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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_99/melt.log

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main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_99.xyz
read_input> Finish reading initial positions
read_input> Validating positions
read_input> Initializing random number generator
read_input> Checking program
read_rgl> START READING FILE ../pot.pot
read_rgl>> END READING FILE ../pot.pot
READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
read_rgl> PARAMETERS SELECTION
FOR IMET1 :: Ag 4
ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
p :: 10.850000000000000 q :: 3.1800000000000002
ATOMIC RADIUS :: 1.4450000999999999
choice_pot> values:
frac = 0.12062503764379931 arete = 4.0870774781009569
choice_pot> mass is== 108.00000000000000 for elem1=
read_input> ntipo1 = 99 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 99 9900
main_MD> Size of nv and nvoiz: 99 9900
main_MD> Number of time-steps (npas) = 50000
main_MD> Number of CVs (num_cv) = 1
main_MD> Max allowed number of atoms = 2900
main_MD> Max number of atoms = 99
main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
main_MD> collvar_wanted = F
main_MD> INPUT AND POTENTIAL FILE READING IS DONE
main_MD> THERMALIZATION IS STARTING
init> 6.7492436835652786E-002 -2.6216994835201450E-002 -8.8075057840227858E-002 initial drift of cluster / NP1 for coalescence
init> 0.33940762881737829 0.35154484106659434 0.34410637304023162 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8346534378327240E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.31664 -2.57867 -0.07178
force_rgl> df(natom) 1.64749 -0.21905 -1.64670
preparo> THERMALIZATION PROCESS AT 291.84265262447764
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -253.17419812059802 2.9414760614119984 -256.11567418201003 3.8141340567609416E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
MELTING PROCESS: loop number 1 T-loop= 317.00000000000000
main_MD> interactions number 1 at Temperature= 317.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.79977 -1.68687 -1.14480
force_rgl> df(natom) 0.35707 0.85904 -0.71858
5.0000 -256.73323 -252.69120 4.04203 1.83711 -252.73494 300.24233
10.0000 -256.28303 -252.20953 4.07350 1.86164 -252.21001 319.13856
15.0000 -256.32351 -251.42466 4.89886 1.86445 -252.14980 319.78159
20.0000 -256.41484 -252.29246 4.12238 1.87662 -251.88946 329.89155
25.0000 -255.84235 -251.68101 4.16134 1.87481 -251.92816 328.00221
30.0000 -256.96861 -252.37318 4.59543 1.87035 -252.02352 323.48288
35.0000 -257.13973 -253.02876 4.11097 1.84313 -252.60612 306.92896
40.0000 -256.39761 -252.75804 3.63957 1.84297 -252.60951 305.65065
45.0000 -255.85163 -251.49898 4.35265 1.85500 -252.35206 316.74196
50.0000 -256.45991 -252.69081 3.76910 1.87645 -251.89314 332.34479
55.0000 -256.24058 -251.85743 4.38316 1.85691 -252.31131 315.18251
60.0000 -255.70830 -252.03024 3.67806 1.87477 -251.92898 328.00512
65.0000 -256.48390 -252.52953 3.95437 1.86587 -252.11939 321.67643
70.0000 -255.90226 -252.04119 3.86107 1.86784 -252.07735 323.71992
75.0000 -256.76349 -252.55089 4.21260 1.84562 -252.55291 307.95500
80.0000 -256.51218 -252.39480 4.11738 1.86113 -252.22090 317.03205
85.0000 -256.16250 -251.60573 4.55677 1.86022 -252.24030 320.76987
90.0000 -255.79215 -251.79771 3.99445 1.87614 -251.89965 329.34987
95.0000 -256.17966 -252.66437 3.51528 1.85518 -252.34826 315.51649
100.0000 -256.54978 -252.81959 3.73019 1.83996 -252.67404 303.09464
105.0000 -256.77790 -252.90084 3.87706 1.83601 -252.75861 299.81682
110.0000 -256.25359 -252.07075 4.18285 1.85279 -252.39931 312.38241
115.0000 -255.63729 -251.72696 3.91034 1.87936 -251.83079 333.32763
120.0000 -256.07621 -252.30745 3.76876 1.87083 -252.01342 323.76316
125.0000 -256.26338 -251.37831 4.88508 1.88811 -251.64347 342.19119
130.0000 -256.32832 -252.05230 4.27602 1.87368 -251.95245 328.95529
135.0000 -256.14626 -251.81865 4.32761 1.87245 -251.97868 325.52416
140.0000 -256.37128 -251.82423 4.54705 1.87174 -251.99393 326.02418
145.0000 -256.16720 -252.06197 4.10523 1.87251 -251.97736 324.07379
150.0000 -255.68874 -252.22153 3.46721 1.85351 -252.38394 310.46303
155.0000 -256.09484 -251.66115 4.43369 1.87902 -251.83806 330.65448
160.0000 -255.96038 -251.92654 4.03383 1.87992 -251.81881 331.83637
165.0000 -256.69847 -252.27980 4.41867 1.87196 -251.98908 325.21879
170.0000 -255.97338 -251.76744 4.20595 1.88315 -251.74973 340.56129
175.0000 -256.44109 -252.07986 4.36122 1.89238 -251.55216 343.50411
180.0000 -256.44461 -252.38763 4.05698 1.83994 -252.67439 303.01736
185.0000 -256.44145 -251.90880 4.53265 1.86943 -252.04330 326.43583
190.0000 -256.32931 -252.29056 4.03875 1.87794 -251.86129 334.16037
195.0000 -256.26369 -251.76985 4.49385 1.87439 -251.93715 330.05176
200.0000 -256.72106 -252.51671 4.20435 1.86222 -252.19753 318.18695
205.0000 -256.22330 -251.80642 4.41689 1.86188 -252.20486 320.10048
210.0000 -256.08182 -252.06148 4.02033 1.87948 -251.82830 332.91981
215.0000 -256.67121 -252.41424 4.25697 1.84475 -252.57148 305.44944
220.0000 -256.46139 -253.02034 3.44105 1.82562 -252.98078 290.81242
225.0000 -256.61922 -252.28063 4.33859 1.83751 -252.72644 300.79088
230.0000 -255.96903 -251.97151 3.99751 1.84806 -252.50072 309.79981
235.0000 -255.85018 -252.04914 3.80103 1.88467 -251.71717 338.82496
240.0000 -256.10198 -252.44292 3.65906 1.84442 -252.57845 300.90971
245.0000 -256.38768 -252.45311 3.93457 1.85807 -252.28649 306.87067
250.0000 -255.99876 -251.58605 4.41270 1.87144 -252.00032 327.69874
MELTING PROCESS: loop number 2 T-loop= 342.00000000000000
main_MD> interactions number 2 at Temperature= 342.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.30751 -0.78306 0.32865
force_rgl> df(natom) 1.18943 -0.14106 1.41974
255.0000 -256.21881 -251.65046 4.56834 1.88204 -251.77352 333.38732
260.0000 -255.29929 -251.23820 4.06109 1.88643 -251.67947 335.07290
265.0000 -255.18598 -250.77038 4.41560 1.92366 -250.88283 368.09574
270.0000 -256.53577 -251.95612 4.57965 1.92006 -250.95981 364.15643
275.0000 -256.45764 -252.00583 4.45181 1.87336 -251.95923 328.42105
280.0000 -255.27590 -250.65251 4.62339 1.90803 -251.21719 352.41859
285.0000 -256.35204 -251.36436 4.98768 1.92466 -250.86142 365.49834
290.0000 -255.56921 -251.31853 4.25068 1.90714 -251.23629 355.36349
295.0000 -255.34860 -251.03234 4.31626 1.89848 -251.42161 347.34205
300.0000 -255.10698 -250.98493 4.12205 1.90560 -251.26932 351.70221
305.0000 -255.96736 -251.55003 4.41733 1.91878 -250.98712 366.20973
310.0000 -256.30282 -251.94131 4.36152 1.90651 -251.24969 357.26296
315.0000 -255.60017 -251.36625 4.23392 1.86302 -252.18055 318.49696
320.0000 -255.55501 -251.16779 4.38723 1.90363 -251.31137 348.39956
325.0000 -256.49369 -252.22788 4.26582 1.88755 -251.65552 337.13965
330.0000 -256.26141 -251.59702 4.66439 1.89140 -251.57304 339.63388
335.0000 -256.56432 -252.50105 4.06327 1.88957 -251.61224 336.97970
340.0000 -256.37029 -251.68323 4.68706 1.87246 -251.97844 330.33661
345.0000 -255.65675 -251.92975 3.72700 1.88000 -251.81717 333.04638
350.0000 -256.44223 -252.37059 4.07165 1.87563 -251.91067 327.43455
355.0000 -255.23256 -250.74271 4.48984 1.88295 -251.75392 335.92069
360.0000 -255.47689 -250.89540 4.58148 1.91994 -250.96240 362.92520
365.0000 -255.64235 -250.80318 4.83917 1.90970 -251.18147 355.46265
370.0000 -255.87948 -251.84223 4.03724 1.91302 -251.11041 356.66985
375.0000 -256.52571 -252.15892 4.36679 1.88341 -251.74423 334.99279
380.0000 -256.43713 -251.98283 4.45429 1.85585 -252.33400 316.19519
385.0000 -256.27593 -251.93655 4.33939 1.88464 -251.71773 336.57422
390.0000 -256.14624 -251.45999 4.68625 1.88946 -251.61463 340.56968
395.0000 -256.11438 -251.46505 4.64933 1.89928 -251.40457 348.08938
400.0000 -256.13637 -251.49625 4.64012 1.89768 -251.43871 348.44681
405.0000 -255.69017 -251.25125 4.43891 1.89506 -251.49486 345.06177
410.0000 -256.53376 -251.92390 4.60986 1.90026 -251.38353 349.22890
415.0000 -256.53501 -252.44129 4.09372 1.85368 -252.38043 315.99350
420.0000 -256.18521 -252.43496 3.75024 1.86578 -252.12147 324.22695
425.0000 -255.92234 -252.31385 3.60849 1.85658 -252.31833 315.66280
430.0000 -255.97773 -250.83461 5.14312 1.89413 -251.51473 346.49432
435.0000 -256.37278 -251.48383 4.88895 1.90872 -251.20249 355.16959
440.0000 -255.79746 -251.59788 4.19958 1.91525 -251.06265 358.88115
445.0000 -255.46083 -251.04399 4.41683 1.90367 -251.31049 351.37277
450.0000 -255.97995 -252.10123 3.87873 1.89893 -251.41197 347.27125
455.0000 -255.87388 -252.21905 3.65483 1.86363 -252.16751 316.60704
460.0000 -255.64803 -250.99493 4.65310 1.89231 -251.55367 342.98998
465.0000 -255.51306 -251.25553 4.25753 1.89333 -251.53176 340.02500
470.0000 -256.06302 -251.84074 4.22227 1.87877 -251.84339 336.35064
475.0000 -256.22832 -251.70760 4.52072 1.86874 -252.05810 326.43436
480.0000 -255.91259 -251.25584 4.65675 1.89624 -251.46950 345.00331
485.0000 -255.46259 -251.11034 4.35224 1.91137 -251.14572 356.73372
490.0000 -255.52798 -250.74196 4.78602 1.94569 -250.41136 384.36237
495.0000 -256.00105 -251.74996 4.25109 1.91256 -251.12040 359.90365
500.0000 -256.01363 -251.37110 4.64253 1.88809 -251.64391 335.91643
MELTING PROCESS: loop number 3 T-loop= 367.00000000000000
main_MD> interactions number 3 at Temperature= 367.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.51860 -1.26540 0.22192
force_rgl> df(natom) -0.06020 0.78737 -0.70148
505.0000 -255.35085 -250.12586 5.22499 1.92724 -250.80623 368.25051
510.0000 -255.58598 -250.74216 4.84383 1.92968 -250.75393 370.40598
515.0000 -256.32469 -251.09748 5.22720 1.92465 -250.86168 367.75345
520.0000 -255.25628 -250.11902 5.13726 1.95884 -250.12986 392.19729
525.0000 -255.98863 -250.99478 4.99385 1.93576 -250.62390 370.94274
530.0000 -255.79177 -251.15490 4.63687 1.90985 -251.17823 355.61946
535.0000 -255.81375 -251.22290 4.59085 1.90384 -251.30685 353.85347
540.0000 -255.10533 -250.07449 5.03084 1.93027 -250.74125 366.73122
545.0000 -255.63855 -249.87796 5.76059 1.97024 -249.88600 398.55343
550.0000 -255.15161 -250.32258 4.82903 1.97199 -249.84838 405.76334
555.0000 -255.67490 -250.71165 4.96325 1.91942 -250.97360 362.20020
560.0000 -254.93219 -250.49545 4.43674 1.93922 -250.54972 378.77262
565.0000 -255.57991 -251.11292 4.46699 1.92927 -250.76275 372.87525
570.0000 -256.47883 -252.40883 4.07000 1.88910 -251.62227 340.03504
575.0000 -256.09073 -251.68758 4.40315 1.86086 -252.22664 317.20961
580.0000 -255.98352 -251.55524 4.42828 1.88165 -251.78183 334.45944
585.0000 -255.73040 -251.83874 3.89166 1.86757 -252.08302 325.76922
590.0000 -256.16471 -251.75452 4.41018 1.87554 -251.91255 328.87830
595.0000 -256.16514 -251.41481 4.75033 1.90141 -251.35892 350.05584
600.0000 -255.48788 -250.69455 4.79333 1.92123 -250.93470 364.21302
605.0000 -255.52651 -250.21213 5.31438 1.94845 -250.35229 382.86522
610.0000 -255.33702 -251.28897 4.04806 1.92393 -250.87703 364.52895
615.0000 -256.04859 -250.74629 5.30230 1.90121 -251.36317 346.95952
620.0000 -255.75201 -250.99549 4.75652 1.92311 -250.89448 364.81999
625.0000 -255.54885 -250.77019 4.77865 1.92858 -250.77737 372.22794
630.0000 -254.84626 -250.40730 4.43895 1.94723 -250.37836 385.96072
635.0000 -255.98628 -251.61832 4.36796 1.92039 -250.95277 365.65480
640.0000 -255.99793 -251.48822 4.50970 1.89877 -251.41548 346.33043
645.0000 -255.15400 -251.29608 3.85792 1.89437 -251.50966 343.40460
650.0000 -255.48842 -250.47280 5.01562 1.92266 -250.90414 367.16047
655.0000 -255.83245 -251.16482 4.66763 1.93158 -250.71332 375.88459
660.0000 -256.17829 -251.40635 4.77194 1.91166 -251.13964 357.34321
665.0000 -255.88401 -251.58813 4.29588 1.90168 -251.35322 350.59531
670.0000 -255.04389 -250.81863 4.22526 1.91821 -250.99945 361.57788
675.0000 -255.97968 -250.84169 5.13799 1.91524 -251.06304 359.05513
680.0000 -255.46808 -250.50752 4.96056 1.92695 -250.81239 366.55469
685.0000 -255.87940 -251.72190 4.15750 1.92487 -250.85686 365.66689
690.0000 -256.07652 -252.00812 4.06841 1.87989 -251.81955 332.29698
695.0000 -256.25302 -252.10899 4.14403 1.85609 -252.32882 316.47746
700.0000 -256.02300 -252.09527 3.92774 1.86638 -252.10851 325.15293
705.0000 -255.97464 -251.55725 4.41739 1.86758 -252.08287 323.28370
710.0000 -256.11814 -251.51790 4.60024 1.89987 -251.39188 348.67172
715.0000 -256.10576 -251.31754 4.78822 1.91122 -251.14903 356.58593
720.0000 -255.36021 -251.47286 3.88735 1.90536 -251.27429 351.88968
725.0000 -255.28837 -250.69385 4.59452 1.91341 -251.10219 358.35198
730.0000 -255.00353 -249.62851 5.37501 1.93676 -250.60245 378.32999
735.0000 -255.08184 -250.26171 4.82013 1.97513 -249.78120 403.72113
740.0000 -255.47582 -250.37076 5.10506 1.96031 -250.09840 392.31104
745.0000 -255.96581 -251.13247 4.83333 1.92068 -250.94658 365.08474
750.0000 -256.70081 -251.74388 4.95693 1.90965 -251.18252 358.17841
MELTING PROCESS: loop number 4 T-loop= 392.00000000000000
main_MD> interactions number 4 at Temperature= 392.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.82171 0.37808 -1.81354
force_rgl> df(natom) -0.54826 -1.47672 0.61668
755.0000 -255.73856 -250.87582 4.86274 1.90714 -251.23629 357.98404
760.0000 -254.39761 -249.54045 4.85716 1.95486 -250.21517 382.79896
765.0000 -254.49197 -249.80218 4.68979 1.98604 -249.54779 409.74377
770.0000 -255.51725 -250.33999 5.17726 1.94909 -250.33852 386.96104
775.0000 -254.87610 -249.45125 5.42485 1.95565 -250.19824 389.74702
780.0000 -254.75814 -249.47274 5.28540 2.01093 -249.01522 433.45034
785.0000 -255.26549 -251.02609 4.23940 1.94534 -250.41882 382.97845
790.0000 -255.18626 -250.78314 4.40312 1.92560 -250.84132 367.36687
795.0000 -256.07631 -250.27130 5.80501 1.94263 -250.47689 384.72229
800.0000 -256.39081 -251.04626 5.34455 1.91027 -251.16921 357.20686
805.0000 -255.63938 -250.63117 5.00822 1.91783 -251.00742 362.72184
810.0000 -255.50543 -250.41128 5.09416 1.93291 -250.68475 377.35562
815.0000 -255.40271 -250.43680 4.96591 1.93304 -250.68197 371.40978
820.0000 -255.23504 -250.04081 5.19423 1.93001 -250.74677 372.82488
825.0000 -254.85451 -249.59861 5.25590 1.97433 -249.79833 406.38179
830.0000 -255.09935 -250.37100 4.72834 1.95989 -250.10747 393.85826
835.0000 -255.43922 -249.84373 5.59548 1.95477 -250.21695 387.98107
840.0000 -255.24915 -250.51876 4.73039 1.94657 -250.39253 379.06308
845.0000 -254.13018 -248.49041 5.63977 1.99523 -249.35107 420.15662
850.0000 -255.14553 -249.21873 5.92680 2.03452 -248.51031 444.69187
855.0000 -254.65640 -249.49350 5.16290 1.98633 -249.54166 410.59264
860.0000 -255.00350 -250.35243 4.65108 1.97339 -249.81854 391.98298
865.0000 -255.19166 -249.86711 5.32455 1.94796 -250.36281 378.18322
870.0000 -254.73437 -249.38507 5.34930 1.97097 -249.87023 394.10717
875.0000 -254.92713 -249.74506 5.18207 1.98554 -249.55852 408.70277
880.0000 -254.59709 -249.29424 5.30285 1.98239 -249.62580 410.43284
885.0000 -255.02489 -250.08844 4.93645 1.98527 -249.56423 410.20357
890.0000 -255.16854 -250.08279 5.08575 1.95525 -250.20662 389.04632
895.0000 -254.74073 -249.88498 4.85575 1.95629 -250.18446 393.58066
900.0000 -255.09070 -249.94744 5.14326 1.98228 -249.62832 413.59245
905.0000 -255.19143 -250.53505 4.65638 1.95313 -250.25204 385.35140
910.0000 -254.88292 -250.58426 4.29866 1.94371 -250.45374 378.69230
915.0000 -255.83346 -251.44685 4.38661 1.91713 -251.02258 357.32950
920.0000 -255.00161 -250.88713 4.11448 1.91642 -251.03774 361.24445
925.0000 -254.52630 -249.19264 5.33366 1.96810 -249.93167 395.62774
930.0000 -255.12493 -250.05848 5.06645 1.99395 -249.37849 419.60694
935.0000 -254.60320 -248.87930 5.72389 1.99003 -249.46250 417.21522
940.0000 -255.19155 -249.68368 5.50787 1.99452 -249.36641 414.21307
945.0000 -255.03472 -249.61196 5.42276 1.96718 -249.95142 399.07403
950.0000 -255.21508 -249.61832 5.59676 1.97718 -249.73748 406.50002
955.0000 -255.75097 -250.01112 5.73985 1.96584 -249.98015 399.67934
960.0000 -255.17147 -250.05371 5.11777 1.97225 -249.84298 409.04873
965.0000 -255.36719 -250.14217 5.22502 1.97202 -249.84791 401.53756
970.0000 -254.79263 -249.71305 5.07958 1.97194 -249.84959 398.16637
975.0000 -255.30882 -249.94689 5.36193 1.97945 -249.68888 408.86350
980.0000 -255.30423 -251.12355 4.18068 1.92297 -250.89758 366.15136
985.0000 -255.28749 -249.95657 5.33091 1.93897 -250.55514 381.20702
990.0000 -255.70395 -250.41261 5.29134 1.94260 -250.47741 379.67607
995.0000 -254.62499 -249.78528 4.83971 1.96068 -250.09051 395.71237
1000.0000 -255.78879 -250.55669 5.23210 1.98135 -249.64817 406.10741
MELTING PROCESS: loop number 5 T-loop= 417.00000000000000
main_MD> interactions number 5 at Temperature= 417.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55897 -1.37845 -0.80123
force_rgl> df(natom) -0.58990 0.16551 -0.93879
1005.0000 -254.23493 -249.45533 4.77960 1.97248 -249.83803 402.60781
1010.0000 -254.85870 -249.94130 4.91741 1.98964 -249.47083 412.88111
1015.0000 -255.15105 -250.16699 4.98406 1.95443 -250.22431 389.97036
1020.0000 -255.31685 -249.40903 5.90783 2.00030 -249.24260 426.67989
1025.0000 -255.25833 -249.93560 5.32273 1.99621 -249.33007 420.56489
1030.0000 -254.74467 -249.80331 4.94136 1.97031 -249.88451 406.32029
1035.0000 -255.02719 -248.68424 6.34295 2.00934 -249.04911 431.95944
1040.0000 -254.78872 -249.14945 5.63927 2.01244 -248.98275 431.07872
1045.0000 -255.36572 -250.42589 4.93983 1.98328 -249.60676 410.13764
1050.0000 -254.89240 -249.72450 5.16789 1.94714 -250.38034 382.30554
1055.0000 -254.52138 -249.72556 4.79582 1.96148 -250.07343 397.98010
1060.0000 -254.50728 -248.84050 5.66678 1.99887 -249.27332 422.17142
1065.0000 -254.29731 -248.63592 5.66139 2.01398 -248.94989 435.66657
1070.0000 -254.25562 -248.41923 5.83639 2.03696 -248.45806 450.95843
1075.0000 -254.94518 -248.26792 6.67726 2.04158 -248.35932 454.64293
1080.0000 -254.38293 -247.98375 6.39918 2.06648 -247.82631 473.80820
1085.0000 -254.94745 -249.40134 5.54611 2.01105 -249.01253 435.76490
1090.0000 -254.44048 -248.97346 5.46702 1.99700 -249.31332 423.04059
1095.0000 -254.69444 -248.72607 5.96837 2.01183 -248.99583 433.50351
1100.0000 -254.42016 -248.76816 5.65200 2.03065 -248.59317 446.74545
1105.0000 -254.38807 -249.49244 4.89563 1.99716 -249.30973 423.39928
1110.0000 -254.56524 -249.28463 5.28061 2.00095 -249.22862 427.46073
1115.0000 -255.12660 -249.09523 6.03137 2.00904 -249.05548 431.98104
1120.0000 -255.25513 -249.35463 5.90051 2.00728 -249.09319 431.48454
1125.0000 -255.01694 -249.35932 5.65762 1.98084 -249.65910 410.15171
1130.0000 -254.36408 -249.06291 5.30117 1.99836 -249.28413 426.79934
1135.0000 -255.01940 -249.92792 5.09149 1.99200 -249.42022 418.03189
1140.0000 -255.25907 -250.20567 5.05340 1.96080 -250.08794 395.29753
1145.0000 -254.97951 -249.76783 5.21168 1.98766 -249.51315 415.07294
1150.0000 -254.27736 -248.73694 5.54043 2.00365 -249.17085 425.30221
1155.0000 -253.72386 -248.05521 5.66866 2.05158 -248.14517 460.99941
1160.0000 -254.83690 -249.11007 5.72683 2.00988 -249.03761 430.26077
1165.0000 -255.01022 -249.39819 5.61203 2.00233 -249.19909 424.20694
1170.0000 -254.56045 -249.24247 5.31798 1.98476 -249.57511 413.90421
1175.0000 -255.32700 -250.07675 5.25026 1.98340 -249.60439 409.13129
1180.0000 -255.31394 -249.85502 5.45892 1.96054 -250.09345 394.97201
1185.0000 -254.20781 -248.45692 5.75089 2.01042 -249.02595 436.46451
1190.0000 -253.73405 -248.28458 5.44947 2.02701 -248.67097 442.19727
1195.0000 -255.43823 -250.01749 5.42074 2.00038 -249.24096 426.77080
1200.0000 -255.14956 -250.27243 4.87713 1.97449 -249.79488 410.21869
1205.0000 -255.02598 -249.41349 5.61250 1.99162 -249.42835 409.05496
1210.0000 -255.40567 -249.80201 5.60366 2.00507 -249.14053 416.11971
1215.0000 -255.18703 -249.76758 5.41945 1.94937 -250.33248 373.34181
1220.0000 -254.63110 -250.40957 4.22153 1.95751 -250.15837 383.37323
1225.0000 -254.60586 -249.41296 5.19290 1.97561 -249.77110 402.28952
1230.0000 -255.16199 -250.59209 4.56991 1.95244 -250.26683 393.32409
1235.0000 -254.64628 -250.25661 4.38968 1.93934 -250.54722 379.56526
1240.0000 -255.24456 -250.55795 4.68661 1.94558 -250.41368 382.23217
1245.0000 -255.19085 -249.89428 5.29658 1.93604 -250.61776 377.37939
1250.0000 -254.69421 -249.56749 5.12672 1.96521 -249.99356 397.68777
MELTING PROCESS: loop number 6 T-loop= 442.00000000000000
main_MD> interactions number 6 at Temperature= 442.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.19008 -2.72866 3.45875
force_rgl> df(natom) 0.18612 0.49995 -1.40757
1255.0000 -254.27306 -249.16761 5.10545 1.97785 -249.72303 411.94410
1260.0000 -253.49076 -248.90563 4.58513 1.99429 -249.37129 426.39252
1265.0000 -254.41567 -249.33750 5.07817 2.00301 -249.18463 423.62243
1270.0000 -255.14795 -249.60610 5.54185 1.99281 -249.40298 417.61713
1275.0000 -254.90002 -248.91596 5.98406 2.00720 -249.09498 428.27911
1280.0000 -253.16644 -247.49148 5.67496 2.03604 -248.47777 449.28936
1285.0000 -254.80490 -248.70681 6.09809 2.05385 -248.09661 458.62970
1290.0000 -253.51260 -247.36626 6.14634 2.06471 -247.86421 476.33523
1295.0000 -253.57065 -247.51232 6.05833 2.06470 -247.86453 469.90977
1300.0000 -254.47107 -249.01915 5.45192 2.05551 -248.06105 466.79260
1305.0000 -254.36848 -247.97759 6.39089 2.03660 -248.46574 450.77468
1310.0000 -253.92602 -248.45646 5.46956 2.04357 -248.31671 453.49540
1315.0000 -255.38360 -249.39741 5.98619 2.02999 -248.60714 437.27942
1320.0000 -254.04884 -249.23200 4.81683 2.00467 -249.14914 418.21669
1325.0000 -254.97417 -249.52766 5.44651 2.00369 -249.17017 419.56733
1330.0000 -254.79304 -249.47204 5.32100 2.00798 -249.07820 424.72857
1335.0000 -255.25887 -249.41583 5.84305 1.99321 -249.39442 413.06729
1340.0000 -254.15389 -248.68094 5.47295 2.02765 -248.65728 435.23665
1345.0000 -254.76252 -248.29727 6.46524 2.02107 -248.79807 436.43320
1350.0000 -254.08479 -248.48100 5.60379 2.04039 -248.38474 441.53211
1355.0000 -254.17663 -248.96116 5.21547 2.03034 -248.59972 442.30830
1360.0000 -253.83614 -248.61173 5.22442 2.02540 -248.70546 434.26011
1365.0000 -253.23306 -247.78951 5.44355 2.05987 -247.96781 462.38384
1370.0000 -254.45455 -249.59985 4.85469 2.02675 -248.67662 433.28758
1375.0000 -254.16421 -249.03359 5.13062 1.99112 -249.43919 407.49820
1380.0000 -254.67637 -249.69185 4.98452 1.98973 -249.46881 407.29091
1385.0000 -254.73089 -248.16822 6.56267 2.01780 -248.86805 423.43846
1390.0000 -254.70509 -248.46473 6.24036 2.03697 -248.45783 440.39768
1395.0000 -253.65033 -248.01823 5.63210 2.04454 -248.29587 447.13141
1400.0000 -253.77153 -248.29786 5.47367 2.06309 -247.89890 464.69569
1405.0000 -254.41831 -247.94264 6.47567 2.04290 -248.33096 454.37282
1410.0000 -252.92561 -247.71085 5.21477 2.06611 -247.83432 468.73962
1415.0000 -254.17487 -247.95652 6.21835 2.06158 -247.93126 471.05713
1420.0000 -253.79597 -247.95018 5.84580 2.04898 -248.20095 447.52807
1425.0000 -253.96520 -247.42349 6.54170 2.06113 -247.94090 466.15069
1430.0000 -255.82575 -249.90899 5.91676 1.99856 -249.27988 415.68378
1435.0000 -253.80163 -248.66275 5.13888 1.97229 -249.84208 394.37551
1440.0000 -254.47150 -248.39684 6.07466 2.01698 -248.88565 432.35079
1445.0000 -253.48305 -246.64214 6.84091 2.06578 -247.84127 467.57228
1450.0000 -254.19365 -248.12158 6.07207 2.06630 -247.83027 463.29243
1455.0000 -254.92762 -248.75808 6.16953 2.03746 -248.44733 453.61863
1460.0000 -254.08341 -248.18378 5.89963 2.04056 -248.38111 453.05860
1465.0000 -253.80345 -247.88161 5.92184 2.05657 -248.03834 462.87616
1470.0000 -254.13327 -248.89574 5.23753 2.03382 -248.52524 443.79477
1475.0000 -253.54370 -247.86412 5.67959 2.05696 -248.03018 463.85271
1480.0000 -254.52435 -248.35473 6.16962 2.03602 -248.47828 451.70212
1485.0000 -253.11427 -247.06380 6.05047 2.04453 -248.29602 454.36288
1490.0000 -254.07863 -248.19695 5.88168 2.08715 -247.38403 484.74603
1495.0000 -253.46553 -247.43278 6.03275 2.05793 -248.00929 465.69636
1500.0000 -254.78446 -249.16367 5.62079 2.05494 -248.07329 465.38885
MELTING PROCESS: loop number 7 T-loop= 467.00000000000000
main_MD> interactions number 7 at Temperature= 467.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66700 1.11113 0.43403
force_rgl> df(natom) -0.22436 0.01171 -0.43361
1505.0000 -254.50885 -248.54579 5.96305 2.02725 -248.66583 444.68968
1510.0000 -254.95771 -249.53075 5.42697 2.00900 -249.05641 428.12364
1515.0000 -254.68342 -249.28970 5.39371 1.98933 -249.47728 418.44737
1520.0000 -253.66581 -247.17850 6.48732 2.05990 -247.96715 466.83814
1525.0000 -252.79515 -247.73538 5.05978 2.09386 -247.24031 491.94061
1530.0000 -253.59525 -247.14620 6.44905 2.06181 -247.92626 475.27677
1535.0000 -254.26000 -249.00384 5.25616 2.05957 -247.97411 466.96160
1540.0000 -253.97061 -248.56734 5.40327 2.01662 -248.89339 433.85952
1545.0000 -254.19304 -248.53706 5.65598 2.03454 -248.50977 443.03385
1550.0000 -253.65646 -248.03602 5.62044 2.03049 -248.59651 436.61817
1555.0000 -253.78284 -247.97168 5.81116 2.04080 -248.37592 449.03332
1560.0000 -252.78312 -247.43520 5.34791 2.08298 -247.47324 478.21925
1565.0000 -254.15801 -247.19149 6.96652 2.09364 -247.24514 478.24486
1570.0000 -252.61750 -246.92369 5.69381 2.09162 -247.28835 484.18331
1575.0000 -253.37823 -247.90611 5.47212 2.07069 -247.73625 464.06875
1580.0000 -254.14744 -248.36886 5.77858 2.05239 -248.12777 456.42421
1585.0000 -253.27177 -247.97217 5.29960 2.05529 -248.06585 453.52786
1590.0000 -253.90725 -247.65399 6.25326 2.08165 -247.50173 475.02039
1595.0000 -253.88394 -247.69161 6.19233 2.05189 -248.13856 453.93895
1600.0000 -254.20829 -248.50603 5.70226 2.03458 -248.50896 428.17024
1605.0000 -254.49149 -247.90006 6.59143 2.03440 -248.51285 434.53819
1610.0000 -254.77140 -248.72483 6.04658 2.05246 -248.12642 459.42787
1615.0000 -255.46613 -248.95988 6.50625 2.01565 -248.91404 453.99102
1620.0000 -253.46254 -247.96234 5.50020 2.02826 -248.64427 468.77563
1625.0000 -253.74384 -247.96496 5.77888 2.08365 -247.45884 503.95087
1630.0000 -253.25669 -247.56288 5.69381 2.08311 -247.47041 501.48281
1635.0000 -254.19696 -247.44592 6.75104 2.08005 -247.53603 502.81879
1640.0000 -255.30074 -249.93144 5.36930 2.02361 -248.74371 469.56775
1645.0000 -255.12719 -249.42810 5.69909 1.98798 -249.50618 436.53997
1650.0000 -254.92725 -248.37866 6.54859 2.00331 -249.17820 453.42512
1655.0000 -254.90635 -248.63972 6.26663 2.06514 -247.85495 497.69087
1660.0000 -254.59775 -249.39868 5.19907 2.00845 -249.06825 453.85606
1665.0000 -254.83326 -248.72903 6.10423 2.02419 -248.73144 464.02152
1670.0000 -253.94592 -246.42026 7.52566 2.07592 -247.62441 496.31111
1675.0000 -253.87781 -248.03059 5.84723 2.09459 -247.22487 513.91547
1680.0000 -253.66090 -247.63039 6.03052 2.08363 -247.45929 488.87526
1685.0000 -254.16118 -248.78412 5.37706 2.03780 -248.44010 451.54556
1690.0000 -255.05765 -249.37492 5.68273 2.00866 -249.06372 426.12747
1695.0000 -253.87020 -248.15591 5.71428 2.04486 -248.28898 454.35614
1700.0000 -254.48237 -248.70765 5.77471 2.05101 -248.15748 460.69074
1705.0000 -254.14353 -247.54438 6.59915 2.03176 -248.56942 444.05373
1710.0000 -255.26069 -248.84670 6.41399 2.03374 -248.52699 473.93114
1715.0000 -253.99171 -248.10238 5.88933 2.04132 -248.36478 489.40094
1720.0000 -254.21207 -247.87046 6.34161 2.05455 -248.08170 498.43400
1725.0000 -254.85956 -249.69108 5.16848 2.03175 -248.56956 481.78566
1730.0000 -254.91403 -249.42334 5.49069 1.98267 -249.61997 443.60833
1735.0000 -254.76415 -248.62869 6.13546 2.00517 -249.13841 456.64490
1740.0000 -254.05077 -247.81560 6.23517 2.04506 -248.28476 484.74449
1745.0000 -255.43318 -248.48486 6.94832 2.06278 -247.90557 489.66784
1750.0000 -254.48893 -247.94145 6.54748 2.06806 -247.79263 505.13783
MELTING PROCESS: loop number 8 T-loop= 492.00000000000000
main_MD> interactions number 8 at Temperature= 492.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.69192 1.94874 2.00666
force_rgl> df(natom) 0.53621 1.57145 0.37861
1755.0000 -253.55144 -247.23637 6.31506 2.07193 -247.70970 505.67116
1760.0000 -254.75513 -248.36385 6.39128 2.07039 -247.74260 509.05795
1765.0000 -254.70198 -249.03135 5.67063 2.03531 -248.49334 474.02142
1770.0000 -254.66976 -248.83933 5.83043 1.99283 -249.40245 455.41539
1775.0000 -255.75185 -249.74143 6.01042 2.02215 -248.77495 473.54836
1780.0000 -254.67469 -248.30116 6.37353 2.04594 -248.26593 488.60009
1785.0000 -254.58591 -248.16598 6.41993 2.03701 -248.45697 487.85724
1790.0000 -255.44651 -249.02225 6.42426 2.03511 -248.49768 473.58199
1795.0000 -254.16487 -248.12356 6.04131 2.04474 -248.29169 486.72318
1800.0000 -253.69199 -247.16522 6.52677 2.08050 -247.52637 503.83365
1805.0000 -254.03318 -247.82144 6.21174 2.08130 -247.50926 505.36352
1810.0000 -254.56902 -249.10133 5.46769 2.01975 -248.82631 449.45148
1815.0000 -254.69502 -249.00955 5.68547 2.00952 -249.04530 451.00610
1820.0000 -255.11923 -249.78409 5.33513 1.99631 -249.32807 456.31840
1825.0000 -254.08708 -248.26731 5.81978 1.98976 -249.46813 456.09517
1830.0000 -253.83233 -247.01215 6.82017 2.08524 -247.42497 521.23425
1835.0000 -254.21161 -247.70180 6.50980 2.06757 -247.80295 511.60282
1840.0000 -254.50231 -247.91268 6.58963 2.07716 -247.59772 512.49493
1845.0000 -254.20255 -248.40589 5.79666 2.05315 -248.11152 491.93460
1850.0000 -254.14175 -247.85507 6.28668 2.04133 -248.36460 489.18416
1855.0000 -253.59115 -247.12696 6.46420 2.06117 -247.93993 504.90168
1860.0000 -253.78444 -247.78983 5.99461 2.08909 -247.34255 527.45250
1865.0000 -253.94424 -247.93403 6.01021 2.07625 -247.61728 516.81446
1870.0000 -255.36606 -248.93117 6.43489 2.02207 -248.77683 479.28467
1875.0000 -254.45056 -248.01842 6.43214 2.03007 -248.60562 482.92142
1880.0000 -253.56366 -247.98196 5.58170 2.06859 -247.78126 504.85574
1885.0000 -255.05288 -247.60310 7.44978 2.07338 -247.67865 511.60491
1890.0000 -254.89536 -249.44362 5.45174 2.02844 -248.64037 485.01183
1895.0000 -255.00979 -248.68538 6.32442 2.00976 -249.04025 466.70108
1900.0000 -254.49797 -248.11940 6.37856 2.01720 -248.88106 471.31836
1905.0000 -253.57197 -247.15319 6.41878 2.05905 -247.98527 499.54314
1910.0000 -253.85786 -246.10887 7.74898 2.11966 -246.68823 546.92687
1915.0000 -255.47367 -247.78274 7.69092 2.08307 -247.47137 517.53401
1920.0000 -254.71134 -249.04879 5.66255 2.03472 -248.50604 494.16041
1925.0000 -255.14692 -248.22742 6.91950 2.03332 -248.53601 478.43464
1930.0000 -254.99664 -248.85498 6.14166 2.03126 -248.58006 487.46706
1935.0000 -255.50104 -249.12968 6.37136 2.03096 -248.58654 484.99772
1940.0000 -255.27805 -248.88542 6.39263 2.00889 -249.05877 465.07838
1945.0000 -254.52175 -248.99026 5.53148 1.99728 -249.30719 459.96216
1950.0000 -255.37209 -248.68052 6.69157 2.00971 -249.04120 468.11425
1955.0000 -253.35099 -246.35582 6.99517 2.09982 -247.11290 527.11878
1960.0000 -253.20497 -247.18623 6.01874 2.10412 -247.02083 529.48440
1965.0000 -253.83210 -246.18865 7.64345 2.11104 -246.87270 545.91892
1970.0000 -254.14820 -247.17760 6.97059 2.12941 -246.47968 547.64163
1975.0000 -254.00365 -247.93966 6.06399 2.06311 -247.89849 502.84880
1980.0000 -254.19439 -247.21126 6.98313 2.03504 -248.49926 480.88858
1985.0000 -253.40857 -247.08988 6.31869 2.06896 -247.77327 507.05744
1990.0000 -254.10455 -247.12453 6.98002 2.09184 -247.28372 523.30504
1995.0000 -254.79503 -248.60919 6.18584 2.05417 -248.08977 504.36813
2000.0000 -255.54639 -249.43483 6.11155 2.00452 -249.15230 467.66042
MELTING PROCESS: loop number 9 T-loop= 517.00000000000000
main_MD> interactions number 9 at Temperature= 517.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.41237 -0.62629 2.05340
force_rgl> df(natom) -0.01875 -1.26314 -0.14705
2005.0000 -254.30135 -248.07431 6.22705 2.02820 -248.64553 484.83616
2010.0000 -254.39426 -248.06840 6.32586 2.03687 -248.45999 486.82620
2015.0000 -254.68258 -248.18218 6.50040 2.07624 -247.61742 519.21904
2020.0000 -254.71634 -248.79818 5.91816 2.05190 -248.13827 499.87912
2025.0000 -254.75873 -248.97771 5.78102 2.03531 -248.49344 489.10938
2030.0000 -254.87142 -249.20124 5.67017 2.01938 -248.83439 476.60829
2035.0000 -254.61903 -248.72398 5.89505 2.00001 -249.24882 459.29884
2040.0000 -253.46450 -246.37063 7.09387 2.07696 -247.60217 515.53200
2045.0000 -253.24798 -246.54689 6.70108 2.13958 -246.26186 561.18675
2050.0000 -254.48098 -248.33266 6.14832 2.07934 -247.55110 517.69755
2055.0000 -254.47311 -247.39493 7.07818 2.04571 -248.27082 487.37224
2060.0000 -254.67792 -247.51914 7.15878 2.05788 -248.01038 497.42995
2065.0000 -253.84884 -246.76468 7.08416 2.09535 -247.20854 530.83605
2070.0000 -255.12775 -247.94787 7.17988 2.08306 -247.47150 518.90148
2075.0000 -253.41786 -246.58768 6.83018 2.10296 -247.04571 528.70261
2080.0000 -253.41130 -246.94325 6.46805 2.11393 -246.81085 539.16737
2085.0000 -253.10893 -247.11542 5.99351 2.09729 -247.16704 516.45315
2090.0000 -254.33594 -247.32709 7.00885 2.09607 -247.19313 523.42924
2095.0000 -253.38539 -246.77802 6.60737 2.08226 -247.48871 515.42105
2100.0000 -253.97443 -246.77261 7.20182 2.11805 -246.72261 537.05677
2105.0000 -254.86522 -247.81539 7.04983 2.09619 -247.19047 529.30079
2110.0000 -254.19376 -248.14242 6.05134 2.04188 -248.35279 492.68627
2115.0000 -254.49718 -246.92408 7.57310 2.07962 -247.54510 513.24156
2120.0000 -252.79867 -245.37950 7.41917 2.13819 -246.29180 558.50891
2125.0000 -254.69770 -247.12634 7.57136 2.14201 -246.20996 558.73340
2130.0000 -253.58247 -247.81613 5.76634 2.07350 -247.67606 512.77698
2135.0000 -253.58796 -247.81768 5.77028 2.06327 -247.89497 506.46718
2140.0000 -253.76545 -246.84803 6.91743 2.06953 -247.76105 512.41136
2145.0000 -253.55332 -246.79333 6.75999 2.10325 -247.03935 527.73133
2150.0000 -253.27768 -246.72170 6.55598 2.13032 -246.46016 556.02089
2155.0000 -253.73675 -247.06879 6.66796 2.08816 -247.36246 527.58739
2160.0000 -253.21640 -246.97002 6.24638 2.12056 -246.66899 549.53659
2165.0000 -253.34214 -246.67856 6.66358 2.12497 -246.57453 544.82403
2170.0000 -254.57577 -248.71365 5.86212 2.07320 -247.68263 498.09351
2175.0000 -253.92494 -247.56166 6.36328 2.03338 -248.53468 485.19310
2180.0000 -253.84467 -247.20612 6.63856 2.09997 -247.10955 529.42351
2185.0000 -253.82807 -246.94387 6.88420 2.09267 -247.26594 530.08555
2190.0000 -253.93372 -247.02894 6.90478 2.12343 -246.60755 551.96495
2195.0000 -253.88531 -247.91185 5.97345 2.08062 -247.52379 521.09338
2200.0000 -254.37766 -248.01349 6.36417 2.07932 -247.55162 514.60356
2205.0000 -253.88379 -246.75916 7.12464 2.10169 -247.07275 524.41847
2210.0000 -254.49524 -247.70240 6.79284 2.10994 -246.89637 535.87143
2215.0000 -253.73359 -247.03737 6.69621 2.08986 -247.32593 518.50756
2220.0000 -254.26178 -248.34794 5.91385 2.08167 -247.50125 518.98810
2225.0000 -254.93608 -248.82385 6.11223 2.02130 -248.79315 479.15819
2230.0000 -254.39993 -247.94749 6.45244 2.04053 -248.38176 492.46094
2235.0000 -255.45874 -248.59531 6.86342 2.04910 -248.19819 494.66345
2240.0000 -254.03371 -247.42699 6.60672 2.07173 -247.71394 512.31453
2245.0000 -254.10637 -247.07630 7.03007 2.08856 -247.35378 521.99685
2250.0000 -253.39986 -246.38204 7.01783 2.10789 -246.94016 541.22680
MELTING PROCESS: loop number 10 T-loop= 542.00000000000000
main_MD> interactions number 10 at Temperature= 542.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79694 -0.17314 -2.99615
force_rgl> df(natom) -0.07578 1.81843 -2.14842
2255.0000 -253.68677 -246.36974 7.31703 2.14884 -246.06380 557.27969
2260.0000 -253.70920 -246.77221 6.93699 2.12562 -246.56063 551.78211
2265.0000 -253.87894 -246.88113 6.99781 2.09417 -247.23379 529.60351
2270.0000 -253.41396 -246.13003 7.28393 2.14471 -246.15227 551.78430
2275.0000 -254.15041 -248.05644 6.09397 2.08422 -247.44662 518.94377
2280.0000 -253.29133 -245.89405 7.39727 2.13459 -246.36878 550.31964
2285.0000 -254.10661 -247.22128 6.88532 2.09953 -247.11911 527.05202
2290.0000 -253.91172 -247.44584 6.46588 2.08412 -247.44877 507.72301
2295.0000 -253.33834 -246.29110 7.04724 2.09289 -247.26111 525.54623
2300.0000 -252.51734 -245.31835 7.19899 2.18409 -245.30943 583.95923
2305.0000 -253.62081 -246.20277 7.41804 2.16808 -245.65205 564.47182
2310.0000 -253.90850 -246.31308 7.59542 2.13782 -246.29972 549.90409
2315.0000 -253.17410 -247.55204 5.62206 2.13341 -246.39392 550.79457
2320.0000 -254.07194 -248.17616 5.89578 2.07981 -247.54102 521.94551
2325.0000 -254.35207 -246.29376 8.05830 2.10464 -247.00962 532.94361
2330.0000 -251.76543 -244.60607 7.15936 2.17325 -245.54145 574.98381
2335.0000 -253.19894 -246.73278 6.46616 2.20017 -244.96538 573.93456
2340.0000 -253.95535 -246.15583 7.79953 2.13406 -246.38000 544.69791
2345.0000 -252.45488 -245.42933 7.02555 2.16418 -245.73554 577.32669
2350.0000 -251.79254 -244.83841 6.95414 2.18078 -245.38033 583.26327
2355.0000 -251.69562 -244.21042 7.48521 2.22629 -244.40623 577.52818
2360.0000 -252.44314 -244.93217 7.51097 2.22404 -244.45442 595.17469
2365.0000 -254.10394 -247.38297 6.72097 2.12805 -246.50874 525.13015
2370.0000 -252.89466 -246.72061 6.17405 2.08482 -247.43381 523.26209
2375.0000 -253.18260 -246.91584 6.26677 2.12602 -246.55218 538.50676
2380.0000 -253.05166 -246.62819 6.42347 2.12627 -246.54685 533.75164
2385.0000 -252.91807 -244.29256 8.62551 2.14824 -246.07673 557.46437
2390.0000 -253.26844 -245.81844 7.45000 2.17980 -245.40123 585.15437
2395.0000 -253.43515 -247.14197 6.29318 2.12409 -246.59339 519.15371
2400.0000 -253.09896 -245.34200 7.75695 2.16762 -245.66197 552.55583
2405.0000 -252.68232 -246.16182 6.52050 2.17273 -245.55247 560.81681
2410.0000 -253.04122 -245.56129 7.47992 2.15184 -245.99962 558.11703
2415.0000 -252.96673 -246.37605 6.59068 2.15679 -245.89374 551.51701
2420.0000 -254.06772 -247.63725 6.43047 2.12596 -246.55339 532.37645
2425.0000 -254.01528 -248.29612 5.71915 2.04770 -248.22822 477.93778
2430.0000 -253.35583 -246.23056 7.12527 2.11008 -246.89336 518.76989
2435.0000 -253.73961 -247.29856 6.44105 2.13541 -246.35131 534.26164
2440.0000 -254.34784 -247.40512 6.94271 2.08816 -247.36238 492.86862
2445.0000 -253.46849 -246.53587 6.93262 2.11941 -246.69367 518.57670
2450.0000 -253.61871 -246.67663 6.94208 2.11846 -246.71388 523.49219
2455.0000 -253.75274 -247.86736 5.88538 2.09212 -247.27756 509.50687
2460.0000 -253.26959 -246.63336 6.63623 2.11544 -246.77852 532.08288
2465.0000 -253.43316 -246.54519 6.88797 2.14036 -246.24529 540.72630
2470.0000 -253.34943 -246.63735 6.71208 2.13135 -246.43811 531.30365
2475.0000 -252.99802 -246.11576 6.88226 2.15529 -245.92584 552.23860
2480.0000 -254.49527 -247.35603 7.13925 2.11948 -246.69217 526.81442
2485.0000 -253.71877 -247.18240 6.53637 2.06400 -247.87942 491.39608
2490.0000 -253.77899 -246.48002 7.29897 2.09785 -247.15497 518.61300
2495.0000 -253.32080 -246.97831 6.34250 2.11612 -246.76400 526.04261
2500.0000 -254.88853 -248.37411 6.51442 2.04429 -248.30131 479.37625
MELTING PROCESS: loop number 11 T-loop= 567.00000000000000
main_MD> interactions number 11 at Temperature= 567.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.10928 7.74988 -0.99560
force_rgl> df(natom) 0.10858 -0.55567 1.67218
2505.0000 -252.91503 -246.73324 6.18179 2.08145 -247.50595 503.04121
2510.0000 -252.36086 -245.75277 6.60809 2.14752 -246.09208 530.59781
2515.0000 -252.03785 -244.18395 7.85390 2.23124 -244.30041 595.90067
2520.0000 -252.07544 -244.62512 7.45032 2.22435 -244.44775 579.90760
2525.0000 -251.29152 -243.41620 7.87532 2.25999 -243.68505 608.90387
2530.0000 -250.96736 -243.92793 7.03942 2.23815 -244.15243 559.71984
2535.0000 -251.53705 -243.52640 8.01065 2.27171 -243.43439 561.98628
2540.0000 -250.43357 -242.84738 7.58619 2.27463 -243.37191 583.05563
2545.0000 -249.90397 -242.07309 7.83088 2.30154 -242.79605 585.66604
2550.0000 -250.73899 -243.56468 7.17432 2.34406 -241.88600 613.26481
2555.0000 -249.53748 -242.66473 6.87275 2.29478 -242.94065 558.20405
2560.0000 -248.45540 -242.13643 6.31897 2.33996 -241.97375 586.28675
2565.0000 -250.15647 -242.57779 7.57868 2.35563 -241.63831 588.57268
2570.0000 -249.98525 -243.04651 6.93874 2.29911 -242.84793 578.38570
2575.0000 -250.75442 -243.35648 7.39794 2.29523 -242.93088 564.86115
2580.0000 -250.01790 -243.25089 6.76701 2.25955 -243.69453 549.31639
2585.0000 -250.29719 -243.99518 6.30202 2.25771 -243.73387 540.95334
2590.0000 -251.18139 -243.79817 7.38323 2.25112 -243.87498 536.37623
2595.0000 -251.18777 -243.79436 7.39341 2.28924 -243.05926 554.49006
2600.0000 -251.46653 -244.47645 6.99008 2.22933 -244.34129 555.34023
2605.0000 -251.20450 -244.00090 7.20360 2.23606 -244.19719 577.18227
2610.0000 -249.78932 -242.29102 7.49830 2.30161 -242.79448 596.41465
2615.0000 -250.90657 -243.90515 7.00142 2.27520 -243.35962 577.67923
2620.0000 -250.44782 -243.01168 7.43614 2.28791 -243.08762 558.75928
2625.0000 -250.76262 -242.68102 8.08160 2.33333 -242.11557 588.07071
2630.0000 -251.49395 -243.40616 8.08779 2.28640 -243.11993 588.93303
2635.0000 -250.98888 -244.17884 6.81004 2.24122 -244.08685 541.69775
2640.0000 -251.35943 -243.81723 7.54220 2.26299 -243.62088 569.93837
2645.0000 -250.96250 -244.23760 6.72490 2.23744 -244.16769 544.72760
2650.0000 -251.12516 -244.20226 6.92290 2.23769 -244.16236 532.91522
2655.0000 -250.48019 -242.34997 8.13022 2.28678 -243.11172 549.79919
2660.0000 -250.41791 -242.46254 7.95537 2.31582 -242.49034 584.50304
2665.0000 -249.88267 -242.60312 7.27955 2.33301 -242.12237 588.84496
2670.0000 -248.25003 -241.64303 6.60700 2.32038 -242.39284 567.26792
2675.0000 -249.60072 -241.87419 7.72653 2.36068 -241.53028 618.83998
2680.0000 -248.62672 -241.03883 7.58790 2.34153 -241.94018 605.63662
2685.0000 -249.21134 -242.07445 7.13690 2.35435 -241.66572 611.41599
2690.0000 -250.97987 -242.92888 8.05098 2.33252 -242.13292 617.66027
2695.0000 -250.88823 -244.41664 6.47159 2.24200 -244.07004 546.77378
2700.0000 -250.55429 -242.84821 7.70608 2.28165 -243.22167 563.84060
2705.0000 -250.32917 -243.05450 7.27467 2.29077 -243.02633 602.51563
2710.0000 -250.26679 -243.75809 6.50870 2.27724 -243.31599 565.14908
2715.0000 -251.75841 -245.69741 6.06099 2.20435 -244.87591 512.93844
2720.0000 -252.48939 -245.90488 6.58451 2.19189 -245.14253 521.05272
2725.0000 -251.47863 -244.60698 6.87166 2.18687 -245.24987 537.19910
2730.0000 -251.43913 -243.83861 7.60052 2.25166 -243.86344 571.73549
2735.0000 -252.16386 -245.29410 6.86976 2.22053 -244.52953 557.23908
2740.0000 -252.13835 -244.63611 7.50224 2.22409 -244.45351 547.07590
2745.0000 -251.05853 -243.85615 7.20238 2.23101 -244.30541 530.13577
2750.0000 -249.31660 -242.53538 6.78122 2.27088 -243.45210 556.91224
MELTING PROCESS: loop number 12 T-loop= 592.00000000000000
main_MD> interactions number 12 at Temperature= 592.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.29460 -1.56125 1.78704
force_rgl> df(natom) 5.20949 0.60436 3.21585
2755.0000 -249.27316 -242.00074 7.27241 2.30941 -242.62750 569.84742
2760.0000 -249.78775 -242.61806 7.16969 2.32996 -242.18764 580.46970
2765.0000 -250.13716 -242.85242 7.28474 2.31647 -242.47642 577.55258
2770.0000 -250.77829 -244.62530 6.15299 2.27880 -243.28257 559.50119
2775.0000 -250.99788 -244.72023 6.27766 2.23630 -244.19208 528.64839
2780.0000 -250.20765 -242.79510 7.41255 2.26695 -243.53609 550.69674
2785.0000 -249.15877 -241.19621 7.96257 2.30340 -242.75606 572.04060
2790.0000 -249.76955 -241.00410 8.76546 2.35908 -241.56459 604.99775
2795.0000 -248.39705 -240.35440 8.04266 2.39347 -240.82869 621.21610
2800.0000 -249.90649 -242.74133 7.16516 2.35243 -241.70690 583.33727
2805.0000 -249.81701 -240.78721 9.02980 2.31842 -242.43466 586.50800
2810.0000 -249.89049 -241.82611 8.06438 2.36616 -241.41311 635.45499
2815.0000 -250.77707 -243.28388 7.49319 2.32222 -242.35330 604.92186
2820.0000 -251.30334 -243.56524 7.73810 2.25786 -243.73075 588.41068
2825.0000 -251.93581 -244.13868 7.79712 2.26164 -243.64983 585.90391
2830.0000 -251.52842 -243.75733 7.77110 2.25332 -243.82785 565.25861
2835.0000 -250.60076 -243.99854 6.60222 2.27233 -243.42100 559.98531
2840.0000 -251.79083 -244.61802 7.17282 2.22141 -244.51085 550.76717
2845.0000 -251.79602 -243.78267 8.01335 2.20776 -244.80294 560.60895
2850.0000 -252.17769 -243.59916 8.57852 2.25661 -243.75743 584.89067
2855.0000 -250.42661 -243.53065 6.89595 2.25993 -243.68639 582.98824
2860.0000 -250.80438 -242.93524 7.86914 2.30833 -242.65058 599.19148
2865.0000 -250.96059 -243.01023 7.95036 2.30436 -242.73558 622.28550
2870.0000 -250.58824 -243.14359 7.44465 2.25116 -243.87419 594.49506
2875.0000 -251.62607 -244.77360 6.85247 2.22135 -244.51199 559.59709
2880.0000 -250.15887 -242.26435 7.89453 2.26311 -243.61831 577.25614
2885.0000 -248.58834 -241.17943 7.40892 2.33183 -242.14766 608.84237
2890.0000 -250.13858 -242.31932 7.81926 2.30824 -242.65254 567.13481
2895.0000 -250.19140 -242.76948 7.42192 2.30302 -242.76432 570.29740
2900.0000 -251.05007 -243.29530 7.75477 2.29696 -242.89397 588.10980
2905.0000 -251.01224 -243.64648 7.36577 2.26675 -243.54046 602.50025
2910.0000 -249.68917 -242.22913 7.46004 2.29114 -243.01849 606.83432
2915.0000 -251.75355 -244.00887 7.74468 2.29448 -242.94696 579.43646
2920.0000 -250.41764 -243.57198 6.84567 2.27565 -243.34996 605.15010
2925.0000 -251.32516 -243.21865 8.10651 2.29007 -243.04150 615.94217
2930.0000 -252.61229 -245.90996 6.70233 2.22486 -244.43684 573.18078
2935.0000 -250.60834 -244.15838 6.44996 2.21289 -244.69301 565.50793
2940.0000 -251.22023 -244.33410 6.88613 2.25992 -243.68672 584.23346
2945.0000 -250.01526 -243.27859 6.73667 2.26161 -243.65056 558.88756
2950.0000 -250.19419 -242.03790 8.15629 2.31597 -242.48709 572.40092
2955.0000 -251.19841 -241.67604 9.52237 2.33262 -242.13082 590.77146
2960.0000 -249.49826 -242.82812 6.67014 2.36721 -241.39066 632.20742
2965.0000 -250.14345 -242.80049 7.34296 2.33104 -242.16458 594.33573
2970.0000 -252.54699 -244.09664 8.45034 2.29204 -242.99927 608.26783
2975.0000 -251.14845 -243.34234 7.80610 2.26128 -243.65744 602.96672
2980.0000 -250.57031 -242.55147 8.01884 2.26800 -243.51373 585.72252
2985.0000 -249.87986 -242.30924 7.57062 2.28371 -243.17749 612.09665
2990.0000 -248.91351 -241.76802 7.14549 2.34755 -241.81123 624.83668
2995.0000 -248.36558 -239.63885 8.72673 2.41326 -240.40510 642.03547
3000.0000 -248.40740 -240.07250 8.33490 2.40707 -240.53748 630.17656
MELTING PROCESS: loop number 13 T-loop= 617.00000000000000
main_MD> interactions number 13 at Temperature= 617.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70456 -2.53375 -2.11927
force_rgl> df(natom) -1.46270 -0.22029 1.80075
3005.0000 -248.21231 -240.00173 8.21058 2.43956 -239.84219 660.56432
3010.0000 -248.26660 -240.55386 7.71274 2.42592 -240.13411 632.18156
3015.0000 -248.32615 -240.37518 7.95098 2.42134 -240.23224 643.86755
3020.0000 -248.73426 -240.31603 8.41824 2.43864 -239.86199 653.28167
3025.0000 -248.44652 -241.00229 7.44422 2.37252 -241.27694 604.45508
3030.0000 -248.83889 -240.43001 8.40888 2.38484 -241.01320 605.35191
3035.0000 -249.47331 -241.95489 7.51841 2.41067 -240.46060 659.20817
3040.0000 -248.81056 -240.97311 7.83744 2.39424 -240.81222 646.49334
3045.0000 -248.79790 -241.43435 7.36355 2.34031 -241.96614 604.84881
3050.0000 -249.60879 -241.21832 8.39047 2.37291 -241.26855 625.53466
3055.0000 -249.69178 -241.68180 8.00998 2.37368 -241.25207 623.45055
3060.0000 -248.11244 -239.76822 8.34423 2.40033 -240.68189 635.91715
3065.0000 -248.97545 -242.12192 6.85354 2.37221 -241.28365 581.65886
3070.0000 -248.23386 -239.62955 8.60431 2.34545 -241.85629 597.60921
3075.0000 -248.85934 -241.23219 7.62716 2.41380 -240.39359 642.78448
3080.0000 -249.78240 -241.81183 7.97057 2.36592 -241.41820 605.36714
3085.0000 -250.94340 -243.12541 7.81799 2.34056 -241.96094 593.24157
3090.0000 -250.68136 -242.79094 7.89042 2.30813 -242.65495 567.74020
3095.0000 -249.56975 -240.56620 9.00355 2.34936 -241.77268 588.74534
3100.0000 -249.55973 -241.76915 7.79057 2.36267 -241.48780 633.42870
3105.0000 -247.45376 -239.36969 8.08406 2.36568 -241.42329 609.03767
3110.0000 -248.57326 -241.04659 7.52667 2.42487 -240.15656 644.70994
3115.0000 -248.49579 -240.73404 7.76175 2.41499 -240.36816 634.68423
3120.0000 -248.36852 -240.47259 7.89594 2.42660 -240.11970 639.06685
3125.0000 -249.42886 -241.48199 7.94687 2.38793 -240.94725 622.87979
3130.0000 -249.11925 -240.53419 8.58506 2.38664 -240.97486 633.11021
3135.0000 -249.01725 -240.23784 8.77941 2.38651 -240.97749 631.81917
3140.0000 -249.39548 -241.18091 8.21457 2.42126 -240.23385 650.10949
3145.0000 -249.16344 -241.03370 8.12974 2.38125 -241.09018 610.57631
3150.0000 -248.19958 -241.55674 6.64284 2.38028 -241.11098 605.20751
3155.0000 -248.02364 -238.89956 9.12408 2.42482 -240.15760 633.69863
3160.0000 -247.92573 -240.60583 7.31991 2.48331 -238.90609 678.40003
3165.0000 -248.88505 -241.19051 7.69454 2.36955 -241.34046 594.63689
3170.0000 -248.94463 -241.10818 7.83645 2.39015 -240.89958 620.15209
3175.0000 -249.78994 -241.40249 8.38746 2.36951 -241.34145 612.91747
3180.0000 -249.66994 -241.02368 8.64626 2.39364 -240.82496 624.87515
3185.0000 -248.38955 -239.44945 8.94009 2.39876 -240.71532 626.15222
3190.0000 -248.95419 -240.66455 8.28964 2.40911 -240.49380 640.99469
3195.0000 -248.16525 -240.17494 7.99031 2.40250 -240.63535 646.78772
3200.0000 -248.93439 -240.86306 8.07133 2.37985 -241.12017 639.09887
3205.0000 -248.16666 -240.85973 7.30693 2.38332 -241.04587 630.16658
3210.0000 -248.80048 -241.02661 7.77388 2.37564 -241.21019 613.86907
3215.0000 -249.53400 -241.70885 7.82515 2.38257 -241.06183 632.01175
3220.0000 -250.12749 -242.32829 7.79920 2.33988 -241.97544 620.48888
3225.0000 -250.51320 -242.62462 7.88858 2.32602 -242.27216 586.75455
3230.0000 -248.70648 -241.00787 7.69861 2.34284 -241.91207 587.64316
3235.0000 -248.44768 -239.31317 9.13451 2.39463 -240.80385 611.48216
3240.0000 -247.03067 -239.69273 7.33794 2.44309 -239.76663 643.83737
3245.0000 -249.58225 -240.39527 9.18697 2.42381 -240.17936 648.85233
3250.0000 -248.96543 -240.73129 8.23414 2.42545 -240.14423 661.48451
MELTING PROCESS: loop number 14 T-loop= 642.00000000000000
main_MD> interactions number 14 at Temperature= 642.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.90766 0.70614 1.72197
force_rgl> df(natom) 0.80290 1.31409 2.74442
3255.0000 -247.69229 -239.83381 7.85848 2.42006 -240.25949 641.49919
3260.0000 -249.63267 -241.95657 7.67610 2.40770 -240.52413 654.53685
3265.0000 -250.14632 -240.93949 9.20684 2.36036 -241.53707 621.24841
3270.0000 -249.87013 -241.77142 8.09871 2.37128 -241.30347 631.66966
3275.0000 -250.85858 -242.30499 8.55358 2.34445 -241.87770 616.98847
3280.0000 -250.87716 -242.29049 8.58667 2.33589 -242.06087 632.45418
3285.0000 -251.23214 -242.44920 8.78294 2.31877 -242.42724 631.83408
3290.0000 -251.35925 -242.86193 8.49732 2.30753 -242.66783 637.86649
3295.0000 -249.86949 -242.39240 7.47708 2.28864 -243.07192 592.08476
3300.0000 -249.40153 -241.00517 8.39636 2.37436 -241.23753 644.44390
3305.0000 -248.88480 -239.74673 9.13806 2.42429 -240.16913 663.24050
3310.0000 -247.34464 -238.30477 9.03987 2.48737 -238.81903 666.21203
3315.0000 -248.83332 -240.36342 8.46990 2.44859 -239.64896 642.49235
3320.0000 -246.82005 -238.55306 8.26699 2.46661 -239.26326 660.02761
3325.0000 -248.78590 -240.27716 8.50874 2.45133 -239.59040 641.18849
3330.0000 -249.45999 -240.85169 8.60830 2.39459 -240.80468 657.00281
3335.0000 -247.82661 -239.35414 8.47248 2.41565 -240.35401 657.99029
3340.0000 -247.90365 -240.29588 7.60778 2.43557 -239.92774 646.75342
3345.0000 -249.19058 -240.36072 8.82985 2.43104 -240.02462 645.61645
3350.0000 -249.52460 -241.90817 7.61642 2.38349 -241.04223 623.66399
3355.0000 -248.67124 -241.91415 6.75709 2.33548 -242.06970 604.63033
3360.0000 -249.42087 -241.13624 8.28462 2.35537 -241.64398 613.13310
3365.0000 -248.64368 -240.91751 7.72617 2.36537 -241.42999 613.91391
3370.0000 -248.98286 -241.81817 7.16469 2.36571 -241.42260 612.18200
3375.0000 -249.42115 -240.38091 9.04025 2.37400 -241.24537 604.87392
3380.0000 -248.58484 -240.11641 8.46843 2.40885 -240.49939 634.28248
3385.0000 -248.58228 -240.18719 8.39509 2.38460 -241.01836 623.45570
3390.0000 -248.65985 -240.22335 8.43650 2.44246 -239.78025 679.06834
3395.0000 -249.58593 -240.74447 8.84146 2.40160 -240.65463 649.97863
3400.0000 -248.96686 -240.46345 8.50341 2.38655 -240.97660 640.81731
3405.0000 -248.37697 -241.67360 6.70337 2.41836 -240.29600 653.95867
3410.0000 -248.53164 -240.91644 7.61520 2.36091 -241.52545 606.89570
3415.0000 -248.89215 -240.24803 8.64412 2.42608 -240.13072 665.99091
3420.0000 -249.19207 -241.13826 8.05382 2.42447 -240.16518 661.94328
3425.0000 -249.15954 -240.25028 8.90926 2.40889 -240.49868 643.16694
3430.0000 -247.66731 -239.37249 8.29482 2.43055 -240.03512 636.06367
3435.0000 -247.17896 -239.31301 7.86595 2.47169 -239.15470 658.60904
3440.0000 -249.61815 -240.28769 9.33046 2.43338 -239.97440 663.55264
3445.0000 -246.14883 -238.52748 7.62135 2.46527 -239.29206 672.36138
3450.0000 -248.10989 -238.84120 9.26869 2.48817 -238.80191 676.85180
3455.0000 -246.78638 -238.10886 8.67752 2.51187 -238.29483 710.19436
3460.0000 -249.47726 -239.56864 9.90863 2.48968 -238.76959 706.45163
3465.0000 -247.86868 -238.58627 9.28241 2.44323 -239.76382 685.17006
3470.0000 -247.93358 -240.90089 7.03270 2.43882 -239.85806 673.16734
3475.0000 -249.12956 -241.09222 8.03733 2.35589 -241.63290 633.58728
3480.0000 -249.98431 -241.41585 8.56846 2.37595 -241.20345 633.84095
3485.0000 -249.92866 -240.89265 9.03601 2.36454 -241.44772 605.38987
3490.0000 -248.66746 -239.94454 8.72292 2.43032 -240.04002 660.90105
3495.0000 -247.77389 -240.08126 7.69263 2.43788 -239.87811 663.34545
3500.0000 -249.13187 -239.96066 9.17121 2.41309 -240.40869 667.39258
MELTING PROCESS: loop number 15 T-loop= 667.00000000000000
main_MD> interactions number 15 at Temperature= 667.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.13025 -0.93189 -1.29937
force_rgl> df(natom) -1.29567 1.18824 0.69204
3505.0000 -248.12163 -239.89395 8.22769 2.47132 -239.16257 674.24513
3510.0000 -248.36748 -239.23626 9.13122 2.46143 -239.37420 661.94182
3515.0000 -249.72472 -240.64518 9.07955 2.43399 -239.96153 632.97929
3520.0000 -248.54701 -240.29040 8.25661 2.43367 -239.96837 639.49720
3525.0000 -247.44909 -239.38106 8.06803 2.43238 -239.99585 643.80503
3530.0000 -246.70976 -238.48742 8.22233 2.47563 -239.07023 661.34920
3535.0000 -248.52032 -238.11869 10.40164 2.51840 -238.15498 710.56334
3540.0000 -248.05890 -239.91159 8.14731 2.42746 -240.10113 645.30097
3545.0000 -248.16226 -238.87991 9.28235 2.48642 -238.83948 681.17138
3550.0000 -246.22215 -237.80397 8.41818 2.46884 -239.21558 678.31944
3555.0000 -246.90338 -237.50166 9.40172 2.52756 -237.95909 682.95396
3560.0000 -247.43035 -238.60878 8.82157 2.52950 -237.91757 682.40745
3565.0000 -246.86250 -238.15780 8.70471 2.50559 -238.42927 699.69696
3570.0000 -245.53894 -237.12962 8.40932 2.55599 -237.35069 711.53514
3575.0000 -246.98083 -237.83031 9.15052 2.54135 -237.66399 707.57094
3580.0000 -247.42041 -239.03846 8.38195 2.48936 -238.77660 673.15245
3585.0000 -248.20245 -240.39464 7.80781 2.46246 -239.35223 662.50872
3590.0000 -248.22040 -239.17144 9.04896 2.43049 -240.03642 652.90531
3595.0000 -248.77009 -240.70551 8.06458 2.46617 -239.27275 681.42371
3600.0000 -247.38023 -238.42402 8.95621 2.38231 -241.06735 626.88725
3605.0000 -248.65417 -239.52490 9.12927 2.44135 -239.80403 689.30855
3610.0000 -247.96228 -240.35072 7.61156 2.40679 -240.54353 657.69609
3615.0000 -249.37124 -241.54198 7.82926 2.37056 -241.31886 637.38730
3620.0000 -246.63096 -239.08587 7.54509 2.41752 -240.31387 653.78628
3625.0000 -248.74031 -240.68480 8.05551 2.50036 -238.54101 702.15058
3630.0000 -249.24529 -240.00270 9.24259 2.41345 -240.40092 663.37242
3635.0000 -248.88136 -240.30766 8.57370 2.40038 -240.68076 692.72502
3640.0000 -248.44462 -239.59924 8.84538 2.42169 -240.22473 682.15617
3645.0000 -247.68563 -238.65116 9.03447 2.47525 -239.07854 688.72843
3650.0000 -248.88646 -240.25832 8.62814 2.42792 -240.09143 655.10677
3655.0000 -248.39405 -239.48201 8.91204 2.43311 -239.98024 642.76816
3660.0000 -248.34555 -238.88878 9.45677 2.50105 -238.52623 711.28047
3665.0000 -247.61108 -239.81732 7.79376 2.42997 -240.04742 657.78267
3670.0000 -247.07580 -239.97271 7.10309 2.43953 -239.84293 659.18094
3675.0000 -247.32667 -239.07418 8.25248 2.45449 -239.52279 663.11570
3680.0000 -248.30375 -240.26197 8.04178 2.47687 -239.04381 662.94739
3685.0000 -249.37602 -239.78493 9.59109 2.44176 -239.79521 648.54702
3690.0000 -248.38459 -240.57193 7.81265 2.42925 -240.06278 656.10137
3695.0000 -248.91844 -240.34978 8.56866 2.40526 -240.57639 631.23008
3700.0000 -248.55274 -240.23485 8.31789 2.41783 -240.30723 656.86654
3705.0000 -248.89089 -240.93970 7.95119 2.39549 -240.78528 627.59761
3710.0000 -248.79770 -240.05752 8.74018 2.42491 -240.15580 652.87975
3715.0000 -248.28108 -240.08555 8.19553 2.50331 -238.47806 708.98984
3720.0000 -247.36586 -237.28593 10.07993 2.51475 -238.23312 698.62506
3725.0000 -249.50084 -240.85269 8.64815 2.45934 -239.41895 684.26338
3730.0000 -247.57918 -239.07048 8.50870 2.44738 -239.67499 652.91763
3735.0000 -246.93773 -238.04698 8.89075 2.50447 -238.45315 690.84237
3740.0000 -248.58793 -239.03023 9.55771 2.51177 -238.29696 712.63754
3745.0000 -246.53634 -238.57294 7.96341 2.50395 -238.46426 693.22305
3750.0000 -248.45988 -240.33967 8.12021 2.47046 -239.18093 673.22192
MELTING PROCESS: loop number 16 T-loop= 692.00000000000000
main_MD> interactions number 16 at Temperature= 692.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18676 0.37030 -2.49654
force_rgl> df(natom) -3.59663 3.97563 1.68112
3755.0000 -246.05739 -238.65163 7.40576 2.41724 -240.31987 645.42730
3760.0000 -246.26497 -237.12448 9.14049 2.54593 -237.56590 721.04907
3765.0000 -247.88303 -237.58294 10.30009 2.57592 -236.92409 727.49493
3770.0000 -247.48741 -238.03694 9.45048 2.55034 -237.47157 726.07476
3775.0000 -247.58368 -238.14731 9.43637 2.54223 -237.64512 714.47091
3780.0000 -245.10000 -236.44283 8.65717 2.51853 -238.15231 689.32080
3785.0000 -246.85588 -238.28827 8.56761 2.56106 -237.24207 727.80376
3790.0000 -248.29520 -238.75703 9.53817 2.50789 -238.37998 704.36158
3795.0000 -246.93950 -239.01506 7.92444 2.52603 -237.99170 721.23572
3800.0000 -246.41442 -238.03632 8.37810 2.48055 -238.96495 677.04192
3805.0000 -247.62678 -239.10109 8.52569 2.52183 -238.08173 695.89153
3810.0000 -247.38931 -238.33996 9.04934 2.47332 -239.11975 665.61470
3815.0000 -247.95766 -239.57273 8.38492 2.47806 -239.01827 684.55345
3820.0000 -247.29731 -238.98344 8.31387 2.46027 -239.39913 655.07800
3825.0000 -247.67759 -238.62754 9.05005 2.51855 -238.15190 713.58403
3830.0000 -245.68508 -238.21271 7.47236 2.48193 -238.93549 696.86950
3835.0000 -246.75310 -238.63593 8.11717 2.52052 -238.10961 697.51146
3840.0000 -245.98421 -237.71319 8.27102 2.49379 -238.68174 692.58690
3845.0000 -246.93588 -237.81284 9.12304 2.52721 -237.96660 715.24558
3850.0000 -248.70452 -240.35189 8.35262 2.49288 -238.70122 694.06547
3855.0000 -248.97414 -241.10355 7.87059 2.41104 -240.45262 621.79853
3860.0000 -247.46284 -238.82006 8.64278 2.41500 -240.36786 642.35166
3865.0000 -246.19261 -236.91813 9.27448 2.50186 -238.50902 715.60534
3870.0000 -247.39732 -238.46340 8.93393 2.50931 -238.34948 699.68223
3875.0000 -249.04864 -240.43274 8.61590 2.44599 -239.70464 663.01180
3880.0000 -248.08650 -239.38795 8.69855 2.43553 -239.92844 656.58819
3885.0000 -247.11609 -238.18720 8.92889 2.47831 -239.01292 691.37920
3890.0000 -247.92020 -239.30644 8.61376 2.49124 -238.73626 685.80443
3895.0000 -247.52617 -239.10732 8.41885 2.48173 -238.93975 674.98171
3900.0000 -247.77539 -238.88951 8.88588 2.43777 -239.88052 645.75588
3905.0000 -245.20391 -236.73428 8.46963 2.54003 -237.69223 707.64914
3910.0000 -245.28812 -237.24906 8.03906 2.56369 -237.18590 719.11701
3915.0000 -247.73806 -240.57718 7.16088 2.45366 -239.54046 648.89006
3920.0000 -248.37582 -239.25466 9.12117 2.41730 -240.31873 636.55758
3925.0000 -248.01304 -238.17041 9.84263 2.50231 -238.49927 706.37386
3930.0000 -246.49123 -237.62040 8.87083 2.55365 -237.40066 723.38704
3935.0000 -246.47121 -236.47728 9.99393 2.57454 -236.95367 761.43145
3940.0000 -246.31502 -237.96620 8.34882 2.55811 -237.30517 714.12346
3945.0000 -247.80818 -238.26144 9.54675 2.54140 -237.66275 699.12804
3950.0000 -248.23731 -239.44105 8.79626 2.49695 -238.61408 682.01476
3955.0000 -247.15855 -238.62183 8.53673 2.48437 -238.88327 693.32002
3960.0000 -247.29646 -238.58795 8.70851 2.48228 -238.92793 682.20299
3965.0000 -248.27937 -238.70308 9.57630 2.46181 -239.36601 658.48752
3970.0000 -248.38803 -240.19878 8.18925 2.45839 -239.43932 672.90863
3975.0000 -249.19515 -240.09772 9.09744 2.39834 -240.72435 657.12843
3980.0000 -247.44030 -238.51858 8.92173 2.45337 -239.54669 665.03158
3985.0000 -248.28981 -240.31324 7.97657 2.45464 -239.51950 666.51144
3990.0000 -247.73108 -239.67479 8.05629 2.44114 -239.80834 648.51479
3995.0000 -248.72315 -240.19542 8.52773 2.45123 -239.59251 676.48364
4000.0000 -247.54154 -240.96165 6.57988 2.41969 -240.26758 630.55036
MELTING PROCESS: loop number 17 T-loop= 717.00000000000000
main_MD> interactions number 17 at Temperature= 717.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23309 0.59512 -1.28689
force_rgl> df(natom) 1.39096 -1.24412 0.19679
4005.0000 -248.71673 -239.49597 9.22076 2.44989 -239.62114 667.77140
4010.0000 -246.26317 -236.60322 9.65995 2.54125 -237.66593 723.09298
4015.0000 -244.10850 -234.92701 9.18149 2.62360 -235.90362 759.74714
4020.0000 -246.65808 -237.82367 8.83441 2.61956 -235.99012 752.77720
4025.0000 -246.56048 -238.01024 8.55023 2.56215 -237.21870 698.07429
4030.0000 -246.46937 -237.98307 8.48629 2.52599 -237.99260 697.53826
4035.0000 -249.34604 -240.39188 8.95416 2.47968 -238.98360 697.71571
4040.0000 -247.16590 -238.50907 8.65682 2.46088 -239.38600 703.99511
4045.0000 -247.31973 -238.09937 9.22036 2.51838 -238.15545 724.68182
4050.0000 -246.28993 -237.54656 8.74336 2.53359 -237.82989 717.08397
4055.0000 -248.08264 -239.54856 8.53408 2.48418 -238.88726 677.29005
4060.0000 -248.38472 -240.85305 7.53167 2.45289 -239.55690 669.14132
4065.0000 -248.54689 -239.86049 8.68641 2.41195 -240.43317 649.68794
4070.0000 -246.54036 -237.50900 9.03136 2.52213 -238.07511 714.23881
4075.0000 -244.86480 -235.25315 9.61166 2.61011 -236.19230 762.61559
4080.0000 -245.99917 -237.34297 8.65620 2.58433 -236.74402 727.89225
4085.0000 -245.38691 -236.43203 8.95488 2.63211 -235.72151 788.16613
4090.0000 -244.88936 -235.11388 9.77548 2.63766 -235.60272 779.03365
4095.0000 -245.98617 -236.03313 9.95304 2.62655 -235.84063 743.77427
4100.0000 -245.85355 -236.23386 9.61970 2.62016 -235.97722 752.53740
4105.0000 -246.44389 -237.44166 9.00223 2.63073 -235.75106 771.72692
4110.0000 -246.74574 -236.71871 10.02702 2.55863 -237.29412 745.86812
4115.0000 -247.62505 -238.76299 8.86206 2.55463 -237.37979 711.62683
4120.0000 -246.77345 -237.16235 9.61110 2.54973 -237.48460 733.56408
4125.0000 -246.42797 -238.39280 8.03518 2.52566 -237.99972 696.17198
4130.0000 -247.02768 -239.09393 7.93375 2.48455 -238.87952 668.71021
4135.0000 -247.03259 -238.73249 8.30010 2.46720 -239.25079 670.99204
4140.0000 -246.86406 -235.60292 11.26114 2.57518 -236.93999 749.49734
4145.0000 -247.09823 -238.49009 8.60814 2.58314 -236.76950 762.41455
4150.0000 -248.11212 -238.90265 9.20947 2.50129 -238.52127 698.75889
4155.0000 -247.66626 -237.04121 10.62504 2.52511 -238.01146 722.95119
4160.0000 -247.22874 -236.87351 10.35522 2.58774 -236.67111 742.86146
4165.0000 -246.52127 -239.08434 7.43692 2.52843 -237.94047 688.01396
4170.0000 -248.12494 -238.55611 9.56883 2.50887 -238.35904 684.88252
4175.0000 -246.12971 -236.60015 9.52957 2.57245 -236.99839 747.15302
4180.0000 -245.48506 -236.35429 9.13077 2.59054 -236.61115 736.13119
4185.0000 -246.32091 -236.95398 9.36693 2.61956 -235.99027 768.75044
4190.0000 -245.88028 -235.92317 9.95711 2.59168 -236.58671 746.58144
4195.0000 -245.37629 -237.19622 8.18006 2.57139 -237.02106 740.13165
4200.0000 -247.36189 -237.26655 10.09534 2.60764 -236.24535 766.33133
4205.0000 -244.78550 -235.77574 9.00976 2.60928 -236.21025 743.97321
4210.0000 -247.12712 -239.19217 7.93495 2.54336 -237.62078 681.05016
4215.0000 -250.24817 -241.32855 8.91962 2.41717 -240.32142 635.56365
4220.0000 -247.03576 -237.96478 9.07098 2.42385 -240.17835 647.01583
4225.0000 -247.52309 -239.04186 8.48122 2.50021 -238.54427 677.45910
4230.0000 -247.97069 -239.01223 8.95846 2.45408 -239.53144 671.82289
4235.0000 -248.42893 -238.59175 9.83719 2.47898 -238.99860 692.21558
4240.0000 -248.60458 -238.78604 9.81854 2.49255 -238.70829 704.29787
4245.0000 -247.62828 -239.63577 7.99251 2.48134 -238.94817 700.67878
4250.0000 -247.77504 -239.04709 8.72795 2.48236 -238.92640 721.17911
MELTING PROCESS: loop number 18 T-loop= 742.00000000000000
main_MD> interactions number 18 at Temperature= 742.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.20123 -0.72688 1.68906
force_rgl> df(natom) -1.36573 1.01786 0.72786
4255.0000 -246.36682 -237.96506 8.40175 2.51123 -238.30844 699.13077
4260.0000 -246.63635 -238.38660 8.24975 2.48998 -238.76328 684.11553
4265.0000 -244.75615 -235.31123 9.44492 2.60230 -236.35947 752.15230
4270.0000 -247.54423 -238.90821 8.63602 2.54602 -237.56385 715.73356
4275.0000 -248.69221 -239.58237 9.10984 2.50062 -238.53553 697.53315
4280.0000 -246.26588 -236.60768 9.65820 2.52847 -237.93960 720.85662
4285.0000 -246.79870 -236.84253 9.95617 2.64226 -235.50444 770.45487
4290.0000 -246.32496 -237.33402 8.99094 2.54389 -237.60960 697.61002
4295.0000 -245.81464 -235.48197 10.33267 2.58267 -236.77956 735.15911
4300.0000 -244.09378 -235.38668 8.70710 2.68840 -234.51688 809.91275
4305.0000 -245.79150 -234.05562 11.73588 2.69097 -234.46186 811.35006
4310.0000 -245.89223 -236.65206 9.24017 2.64750 -235.39216 750.95489
4315.0000 -244.61917 -236.83223 7.78694 2.61911 -235.99975 764.07605
4320.0000 -245.15241 -235.95117 9.20124 2.55968 -237.27168 721.29284
4325.0000 -246.37099 -236.77782 9.59317 2.61661 -236.05322 750.65598
4330.0000 -245.72568 -234.94611 10.77956 2.62487 -235.87647 730.44778
4335.0000 -245.79613 -235.58503 10.21111 2.64658 -235.41193 774.16295
4340.0000 -245.44931 -236.84014 8.60917 2.61436 -236.10137 732.10246
4345.0000 -245.37661 -236.21224 9.16436 2.59637 -236.48648 724.35862
4350.0000 -246.51447 -235.70162 10.81284 2.59036 -236.61507 741.58839
4355.0000 -245.32243 -235.96841 9.35402 2.62882 -235.79191 781.57509
4360.0000 -246.12594 -237.11468 9.01126 2.60393 -236.32456 750.93701
4365.0000 -245.64873 -236.86892 8.77982 2.56684 -237.11848 731.89691
4370.0000 -245.76049 -236.01343 9.74706 2.58680 -236.69128 741.94173
4375.0000 -247.47858 -236.29378 11.18480 2.59275 -236.56399 761.24358
4380.0000 -247.59975 -237.81743 9.78232 2.59242 -236.57102 757.43503
4385.0000 -247.37237 -238.09160 9.28076 2.56265 -237.20804 732.49426
4390.0000 -247.97477 -238.84158 9.13319 2.52863 -237.93609 714.41484
4395.0000 -247.07556 -238.59489 8.48067 2.47142 -239.16048 678.67741
4400.0000 -246.86087 -237.97825 8.88262 2.50376 -238.46832 689.33171
4405.0000 -245.75856 -235.40207 10.35650 2.56510 -237.15562 735.19500
4410.0000 -247.33302 -237.90953 9.42349 2.59917 -236.42646 751.02095
4415.0000 -245.74859 -237.08476 8.66383 2.51800 -238.16366 700.77882
4420.0000 -245.78604 -236.33593 9.45011 2.58178 -236.79861 745.89567
4425.0000 -245.25797 -234.94044 10.31753 2.63797 -235.59608 765.34635
4430.0000 -245.27038 -234.01398 11.25641 2.70495 -234.16273 798.04708
4435.0000 -246.35495 -237.52446 8.83049 2.64364 -235.47477 786.04226
4440.0000 -246.30939 -236.55350 9.75589 2.56042 -237.25574 735.05922
4445.0000 -246.96273 -237.63175 9.33098 2.55466 -237.37915 716.10262
4450.0000 -246.61919 -237.81019 8.80900 2.51165 -238.29948 703.40471
4455.0000 -246.50177 -237.88036 8.62141 2.52737 -237.96318 698.29406
4460.0000 -247.47551 -239.52787 7.94764 2.48914 -238.78115 677.29597
4465.0000 -245.20530 -235.66976 9.53554 2.55716 -237.32546 742.24132
4470.0000 -245.04587 -235.42859 9.61728 2.64352 -235.47745 752.73328
4475.0000 -246.02039 -235.41314 10.60724 2.63416 -235.67779 762.48666
4480.0000 -246.05048 -236.01201 10.03847 2.64141 -235.52257 769.07717
4485.0000 -244.58614 -235.25220 9.33395 2.60778 -236.24216 777.99052
4490.0000 -246.57798 -236.57888 9.99910 2.61409 -236.10713 772.79137
4495.0000 -246.56108 -237.45842 9.10265 2.56365 -237.18672 730.85767
4500.0000 -245.45991 -236.59010 8.86982 2.57870 -236.86449 724.75419
MELTING PROCESS: loop number 19 T-loop= 767.00000000000000
main_MD> interactions number 19 at Temperature= 767.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80178 -0.28110 5.03803
force_rgl> df(natom) -2.43524 0.96691 -0.39726
4505.0000 -245.37517 -235.02496 10.35021 2.65638 -235.20219 802.03518
4510.0000 -246.25773 -236.79889 9.45884 2.56524 -237.15267 730.09456
4515.0000 -246.14106 -236.96375 9.17730 2.59702 -236.47249 742.88483
4520.0000 -246.40629 -235.56691 10.83938 2.60518 -236.29795 739.93207
4525.0000 -244.72295 -235.51983 9.20312 2.64206 -235.50875 796.82028
4530.0000 -245.35705 -236.04681 9.31024 2.65300 -235.27448 773.71014
4535.0000 -245.24895 -234.80545 10.44351 2.66414 -235.03612 786.93045
4540.0000 -246.96781 -236.11323 10.85458 2.66364 -235.04676 782.83370
4545.0000 -246.30375 -236.97514 9.32862 2.58681 -236.69105 752.61704
4550.0000 -248.02410 -238.91932 9.10477 2.52192 -238.07966 698.93215
4555.0000 -248.23267 -239.12793 9.10474 2.48156 -238.94352 688.78843
4560.0000 -247.21206 -239.45029 7.76178 2.45572 -239.49652 698.99039
4565.0000 -245.19495 -236.06520 9.12975 2.59397 -236.53780 744.03014
4570.0000 -247.58523 -237.44048 10.14475 2.58615 -236.70519 738.83084
4575.0000 -246.11791 -236.68507 9.43284 2.59559 -236.50311 741.55692
4580.0000 -246.39192 -236.58980 9.80212 2.54757 -237.53070 718.99931
4585.0000 -246.35656 -236.56800 9.78856 2.61257 -236.13973 768.81839
4590.0000 -243.50545 -235.65202 7.85343 2.64164 -235.51770 773.47269
4595.0000 -245.70149 -236.44443 9.25707 2.59120 -236.59704 718.12456
4600.0000 -245.91874 -236.39124 9.52750 2.61754 -236.03346 733.41648
4605.0000 -246.81036 -235.39116 11.41920 2.58325 -236.76729 736.92030
4610.0000 -245.78235 -235.04515 10.73720 2.61358 -236.11812 757.73679
4615.0000 -245.13954 -234.76206 10.37748 2.67533 -234.79660 812.18660
4620.0000 -245.11077 -234.07152 11.03926 2.72200 -233.79793 823.84095
4625.0000 -245.13273 -233.64716 11.48557 2.74456 -233.31513 844.18589
4630.0000 -244.53785 -234.94376 9.59408 2.70818 -234.09365 812.40376
4635.0000 -246.79089 -235.14859 11.64230 2.64735 -235.39550 765.42525
4640.0000 -246.13330 -236.71948 9.41382 2.57245 -236.99844 759.14459
4645.0000 -246.39613 -235.75401 10.64212 2.63763 -235.60351 783.80491
4650.0000 -244.39054 -235.01080 9.37973 2.60906 -236.21481 759.28809
4655.0000 -245.80173 -235.78834 10.01339 2.62426 -235.88957 772.29012
4660.0000 -246.70261 -236.89742 9.80519 2.62625 -235.84695 764.67803
4665.0000 -246.92862 -237.57605 9.35257 2.57078 -237.03403 740.01874
4670.0000 -246.39569 -236.32301 10.07268 2.55166 -237.44336 743.21610
4675.0000 -246.72525 -237.00660 9.71865 2.57117 -237.02564 731.28444
4680.0000 -244.64692 -235.36905 9.27787 2.66331 -235.05379 781.28193
4685.0000 -244.14784 -233.75887 10.38897 2.72276 -233.78159 838.73780
4690.0000 -243.18517 -233.43574 9.74943 2.74408 -233.32534 838.46161
4695.0000 -246.20024 -235.94409 10.25615 2.65040 -235.33008 780.50233
4700.0000 -245.39873 -235.45551 9.94322 2.64818 -235.37778 775.63192
4705.0000 -245.01442 -236.61832 8.39611 2.58633 -236.70133 736.81598
4710.0000 -246.86976 -235.95274 10.91702 2.63841 -235.58678 786.90988
4715.0000 -245.75418 -235.94161 9.81257 2.59915 -236.42688 739.49780
4720.0000 -245.12075 -236.97700 8.14376 2.59525 -236.51033 736.57728
4725.0000 -247.07952 -236.22648 10.85304 2.59174 -236.58554 735.40614
4730.0000 -244.39268 -235.75314 8.63954 2.59899 -236.43031 754.72292
4735.0000 -245.75056 -235.11297 10.63759 2.66449 -235.02855 788.96945
4740.0000 -244.04630 -234.80585 9.24045 2.64332 -235.48172 768.25903
4745.0000 -245.53707 -235.99963 9.53743 2.61530 -236.08126 785.85840
4750.0000 -247.59819 -237.51951 10.07867 2.59115 -236.59808 742.55159
MELTING PROCESS: loop number 20 T-loop= 792.00000000000000
main_MD> interactions number 20 at Temperature= 792.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -7.17357 -6.21025 6.26018
force_rgl> df(natom) -0.36613 -2.35528 4.53765
4755.0000 -246.74216 -238.78520 7.95695 2.57446 -236.95530 746.64060
4760.0000 -245.79519 -237.59625 8.19894 2.55218 -237.43204 696.32075
4765.0000 -245.73776 -235.66914 10.06862 2.64141 -235.52258 764.74453
4770.0000 -245.69550 -235.35099 10.34451 2.66557 -235.00552 783.64510
4775.0000 -244.66616 -235.01157 9.65460 2.66807 -234.95193 779.10414
4780.0000 -244.12484 -233.48417 10.64066 2.68030 -234.69021 797.80017
4785.0000 -245.15706 -234.79540 10.36165 2.68224 -234.64868 793.85516
4790.0000 -245.47471 -235.29854 10.17617 2.64506 -235.44442 768.58426
4795.0000 -245.77721 -234.94750 10.82971 2.64724 -235.39787 760.53623
4800.0000 -245.55585 -233.68503 11.87082 2.70142 -234.23823 808.28776
4805.0000 -245.20069 -234.75374 10.44695 2.70839 -234.08919 801.54506
4810.0000 -243.84086 -233.43862 10.40224 2.69853 -234.30015 816.14000
4815.0000 -244.91800 -235.49320 9.42480 2.66271 -235.06664 777.47306
4820.0000 -244.68951 -236.41606 8.27345 2.63387 -235.68398 781.54183
4825.0000 -245.71520 -235.35099 10.36421 2.64472 -235.45173 792.13903
4830.0000 -243.37697 -232.96788 10.40908 2.70536 -234.15391 803.61860
4835.0000 -244.82875 -234.47887 10.34988 2.75620 -233.06591 843.65872
4840.0000 -244.10065 -233.82940 10.27125 2.72651 -233.70142 829.07955
4845.0000 -244.14592 -234.19509 9.95083 2.70475 -234.16708 796.97341
4850.0000 -245.38834 -235.46287 9.92547 2.68325 -234.62723 785.67456
4855.0000 -245.23025 -234.38230 10.84795 2.63686 -235.62002 782.61135
4860.0000 -245.81105 -235.13228 10.67878 2.65511 -235.22943 789.42190
4865.0000 -243.72384 -233.05216 10.67168 2.69999 -234.26897 830.25644
4870.0000 -245.46497 -236.30708 9.15789 2.66991 -234.91258 776.78187
4875.0000 -247.67207 -237.94456 9.72751 2.56745 -237.10532 730.26054
4880.0000 -245.40453 -235.84604 9.55849 2.54471 -237.59191 715.09805
4885.0000 -243.97384 -234.24158 9.73226 2.65290 -235.27657 769.02401
4890.0000 -244.82190 -233.90412 10.91778 2.68407 -234.60959 814.81148
4895.0000 -245.64131 -233.94300 11.69831 2.73130 -233.59895 815.46754
4900.0000 -245.14648 -233.78465 11.36184 2.68391 -234.61311 769.68198
4905.0000 -243.97044 -235.18761 8.78283 2.67192 -234.86953 788.64422
4910.0000 -244.65666 -234.61847 10.03820 2.65824 -235.16246 762.78956
4915.0000 -244.35150 -233.11110 11.24040 2.70771 -234.10366 826.28428
4920.0000 -244.18059 -234.63815 9.54244 2.71498 -233.94812 805.24177
4925.0000 -243.98589 -233.91965 10.06624 2.71655 -233.91458 813.76827
4930.0000 -245.23901 -234.01391 11.22510 2.69689 -234.33528 818.81855
4935.0000 -245.62548 -236.01476 9.61072 2.62290 -235.91866 770.32411
4940.0000 -244.18783 -231.63414 12.55369 2.73393 -233.54254 818.26021
4945.0000 -245.04370 -234.96725 10.07645 2.78297 -232.49308 851.13260
4950.0000 -244.52846 -234.66936 9.85910 2.69660 -234.34144 794.68696
4955.0000 -244.34746 -232.81957 11.52789 2.75456 -233.10110 846.23016
4960.0000 -245.35072 -234.74529 10.60543 2.73593 -233.49984 839.84011
4965.0000 -245.99943 -235.44020 10.55923 2.63807 -235.59401 779.93509
4970.0000 -244.91709 -234.99404 9.92305 2.67077 -234.89428 786.63734
4975.0000 -245.83415 -235.65161 10.18254 2.65512 -235.22926 778.52597
4980.0000 -244.86472 -234.52133 10.34339 2.68653 -234.55706 802.50350
4985.0000 -246.02303 -236.73141 9.29162 2.63590 -235.64049 768.08568
4990.0000 -245.77811 -236.85072 8.92739 2.62302 -235.91615 769.98686
4995.0000 -242.81672 -234.52807 8.28865 2.65139 -235.30891 772.49081
5000.0000 -245.99597 -235.46015 10.53582 2.69311 -234.41613 771.07163
MELTING PROCESS: loop number 21 T-loop= 817.00000000000000
main_MD> interactions number 21 at Temperature= 817.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.15760 0.30882 1.80210
force_rgl> df(natom) 3.15837 0.28873 -0.81182
5005.0000 -245.97100 -234.32846 11.64254 2.66145 -235.09370 805.56645
5010.0000 -245.22416 -235.74906 9.47510 2.67621 -234.77775 800.27080
5015.0000 -246.43547 -236.47949 9.95598 2.62902 -235.78767 758.86336
5020.0000 -246.65336 -236.28488 10.36848 2.60546 -236.29196 764.41817
5025.0000 -246.76264 -236.18433 10.57831 2.59503 -236.51511 788.09742
5030.0000 -246.97231 -237.64285 9.32946 2.54004 -237.69183 730.60638
5035.0000 -244.87965 -233.90879 10.97086 2.65900 -235.14603 794.02217
5040.0000 -243.46729 -232.84339 10.62390 2.72969 -233.63338 842.64129
5045.0000 -244.61672 -234.13185 10.48487 2.73609 -233.49641 858.11221
5050.0000 -245.80981 -235.59855 10.21125 2.66188 -235.08444 776.11717
5055.0000 -243.55184 -232.16032 11.39152 2.74735 -233.25540 834.04471
5060.0000 -242.35991 -231.26112 11.09879 2.84338 -231.20029 884.14888
5065.0000 -243.00155 -230.65144 12.35011 2.87719 -230.47685 900.00409
5070.0000 -244.36660 -231.41623 12.95037 2.83400 -231.40096 876.93815
5075.0000 -244.63191 -232.20857 12.42334 2.81304 -231.84963 879.65233
5080.0000 -241.26243 -230.77595 10.48648 2.83016 -231.48328 888.66532
5085.0000 -243.44482 -232.57196 10.87286 2.83906 -231.29272 889.55380
5090.0000 -243.19982 -233.01307 10.18675 2.80187 -232.08862 845.09559
5095.0000 -243.30367 -233.75794 9.54573 2.74790 -233.24371 809.80187
5100.0000 -242.99517 -232.83026 10.16491 2.79752 -232.18172 859.94295
5105.0000 -243.77349 -233.20386 10.56963 2.74905 -233.21904 844.97679
5110.0000 -244.61484 -233.37603 11.23881 2.73217 -233.58031 810.11083
5115.0000 -243.75567 -233.65602 10.09965 2.72315 -233.77331 824.22904
5120.0000 -243.97241 -233.07399 10.89842 2.75800 -233.02747 839.31939
5125.0000 -244.33435 -234.20041 10.13395 2.71600 -233.92635 818.89089
5130.0000 -244.54119 -234.04128 10.49991 2.72162 -233.80602 809.45184
5135.0000 -245.52353 -235.72625 9.79728 2.64815 -235.37830 778.42659
5140.0000 -243.62564 -232.40453 11.22111 2.74017 -233.40896 830.12321
5145.0000 -243.43616 -234.79603 8.64013 2.74910 -233.21795 841.58807
5150.0000 -244.57811 -235.04232 9.53579 2.68124 -234.67018 779.16972
5155.0000 -243.90346 -234.08607 9.81738 2.68291 -234.63440 792.10293
5160.0000 -242.89942 -232.71290 10.18652 2.75833 -233.02035 835.45310
5165.0000 -244.18948 -233.31788 10.87161 2.77109 -232.74745 838.11078
5170.0000 -243.50823 -231.84998 11.65825 2.76085 -232.96653 831.88318
5175.0000 -243.64079 -232.62326 11.01753 2.78519 -232.44563 846.78386
5180.0000 -241.97689 -231.44510 10.53179 2.81692 -231.76660 875.72230
5185.0000 -241.11183 -230.28232 10.82952 2.86285 -230.78359 883.64316
5190.0000 -245.76559 -235.14063 10.62497 2.75450 -233.10242 818.73437
5195.0000 -245.18797 -234.71129 10.47669 2.66726 -234.96930 800.00251
5200.0000 -246.19985 -237.45795 8.74189 2.61801 -236.02328 761.52502
5205.0000 -247.31934 -237.07822 10.24112 2.54937 -237.49228 716.83948
5210.0000 -244.73163 -233.99428 10.73734 2.69062 -234.46935 802.61366
5215.0000 -242.60007 -233.52208 9.07799 2.74399 -233.32736 808.75942
5220.0000 -244.05921 -234.07908 9.98012 2.73205 -233.58285 823.88775
5225.0000 -245.92583 -234.50726 11.41857 2.63407 -235.67974 761.13417
5230.0000 -245.33702 -232.55982 12.77720 2.70853 -234.08608 810.05140
5235.0000 -243.90669 -233.41138 10.49531 2.78623 -232.42345 872.50790
5240.0000 -243.92328 -233.72288 10.20040 2.78156 -232.52318 845.55039
5245.0000 -243.10118 -233.03825 10.06293 2.74478 -233.31042 828.48200
5250.0000 -244.85571 -235.40708 9.44864 2.73307 -233.56093 838.53054
MELTING PROCESS: loop number 22 T-loop= 842.00000000000000
main_MD> interactions number 22 at Temperature= 842.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.58099 -0.58508 -1.73026
force_rgl> df(natom) 0.03594 0.78690 -2.62055
5255.0000 -245.79274 -235.62183 10.17090 2.63593 -235.63981 772.64143
5260.0000 -245.59198 -234.97054 10.62144 2.65109 -235.31547 799.38547
5265.0000 -243.42783 -232.89424 10.53359 2.66636 -234.98860 786.40460
5270.0000 -243.39963 -232.19561 11.20403 2.76187 -232.94459 853.88320
5275.0000 -243.04808 -232.63579 10.41230 2.78950 -232.35341 865.76245
5280.0000 -242.15698 -233.38850 8.76847 2.77001 -232.77051 844.75406
5285.0000 -243.47457 -233.54155 9.93301 2.76433 -232.89197 837.25772
5290.0000 -243.66354 -232.56917 11.09437 2.69867 -234.29719 823.11168
5295.0000 -242.91308 -232.01499 10.89809 2.81854 -231.73187 870.42655
5300.0000 -244.32138 -232.25312 12.06827 2.80944 -231.92667 885.63126
5305.0000 -243.03281 -232.56205 10.47076 2.74590 -233.28637 826.56498
5310.0000 -242.74830 -232.18845 10.55985 2.78395 -232.47218 849.80495
5315.0000 -240.18076 -230.78482 9.39594 2.85885 -230.86918 876.97973
5320.0000 -242.70048 -231.49946 11.20103 2.83805 -231.31447 841.63920
5325.0000 -243.41993 -233.20938 10.21056 2.80107 -232.10568 875.10969
5330.0000 -243.31708 -229.88914 13.42794 2.78971 -232.34893 866.97537
5335.0000 -241.20390 -231.14710 10.05680 2.84900 -231.07994 875.54412
5340.0000 -244.00286 -233.53541 10.46745 2.79185 -232.30312 858.97736
5345.0000 -244.22469 -232.33420 11.89049 2.78230 -232.50742 859.30660
5350.0000 -243.50126 -233.43193 10.06932 2.79015 -232.33940 842.05248
5355.0000 -244.64028 -233.74649 10.89378 2.77233 -232.72075 863.05141
5360.0000 -243.53200 -231.90437 11.62763 2.77980 -232.56090 870.33848
5365.0000 -244.34041 -233.38296 10.95746 2.76057 -232.97255 858.79679
5370.0000 -245.05962 -233.19198 11.86764 2.70314 -234.20145 800.30548
5375.0000 -243.31702 -232.40380 10.91322 2.80659 -231.98773 880.58532
5380.0000 -242.25604 -231.27341 10.98263 2.83461 -231.38804 896.61971
5385.0000 -241.92236 -229.83549 12.08687 2.82471 -231.59993 887.93026
5390.0000 -242.94913 -230.87615 12.07298 2.83304 -231.42158 876.93109
5395.0000 -241.22475 -228.98003 12.24472 2.88472 -230.31567 920.74863
5400.0000 -243.53864 -230.50421 13.03444 2.88590 -230.29030 905.33866
5405.0000 -244.83504 -236.20806 8.62698 2.75770 -233.03383 835.18214
5410.0000 -245.93902 -235.24215 10.69687 2.64659 -235.41165 778.29190
5415.0000 -245.49923 -234.09427 11.40496 2.66583 -235.00002 794.48630
5420.0000 -244.41820 -235.28420 9.13400 2.71293 -233.99196 822.78703
5425.0000 -243.36129 -233.61842 9.74286 2.69403 -234.39650 806.97097
5430.0000 -243.90319 -233.40213 10.50107 2.72742 -233.68190 832.64593
5435.0000 -243.38873 -233.02769 10.36104 2.76406 -232.89771 840.92047
5440.0000 -244.02633 -234.70519 9.32114 2.73571 -233.50447 817.02500
5445.0000 -243.79316 -233.21943 10.57373 2.73105 -233.60426 824.28305
5450.0000 -245.55345 -233.47836 12.07509 2.72916 -233.64467 831.62559
5455.0000 -243.82081 -232.76130 11.05951 2.74111 -233.38901 837.86241
5460.0000 -242.64793 -231.66526 10.98266 2.76329 -232.91425 851.34308
5465.0000 -244.21785 -233.96338 10.25447 2.71268 -233.99728 830.50312
5470.0000 -244.00750 -233.27665 10.73085 2.74435 -233.31960 829.99777
5475.0000 -243.70404 -233.98168 9.72236 2.76355 -232.90880 862.83306
5480.0000 -245.01865 -235.19692 9.82173 2.68512 -234.58706 798.72794
5485.0000 -244.49138 -234.60812 9.88326 2.66682 -234.97884 786.53063
5490.0000 -243.35675 -233.28456 10.07218 2.75698 -233.04923 844.12197
5495.0000 -245.85556 -234.04103 11.81453 2.76243 -232.93269 854.03681
5500.0000 -244.53806 -233.11870 11.41936 2.67816 -234.73616 799.30193
MELTING PROCESS: loop number 23 T-loop= 867.00000000000000
main_MD> interactions number 23 at Temperature= 867.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.52715 -1.49368 1.17411
force_rgl> df(natom) -4.82218 -4.73423 2.14515
5505.0000 -243.43549 -230.47114 12.96435 2.77867 -232.58518 843.63923
5510.0000 -244.03921 -232.12685 11.91235 2.84933 -231.07300 908.56301
5515.0000 -242.98108 -231.15321 11.82786 2.86139 -230.81488 908.54810
5520.0000 -244.58295 -233.97675 10.60621 2.79698 -232.19324 871.83082
5525.0000 -243.75131 -233.10251 10.64880 2.69821 -234.30700 833.18421
5530.0000 -244.99564 -233.61479 11.38085 2.76285 -232.92360 849.05646
5535.0000 -242.14322 -230.68668 11.45654 2.78930 -232.35756 866.71576
5540.0000 -243.19212 -230.91822 12.27391 2.86404 -230.75825 905.90687
5545.0000 -242.94330 -232.90279 10.04051 2.80446 -232.03327 876.82572
5550.0000 -244.64911 -232.92649 11.72262 2.78007 -232.55524 847.60339
5555.0000 -243.89699 -233.71119 10.18581 2.73065 -233.61281 813.06109
5560.0000 -244.71088 -232.75368 11.95720 2.81389 -231.83134 884.08878
5565.0000 -244.69387 -233.13131 11.56256 2.75910 -233.00403 856.63235
5570.0000 -245.03131 -232.38080 12.65051 2.80373 -232.04877 882.26853
5575.0000 -244.19399 -232.95438 11.23961 2.80173 -232.09163 875.65492
5580.0000 -244.65533 -234.06726 10.58806 2.70805 -234.09638 829.19904
5585.0000 -244.84103 -235.75965 9.08138 2.71109 -234.03144 823.03259
5590.0000 -244.03006 -232.73325 11.29681 2.75020 -233.19450 837.67800
5595.0000 -245.02607 -234.12621 10.89986 2.77338 -232.69829 882.12539
5600.0000 -241.57413 -229.79686 11.77728 2.85324 -230.98923 908.71138
5605.0000 -241.85937 -230.78155 11.07782 2.87150 -230.59856 897.70410
5610.0000 -241.90337 -232.17490 9.72846 2.80324 -232.05938 860.00314
5615.0000 -242.42830 -230.73164 11.69666 2.80876 -231.94113 883.08336
5620.0000 -244.21611 -233.49295 10.72316 2.83051 -231.47564 882.46571
5625.0000 -243.31303 -232.52531 10.78772 2.76798 -232.81400 837.26254
5630.0000 -244.58721 -231.78412 12.80309 2.76981 -232.77466 852.42935
5635.0000 -242.65018 -231.31343 11.33675 2.82331 -231.62973 889.42339
5640.0000 -242.06060 -232.90340 9.15720 2.79181 -232.30390 874.15709
5645.0000 -242.39999 -232.48420 9.91579 2.78137 -232.52728 836.85757
5650.0000 -242.56074 -230.57938 11.98136 2.77233 -232.72082 850.84914
5655.0000 -240.98543 -227.97340 13.01203 2.90170 -229.95214 910.89860
5660.0000 -243.74897 -233.03287 10.71610 2.83310 -231.42034 877.77682
5665.0000 -241.00648 -229.83734 11.16915 2.80361 -232.05137 866.89016
5670.0000 -243.02391 -230.78146 12.24245 2.89151 -230.17031 929.47958
5675.0000 -242.34593 -233.47020 8.87572 2.83018 -231.48286 902.76092
5680.0000 -242.19345 -232.44157 9.75188 2.77985 -232.55993 824.18238
5685.0000 -243.81852 -232.26956 11.54897 2.79191 -232.30186 875.65210
5690.0000 -245.04564 -233.52633 11.51931 2.71500 -233.94777 833.37366
5695.0000 -243.19738 -232.26327 10.93411 2.77486 -232.66666 848.30378
5700.0000 -243.67394 -232.62072 11.05322 2.76994 -232.77194 852.41330
5705.0000 -245.37514 -233.45302 11.92212 2.79805 -232.17039 898.17125
5710.0000 -241.65779 -231.94911 9.70868 2.77673 -232.62673 842.78472
5715.0000 -240.82435 -230.51656 10.30779 2.86717 -230.69126 912.71346
5720.0000 -241.76751 -230.97131 10.79620 2.88701 -230.26662 920.59228
5725.0000 -243.10390 -233.56459 9.53930 2.85728 -230.90287 897.37369
5730.0000 -244.69427 -235.18266 9.51161 2.75908 -233.00443 851.89234
5735.0000 -243.65725 -232.65454 11.00271 2.72768 -233.67634 809.07268
5740.0000 -243.98759 -235.40810 8.57948 2.74458 -233.31465 832.36866
5745.0000 -243.68852 -234.50799 9.18053 2.64588 -235.42698 772.28337
5750.0000 -245.51663 -234.88178 10.63486 2.65317 -235.27087 788.50770
MELTING PROCESS: loop number 24 T-loop= 892.00000000000000
main_MD> interactions number 24 at Temperature= 892.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.13612 -2.25013 -3.07480
force_rgl> df(natom) -0.17486 0.26709 -0.73021
5755.0000 -245.43976 -236.14170 9.29806 2.68004 -234.69576 805.50288
5760.0000 -244.24214 -234.12709 10.11505 2.69701 -234.33271 801.80154
5765.0000 -241.04591 -230.22472 10.82120 2.74131 -233.38457 813.04361
5770.0000 -242.66461 -231.73394 10.93067 2.88718 -230.26290 917.37160
5775.0000 -243.28064 -231.64037 11.64028 2.80441 -232.03432 871.24095
5780.0000 -241.97590 -232.66007 9.31584 2.83227 -231.43813 876.69015
5785.0000 -241.68636 -230.70254 10.98382 2.82923 -231.50306 893.12688
5790.0000 -241.14536 -231.57797 9.56739 2.88209 -230.37186 882.88924
5795.0000 -241.18770 -229.06489 12.12281 2.85501 -230.95144 884.65343
5800.0000 -240.27965 -228.17672 12.10292 2.96838 -228.52516 944.35758
5805.0000 -241.10535 -229.31920 11.78615 2.96836 -228.52564 947.96598
5810.0000 -242.36713 -230.17561 12.19152 2.88295 -230.35340 919.78380
5815.0000 -241.95906 -230.38787 11.57118 2.89728 -230.04683 891.32196
5820.0000 -239.23327 -227.87465 11.35862 2.91713 -229.62192 940.60156
5825.0000 -243.55566 -230.98186 12.57379 2.92851 -229.37843 965.70506
5830.0000 -242.31704 -230.48661 11.83043 2.84046 -231.26270 897.42106
5835.0000 -243.12260 -231.90719 11.21541 2.82157 -231.66714 876.29610
5840.0000 -244.77414 -233.77595 10.99819 2.77376 -232.69023 861.74672
5845.0000 -242.42767 -231.90610 10.52158 2.77595 -232.64325 859.38952
5850.0000 -243.90033 -231.57920 12.32113 2.80329 -232.05825 851.39136
5855.0000 -240.83432 -228.97937 11.85495 2.90976 -229.77968 936.58052
5860.0000 -239.75795 -228.95664 10.80132 2.91752 -229.61378 912.76640
5865.0000 -240.52082 -230.39210 10.12872 2.92340 -229.48779 909.71510
5870.0000 -242.93368 -231.80855 11.12513 2.83703 -231.33615 865.53513
5875.0000 -244.94038 -233.92523 11.01515 2.76207 -232.94033 863.84118
5880.0000 -242.93021 -232.02332 10.90689 2.76954 -232.78046 872.51206
5885.0000 -242.69563 -231.96683 10.72880 2.80837 -231.94955 865.53691
5890.0000 -243.55596 -232.06958 11.48638 2.80788 -231.96006 880.57295
5895.0000 -242.74124 -232.17324 10.56800 2.78245 -232.50420 862.10677
5900.0000 -242.83617 -232.06071 10.77546 2.79021 -232.33817 841.68750
5905.0000 -242.59795 -231.77345 10.82450 2.79999 -232.12878 854.47609
5910.0000 -243.20746 -232.72585 10.48161 2.78964 -232.35037 869.38692
5915.0000 -244.16135 -233.57719 10.58416 2.77355 -232.69462 848.51336
5920.0000 -244.64113 -233.72763 10.91350 2.73550 -233.50903 845.59758
5925.0000 -241.90888 -229.84429 12.06459 2.79217 -232.29629 877.81581
5930.0000 -241.90769 -230.13188 11.77582 2.89949 -229.99944 946.62344
5935.0000 -244.07972 -233.88049 10.19923 2.82729 -231.54468 893.64656
5940.0000 -242.21901 -232.33889 9.88012 2.73010 -233.62462 825.59768
5945.0000 -241.16229 -228.20565 12.95663 2.85629 -230.92394 902.23690
5950.0000 -242.84364 -230.83843 12.00521 2.91796 -229.60431 944.41774
5955.0000 -243.73954 -233.41609 10.32345 2.79555 -232.22380 864.02633
5960.0000 -242.61441 -230.23245 12.38196 2.78862 -232.37209 872.61543
5965.0000 -241.82277 -230.45636 11.36640 2.82031 -231.69403 878.19585
5970.0000 -243.31839 -231.81742 11.50097 2.85047 -231.04860 915.70950
5975.0000 -241.28313 -229.89935 11.38378 2.85366 -230.98032 910.32611
5980.0000 -241.26815 -228.58443 12.68372 2.88486 -230.31258 956.30857
5985.0000 -243.12350 -229.65717 13.46634 2.96998 -228.49110 981.00664
5990.0000 -242.19445 -230.77846 11.41599 2.89487 -230.09836 930.61905
5995.0000 -240.89295 -230.63547 10.25748 2.83354 -231.41089 884.83257
6000.0000 -242.11284 -231.35538 10.75747 2.85616 -230.92686 889.27142
MELTING PROCESS: loop number 25 T-loop= 917.00000000000000
main_MD> interactions number 25 at Temperature= 917.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.61547 3.19000 0.62703
force_rgl> df(natom) -0.52609 2.49313 1.61970
6005.0000 -241.96605 -232.00087 9.96518 2.86357 -230.76832 893.83520
6010.0000 -244.44565 -232.60882 11.83682 2.81331 -231.84382 849.05009
6015.0000 -243.91376 -232.31917 11.59459 2.79047 -232.33256 862.01504
6020.0000 -243.24025 -230.45966 12.78059 2.82149 -231.66881 886.58848
6025.0000 -241.41549 -230.85911 10.55638 2.85861 -230.87442 930.70306
6030.0000 -242.91321 -231.93571 10.97750 2.80895 -231.93712 876.25389
6035.0000 -243.55464 -229.83938 13.71526 2.83985 -231.27586 894.44281
6040.0000 -241.88843 -230.13159 11.75684 2.91044 -229.76524 945.36040
6045.0000 -244.45182 -234.27585 10.17597 2.79168 -232.30662 878.34447
6050.0000 -242.47885 -230.58418 11.89468 2.81541 -231.79889 884.73316
6055.0000 -242.32055 -230.62056 11.69999 2.90563 -229.86814 924.64662
6060.0000 -243.60578 -231.91179 11.69399 2.81909 -231.72021 860.34961
6065.0000 -243.62595 -231.35390 12.27205 2.82087 -231.68205 870.94088
6070.0000 -243.61304 -234.64231 8.97073 2.73452 -233.52997 841.90667
6075.0000 -242.94456 -232.52492 10.41964 2.75478 -233.09634 829.97163
6080.0000 -243.45370 -230.98137 12.47233 2.81700 -231.76478 895.60023
6085.0000 -242.48315 -230.44474 12.03841 2.87197 -230.58839 927.47753
6090.0000 -240.41416 -228.85343 11.56073 2.88454 -230.31948 917.25176
6095.0000 -240.14891 -228.30233 11.84659 2.89589 -230.07665 942.90563
6100.0000 -240.02000 -228.52733 11.49268 2.95230 -228.86936 958.88444
6105.0000 -240.44673 -229.03851 11.40822 2.98555 -228.15782 979.58431
6110.0000 -241.24463 -229.99219 11.25244 2.89643 -230.06508 929.55767
6115.0000 -241.94046 -228.58542 13.35505 2.96416 -228.61557 969.39247
6120.0000 -244.51209 -232.60201 11.91008 2.91725 -229.61952 944.67825
6125.0000 -243.19604 -233.15337 10.04267 2.79069 -232.32798 876.28787
6130.0000 -242.16496 -231.14880 11.01616 2.80949 -231.92550 880.20026
6135.0000 -243.99878 -233.11647 10.88230 2.79488 -232.23833 879.30839
6140.0000 -242.78095 -231.15259 11.62836 2.77585 -232.64539 857.69611
6145.0000 -240.97158 -228.36558 12.60600 2.90848 -229.80706 938.81164
6150.0000 -242.91310 -229.68453 13.22857 2.90857 -229.80530 925.23229
6155.0000 -242.76592 -230.28459 12.48133 2.89703 -230.05210 920.84609
6160.0000 -239.18601 -227.80583 11.38018 2.94604 -229.00336 926.56932
6165.0000 -242.67051 -229.97502 12.69549 2.95216 -228.87238 922.95006
6170.0000 -243.11690 -230.90253 12.21437 2.90670 -229.84517 938.45857
6175.0000 -241.30275 -228.34910 12.95365 2.86934 -230.64472 914.95458
6180.0000 -240.88207 -228.45025 12.43182 2.97703 -228.34021 958.45646
6185.0000 -241.63985 -230.89879 10.74106 2.92190 -229.51996 939.26953
6190.0000 -242.31483 -232.56731 9.74752 2.80839 -231.94903 874.52308
6195.0000 -242.82835 -232.76745 10.06091 2.79837 -232.16345 874.35808
6200.0000 -240.96536 -229.07903 11.88632 2.86491 -230.73959 909.21867
6205.0000 -242.04936 -229.22167 12.82769 2.95316 -228.85087 970.90890
6210.0000 -243.10552 -230.29750 12.80803 2.88462 -230.31775 937.60185
6215.0000 -240.36008 -226.76140 13.59868 2.96880 -228.51630 962.97986
6220.0000 -240.07425 -227.81729 12.25695 3.01991 -227.42246 991.43510
6225.0000 -240.93405 -229.99114 10.94290 2.91753 -229.61348 924.67697
6230.0000 -240.67896 -230.47108 10.20787 2.87304 -230.56552 913.69420
6235.0000 -242.47739 -231.54430 10.93309 2.86136 -230.81546 903.40548
6240.0000 -242.83520 -230.73119 12.10401 2.84228 -231.22395 883.90262
6245.0000 -243.10307 -230.91302 12.19005 2.84666 -231.13012 895.03592
6250.0000 -243.12939 -232.10797 11.02142 2.83908 -231.29234 903.08595
MELTING PROCESS: loop number 26 T-loop= 942.00000000000000
main_MD> interactions number 26 at Temperature= 942.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.11709 -4.50819 -3.15121
force_rgl> df(natom) 1.51152 2.77599 -1.07177
6255.0000 -241.88980 -229.52260 12.36720 2.86708 -230.69304 915.43753
6260.0000 -241.05163 -229.24223 11.80939 2.89743 -230.04354 909.06336
6265.0000 -239.96968 -228.32054 11.64913 2.94603 -229.00357 951.87118
6270.0000 -241.66495 -230.37656 11.28839 2.91998 -229.56102 941.12066
6275.0000 -239.96444 -229.55789 10.40654 2.88181 -230.37798 905.45267
6280.0000 -242.13221 -230.22031 11.91190 2.93344 -229.27295 955.02604
6285.0000 -241.69719 -231.46476 10.23244 2.88540 -230.30104 912.20335
6290.0000 -240.83289 -229.96680 10.86609 2.84513 -231.16288 872.38143
6295.0000 -238.56725 -226.18910 12.37815 2.98720 -228.12255 987.88564
6300.0000 -240.16398 -226.64556 13.51843 3.03530 -227.09312 1018.07709
6305.0000 -238.86483 -226.33434 12.53049 3.01109 -227.61132 1010.06214
6310.0000 -239.11371 -228.23864 10.87507 2.97592 -228.36379 960.86223
6315.0000 -242.53234 -229.82991 12.70243 2.97501 -228.38328 973.07357
6320.0000 -241.72299 -227.86360 13.85939 2.95950 -228.71539 964.27354
6325.0000 -243.06534 -231.19173 11.87361 2.99575 -227.93952 1002.26639
6330.0000 -240.41495 -228.76528 11.64967 2.90484 -229.88495 919.70934
6335.0000 -241.77710 -228.64690 13.13020 2.94654 -228.99258 948.63092
6340.0000 -242.49255 -229.99993 12.49262 2.90850 -229.80676 943.28372
6345.0000 -242.17140 -230.12552 12.04588 2.88028 -230.41055 918.96783
6350.0000 -240.68628 -230.16965 10.51663 2.83844 -231.30597 899.44030
6355.0000 -242.04982 -229.12722 12.92261 2.91766 -229.61063 939.35229
6360.0000 -240.31492 -228.51768 11.79724 2.90575 -229.86549 935.94696
6365.0000 -240.46824 -229.80610 10.66215 2.94243 -229.08068 963.74236
6370.0000 -241.73972 -230.15421 11.58551 2.93162 -229.31198 954.51509
6375.0000 -241.37302 -229.58184 11.79119 2.90256 -229.93383 918.75480
6380.0000 -242.61472 -232.66963 9.94509 2.84507 -231.16415 900.03309
6385.0000 -241.52603 -230.07859 11.44744 2.84498 -231.16616 899.44651
6390.0000 -240.49656 -227.46716 13.02941 2.97293 -228.42778 976.57117
6395.0000 -241.34646 -229.93612 11.41034 2.97563 -228.37017 983.17496
6400.0000 -241.20858 -230.01566 11.19292 2.89975 -229.99395 926.18348
6405.0000 -242.11258 -230.65473 11.45785 2.93327 -229.27666 930.30198
6410.0000 -242.87160 -232.08405 10.78755 2.78222 -232.50913 842.59329
6415.0000 -244.29511 -233.24233 11.05279 2.75444 -233.10361 820.35395
6420.0000 -242.04119 -230.13168 11.90951 2.83048 -231.47628 887.05960
6425.0000 -241.80840 -229.05463 12.75376 2.95458 -228.82048 938.19557
6430.0000 -241.86659 -231.26880 10.59778 2.88239 -230.36556 928.67011
6435.0000 -239.36754 -227.00148 12.36607 2.96559 -228.58503 957.04910
6440.0000 -240.59791 -227.94112 12.65679 3.04526 -226.88000 1031.07539
6445.0000 -240.53585 -228.45252 12.08333 2.96276 -228.64548 959.39375
6450.0000 -241.87262 -229.32290 12.54973 2.90945 -229.78642 926.43751
6455.0000 -239.72102 -229.03117 10.68984 2.88079 -230.39982 910.02520
6460.0000 -241.22409 -229.54957 11.67451 2.91614 -229.64330 930.88110
6465.0000 -241.07865 -230.22529 10.85336 2.93063 -229.33304 939.66023
6470.0000 -241.93292 -230.55465 11.37826 2.90597 -229.86080 928.58866
6475.0000 -240.14544 -228.69382 11.45161 2.93547 -229.22946 968.23816
6480.0000 -241.48762 -229.53453 11.95309 2.92186 -229.52072 946.24820
6485.0000 -242.58613 -230.66924 11.91689 2.91592 -229.64783 929.69049
6490.0000 -241.60161 -229.54486 12.05675 2.91689 -229.62709 942.86021
6495.0000 -241.93282 -229.42647 12.50634 2.95758 -228.75642 980.34724
6500.0000 -241.53650 -230.42429 11.11221 2.90967 -229.78164 928.26537
MELTING PROCESS: loop number 27 T-loop= 967.00000000000000
main_MD> interactions number 27 at Temperature= 967.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.55765 -3.41690 6.06073
force_rgl> df(natom) -1.42321 -1.65345 -1.93889
6505.0000 -242.33666 -229.20614 13.13052 2.91065 -229.76061 913.03207
6510.0000 -239.83489 -226.95220 12.88269 2.97401 -228.40473 969.45954
6515.0000 -241.31969 -226.35998 14.95971 3.07362 -226.27297 1036.29435
6520.0000 -241.92085 -229.50117 12.41968 2.99672 -227.91882 972.59316
6525.0000 -240.61439 -228.18990 12.42449 2.98286 -228.21529 995.04034
6530.0000 -239.32409 -226.84035 12.48374 3.04679 -226.84732 980.85809
6535.0000 -240.43523 -228.60598 11.82926 2.99939 -227.86169 982.92490
6540.0000 -239.83607 -226.14794 13.68813 3.03354 -227.13084 1008.27619
6545.0000 -242.54723 -228.89359 13.65364 3.06798 -226.39371 1027.74965
6550.0000 -242.39750 -229.80020 12.59730 2.97041 -228.48187 963.79496
6555.0000 -241.56724 -228.56226 13.00499 2.91950 -229.57137 949.69420
6560.0000 -241.45647 -228.69486 12.76161 2.98109 -228.25315 992.28644
6565.0000 -240.38359 -228.19360 12.19000 3.02396 -227.33577 1011.50260
6570.0000 -241.36663 -228.68547 12.68117 2.94645 -228.99450 950.58290
6575.0000 -238.82714 -226.98649 11.84065 2.95779 -228.75180 971.36386
6580.0000 -239.67873 -227.75922 11.91951 2.98401 -228.19084 973.09220
6585.0000 -238.69848 -226.05728 12.64121 3.03415 -227.11776 1024.05361
6590.0000 -239.45118 -225.08184 14.36934 3.10329 -225.63816 1069.20582
6595.0000 -238.42425 -225.26408 13.16017 3.10142 -225.67813 1055.54849
6600.0000 -239.08238 -226.78058 12.30180 3.07247 -226.29770 1025.67946
6605.0000 -240.52419 -229.25665 11.26754 2.97518 -228.37982 951.74232
6610.0000 -241.21922 -228.50193 12.71730 2.98562 -228.15639 957.12874
6615.0000 -239.81262 -227.43585 12.37677 2.96818 -228.52946 981.21053
6620.0000 -240.54555 -227.17495 13.37061 3.00019 -227.84449 1006.77610
6625.0000 -241.84714 -229.49650 12.35064 2.94376 -229.05208 969.40215
6630.0000 -240.88232 -229.29310 11.58922 2.93253 -229.29255 935.92711
6635.0000 -241.31568 -229.66929 11.64639 2.93491 -229.24142 963.02321
6640.0000 -242.28224 -229.64359 12.63865 2.89516 -230.09221 924.33008
6645.0000 -240.90127 -228.31179 12.58948 2.92993 -229.34814 974.81116
6650.0000 -240.37824 -228.98021 11.39803 2.93584 -229.22161 951.68423
6655.0000 -240.16346 -228.52714 11.63632 2.94408 -229.04523 955.07512
6660.0000 -240.30095 -227.46409 12.83685 2.97715 -228.33760 979.77857
6665.0000 -241.25969 -228.06462 13.19506 3.03350 -227.13166 1009.42243
6670.0000 -240.65696 -229.70021 10.95675 2.98324 -228.20723 973.21718
6675.0000 -242.76517 -229.78976 12.97541 2.95020 -228.91438 961.45470
6680.0000 -242.39809 -231.43440 10.96370 2.91496 -229.66838 930.59580
6685.0000 -240.16273 -228.44449 11.71823 2.90977 -229.77961 941.15452
6690.0000 -240.00915 -227.90757 12.10158 2.97270 -228.43285 952.38824
6695.0000 -240.50002 -229.29333 11.20669 2.98573 -228.15393 973.18651
6700.0000 -240.90803 -229.51593 11.39209 2.95669 -228.77546 949.10312
6705.0000 -241.75608 -227.96607 13.79001 2.93799 -229.17566 942.83604
6710.0000 -241.77295 -231.08553 10.68743 2.91849 -229.59294 946.91710
6715.0000 -240.62194 -228.33310 12.28884 2.87041 -230.62187 912.29080
6720.0000 -238.69238 -224.91434 13.77804 3.05138 -226.74900 1018.38364
6725.0000 -241.04258 -227.60037 13.44222 3.07967 -226.14364 1051.54605
6730.0000 -239.98906 -226.93183 13.05723 3.03917 -227.01026 1024.85549
6735.0000 -240.02714 -226.16934 13.85780 3.06074 -226.54860 1013.17599
6740.0000 -238.85611 -226.17067 12.68544 3.06780 -226.39768 1008.12495
6745.0000 -241.29971 -229.73113 11.56858 3.01373 -227.55470 986.20069
6750.0000 -241.45881 -230.84909 10.60972 2.88880 -230.22839 933.32154
MELTING PROCESS: loop number 28 T-loop= 992.00000000000000
main_MD> interactions number 28 at Temperature= 992.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.04267 1.43158 2.64932
force_rgl> df(natom) -4.19077 1.22800 2.28241
6755.0000 -240.63970 -227.51646 13.12324 2.97160 -228.45642 974.39275
6760.0000 -242.44053 -228.58105 13.85947 2.99740 -227.90422 1007.86926
6765.0000 -240.36367 -228.94047 11.42320 2.99800 -227.89132 991.22173
6770.0000 -242.45137 -230.01651 12.43486 2.90703 -229.83808 929.41948
6775.0000 -239.12808 -226.94471 12.18336 2.98260 -228.22104 975.05924
6780.0000 -239.25593 -226.30202 12.95391 3.08493 -226.03101 1045.37367
6785.0000 -240.22473 -228.89583 11.32890 3.01109 -227.61114 1009.85510
6790.0000 -239.69527 -227.87119 11.82408 3.00927 -227.65023 983.60639
6795.0000 -240.60230 -226.68419 13.91811 3.04908 -226.79831 1020.44371
6800.0000 -240.67028 -227.88334 12.78694 3.10515 -225.59829 1042.10307
6805.0000 -239.65461 -225.08426 14.57034 3.03729 -227.05050 1005.94201
6810.0000 -239.65318 -226.15226 13.50093 3.13709 -224.91476 1060.89742
6815.0000 -240.90548 -228.76701 12.13846 2.97845 -228.30982 951.10038
6820.0000 -240.60629 -227.49902 13.10726 3.00841 -227.66864 988.49298
6825.0000 -242.10323 -230.73396 11.36927 2.86826 -230.66786 915.88038
6830.0000 -242.47507 -230.84612 11.62895 2.90272 -229.93031 932.07133
6835.0000 -239.62433 -226.67403 12.95030 2.96920 -228.50770 988.31160
6840.0000 -239.17716 -226.51756 12.65960 3.04443 -226.89769 1029.78326
6845.0000 -242.75932 -229.95363 12.80569 2.96802 -228.53288 964.27826
6850.0000 -239.74312 -226.85154 12.89159 2.93298 -229.28282 911.86855
6855.0000 -239.71089 -227.74694 11.96395 3.01919 -227.43795 994.29135
6860.0000 -240.49936 -227.83708 12.66228 3.02402 -227.33459 982.69968
6865.0000 -240.79588 -228.38771 12.40817 2.94798 -228.96186 959.20330
6870.0000 -239.77196 -227.16140 12.61056 3.00578 -227.72486 999.35539
6875.0000 -241.87997 -227.67480 14.20517 2.99456 -227.96491 985.20488
6880.0000 -243.01903 -229.23495 13.78407 2.98829 -228.09912 962.66702
6885.0000 -240.00450 -227.47756 12.52693 2.94932 -228.93304 940.17620
6890.0000 -239.62473 -226.19243 13.43230 3.08568 -226.01491 1026.64572
6895.0000 -241.96200 -227.96634 13.99566 3.06904 -226.37098 1035.27001
6900.0000 -239.58449 -226.91082 12.67367 3.00881 -227.65994 1007.78435
6905.0000 -242.21344 -227.90649 14.30695 3.02533 -227.30653 1012.78486
6910.0000 -239.55484 -225.92517 13.62967 3.03949 -227.00342 1017.39934
6915.0000 -240.16974 -228.01274 12.15700 3.04613 -226.86133 1004.11114
6920.0000 -240.79256 -227.99561 12.79695 2.97151 -228.45832 972.20155
6925.0000 -241.03263 -227.62986 13.40276 3.04369 -226.91366 999.56762
6930.0000 -239.66238 -227.74633 11.91605 2.98089 -228.25757 956.42722
6935.0000 -240.94445 -228.73293 12.21151 2.96780 -228.53764 966.29829
6940.0000 -238.49380 -224.56252 13.93128 3.06682 -226.41860 1030.34602
6945.0000 -240.40171 -227.26447 13.13724 3.05579 -226.65467 1025.82440
6950.0000 -238.45403 -225.89330 12.56073 3.08427 -226.04525 1047.97177
6955.0000 -240.00293 -226.54424 13.45869 3.09443 -225.82766 1054.70400
6960.0000 -238.88130 -227.69107 11.19023 3.06325 -226.49492 1059.73775
6965.0000 -241.78808 -229.95137 11.83671 2.96624 -228.57109 968.77928
6970.0000 -242.05222 -230.02946 12.02276 2.94135 -229.10363 950.54762
6975.0000 -236.80549 -224.88277 11.92273 3.02479 -227.31813 998.44441
6980.0000 -239.63901 -225.36400 14.27501 3.12096 -225.26000 1054.81871
6985.0000 -239.96831 -228.84409 11.12422 3.07752 -226.18956 1060.32780
6990.0000 -240.15722 -226.76420 13.39302 2.97983 -228.28014 974.09083
6995.0000 -239.81533 -228.51642 11.29891 2.96535 -228.59006 955.08454
7000.0000 -240.38157 -228.50730 11.87428 3.02217 -227.37402 980.62199
MELTING PROCESS: loop number 29 T-loop= 1017.0000000000000
main_MD> interactions number 29 at Temperature= 1017.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.35852 -0.38584 2.72218
force_rgl> df(natom) -0.78391 -2.57045 1.67299
7005.0000 -239.00525 -225.62064 13.38461 3.13843 -224.88605 1043.11366
7010.0000 -241.74071 -227.84631 13.89440 3.06246 -226.51191 1021.46917
7015.0000 -240.97486 -228.29861 12.67625 2.95249 -228.86525 938.11816
7020.0000 -240.21980 -226.93427 13.28553 3.10251 -225.65486 1028.97584
7025.0000 -238.76750 -227.32420 11.44331 3.06045 -226.55482 1000.71927
7030.0000 -238.74613 -225.66936 13.07677 3.04542 -226.87646 1007.59546
7035.0000 -238.43725 -225.96424 12.47301 3.06988 -226.35303 1012.62638
7040.0000 -238.50979 -227.10517 11.40462 3.01697 -227.48538 998.39865
7045.0000 -240.71578 -229.21127 11.50451 3.03757 -227.04459 1016.48450
7050.0000 -240.25842 -226.92208 13.33634 3.04449 -226.89650 993.78116
7055.0000 -239.77717 -226.73949 13.03768 3.02058 -227.40824 1000.14801
7060.0000 -237.98457 -224.00361 13.98096 3.09727 -225.76701 1053.71110
7065.0000 -239.94445 -225.77320 14.17125 3.11857 -225.31114 1054.18672
7070.0000 -239.39871 -227.14834 12.25037 3.06472 -226.46354 1035.73651
7075.0000 -240.78068 -229.44949 11.33120 2.97489 -228.38589 988.17980
7080.0000 -239.76450 -228.22401 11.54049 2.97861 -228.30642 948.38080
7085.0000 -241.02111 -227.59106 13.43006 2.99398 -227.97747 984.06713
7090.0000 -238.98371 -224.61647 14.36724 3.09017 -225.91890 1057.96236
7095.0000 -238.19348 -225.67915 12.51432 3.10679 -225.56328 1026.36283
7100.0000 -238.90659 -224.98623 13.92037 3.11894 -225.30319 1020.45441
7105.0000 -241.04553 -228.44607 12.59946 3.02393 -227.33639 1015.87302
7110.0000 -242.32122 -230.25638 12.06483 2.93906 -229.15278 952.38445
7115.0000 -238.41076 -227.34168 11.06907 2.92467 -229.46076 928.41217
7120.0000 -239.60664 -226.81879 12.78785 3.02943 -227.21880 1006.94875
7125.0000 -239.34342 -226.91841 12.42501 3.03619 -227.07414 1008.58695
7130.0000 -238.77715 -225.52211 13.25503 3.05383 -226.69664 1031.54582
7135.0000 -240.75901 -229.40201 11.35699 3.02406 -227.33358 1007.99959
7140.0000 -238.19681 -225.67984 12.51698 3.05481 -226.67550 1027.17827
7145.0000 -239.05190 -224.67863 14.37326 3.12447 -225.18495 1059.69451
7150.0000 -240.42086 -227.68697 12.73389 3.12305 -225.21529 1051.74572
7155.0000 -238.69328 -225.17210 13.52118 3.10386 -225.62585 1029.91255
7160.0000 -238.53415 -225.88282 12.65132 3.11428 -225.40289 1064.64010
7165.0000 -237.96568 -225.59506 12.37062 3.09113 -225.89834 1052.85510
7170.0000 -241.48538 -228.68721 12.79817 3.07382 -226.26870 1029.89675
7175.0000 -241.82110 -229.78037 12.04073 2.94353 -229.05709 968.49086
7180.0000 -240.26087 -228.01448 12.24638 2.96520 -228.59325 972.31660
7185.0000 -239.77288 -225.89819 13.87469 3.01942 -227.43304 974.50565
7190.0000 -242.38398 -228.55309 13.83089 3.04752 -226.83154 1012.21897
7195.0000 -243.73943 -231.34926 12.39017 2.87004 -230.62981 917.30113
7200.0000 -241.55801 -229.18930 12.36871 2.90274 -229.93002 953.98553
7205.0000 -241.04315 -228.04132 13.00183 2.96134 -228.67589 958.93152
7210.0000 -241.88006 -228.03314 13.84692 3.00396 -227.76386 989.77468
7215.0000 -238.42733 -226.67192 11.75541 3.02683 -227.27450 1005.51113
7220.0000 -239.73846 -226.89292 12.84554 3.02781 -227.25347 1008.40942
7225.0000 -239.98408 -228.21891 11.76517 2.98953 -228.07267 956.75533
7230.0000 -241.14314 -227.78176 13.36138 2.99200 -228.01981 997.48282
7235.0000 -240.16065 -228.75620 11.40444 2.99519 -227.95158 949.39639
7240.0000 -239.79135 -227.59115 12.20020 2.99946 -227.86004 957.74788
7245.0000 -240.14500 -228.15575 11.98925 2.93714 -229.19385 936.43147
7250.0000 -239.42446 -226.51604 12.90842 3.01275 -227.57570 1009.04045
MELTING PROCESS: loop number 30 T-loop= 1042.0000000000000
main_MD> interactions number 30 at Temperature= 1042.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.35082 3.10483 -1.65623
force_rgl> df(natom) 2.06950 -3.38582 -1.50379
7255.0000 -238.66402 -226.47550 12.18852 3.06079 -226.54774 1020.87375
7260.0000 -240.21327 -227.91687 12.29640 3.01814 -227.46030 982.82550
7265.0000 -239.69702 -225.07936 14.61766 3.11750 -225.33394 1076.35765
7270.0000 -239.07210 -223.72290 15.34920 3.18090 -223.97716 1086.61766
7275.0000 -239.42479 -224.73264 14.69215 3.14638 -224.71593 1068.29480
7280.0000 -238.91481 -226.59840 12.31642 3.12834 -225.10200 1039.65119
7285.0000 -239.72847 -227.88217 11.84630 3.08107 -226.11362 1018.74317
7290.0000 -238.56229 -226.68993 11.87236 3.05203 -226.73515 1017.66558
7295.0000 -238.45395 -226.57319 11.88076 3.01875 -227.44724 992.66795
7300.0000 -238.86501 -225.42106 13.44394 3.03640 -227.06954 992.22861
7305.0000 -240.01341 -226.77847 13.23494 3.10781 -225.54147 1060.28897
7310.0000 -242.65320 -228.82033 13.83287 3.05400 -226.69300 1011.09448
7315.0000 -238.59285 -225.81982 12.77304 3.00486 -227.74457 1012.09523
7320.0000 -236.80956 -225.08739 11.72217 3.07516 -226.24018 1015.07758
7325.0000 -238.87330 -225.59592 13.27738 3.11213 -225.44890 1033.56397
7330.0000 -241.54061 -227.33324 14.20737 3.05379 -226.69748 1013.21055
7335.0000 -240.72894 -226.20644 14.52250 3.06251 -226.51085 1031.06356
7340.0000 -238.71518 -224.72911 13.98607 3.16454 -224.32735 1098.48429
7345.0000 -238.01837 -223.99618 14.02219 3.12894 -225.08909 1103.74038
7350.0000 -237.26428 -223.16106 14.10322 3.16796 -224.25406 1084.00005
7355.0000 -239.46324 -227.39662 12.06662 3.12007 -225.27901 1047.02680
7360.0000 -240.40690 -228.53878 11.86812 2.99694 -227.91410 968.60385
7365.0000 -242.44221 -228.66130 13.78091 2.91295 -229.71153 931.71535
7370.0000 -241.29654 -227.44673 13.84981 2.99196 -228.02053 985.43616
7375.0000 -241.26894 -227.69508 13.57386 3.00853 -227.66599 990.20677
7380.0000 -239.95872 -227.03443 12.92429 3.02350 -227.34555 991.95816
7385.0000 -237.35304 -225.83846 11.51458 3.01711 -227.48250 997.90386
7390.0000 -240.59456 -225.41992 15.17464 3.04441 -226.89824 1009.05388
7395.0000 -240.49601 -227.21372 13.28229 3.09055 -225.91085 1029.25859
7400.0000 -239.42125 -227.00411 12.41714 3.03195 -227.16489 1005.98794
7405.0000 -241.41757 -228.31183 13.10574 2.98880 -228.08826 973.99379
7410.0000 -241.74609 -230.87779 10.86830 2.90368 -229.90981 932.98814
7415.0000 -241.27302 -227.28317 13.98985 2.96965 -228.49810 962.26011
7420.0000 -238.31827 -225.45811 12.86016 3.07838 -226.17118 1054.97233
7425.0000 -237.02518 -223.97340 13.05178 3.12253 -225.22642 1050.34820
7430.0000 -238.22550 -224.25059 13.97492 3.16667 -224.28166 1103.89909
7435.0000 -241.18388 -227.69753 13.48635 3.08609 -226.00628 1051.10885
7440.0000 -240.34814 -226.78077 13.56737 3.01608 -227.50437 992.43508
7445.0000 -239.66397 -229.03398 10.62999 3.01816 -227.45999 1006.14020
7450.0000 -239.94049 -227.65512 12.28536 2.93869 -229.16062 943.00765
7455.0000 -239.15702 -226.87414 12.28287 3.03739 -227.04833 1007.44362
7460.0000 -238.92384 -227.06143 11.86241 3.04572 -226.87012 987.45023
7465.0000 -241.25667 -229.59805 11.65863 3.00564 -227.72779 1009.40909
7470.0000 -238.99093 -226.66189 12.32904 3.01724 -227.47966 997.40213
7475.0000 -241.79367 -230.58863 11.20504 2.98355 -228.20053 968.92307
7480.0000 -238.88319 -226.85128 12.03191 2.95661 -228.77719 961.57988
7485.0000 -239.28947 -223.13562 16.15385 3.13002 -225.06618 1069.56122
7490.0000 -238.14859 -223.98535 14.16325 3.15526 -224.52600 1086.89944
7495.0000 -240.60458 -225.74761 14.85697 3.18615 -223.86487 1133.56611
7500.0000 -240.29307 -224.01239 16.28068 3.11752 -225.33354 1059.41516
MELTING PROCESS: loop number 31 T-loop= 1067.0000000000000
main_MD> interactions number 31 at Temperature= 1067.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.72044 0.66177 1.45709
force_rgl> df(natom) 0.32788 -0.33696 1.77957
7505.0000 -236.80084 -222.62222 14.17862 3.22990 -222.92850 1135.74372
7510.0000 -236.21372 -221.90169 14.31203 3.22005 -223.13947 1133.57985
7515.0000 -237.82595 -224.59181 13.23414 3.22374 -223.06032 1140.01569
7520.0000 -237.35583 -222.87261 14.48322 3.20121 -223.54268 1087.99606
7525.0000 -239.46401 -226.24105 13.22295 3.14002 -224.85200 1065.20614
7530.0000 -238.23841 -225.66153 12.57689 3.12530 -225.16700 1062.31817
7535.0000 -238.65527 -222.96452 15.69075 3.19073 -223.76675 1110.10850
7540.0000 -236.49076 -223.42020 13.07056 3.25866 -222.31305 1147.41506
7545.0000 -235.38377 -221.21212 14.17165 3.32872 -220.81382 1159.77523
7550.0000 -235.99260 -219.88636 16.10624 3.36641 -220.00721 1200.60416
7555.0000 -237.73378 -222.17268 15.56110 3.37092 -219.91074 1232.17137
7560.0000 -237.96772 -225.44540 12.52232 3.17499 -224.10364 1097.50314
7565.0000 -240.87494 -227.06532 13.80962 3.10786 -225.54031 1056.89567
7570.0000 -236.19075 -223.12605 13.06471 3.11242 -225.44267 1049.20823
7575.0000 -239.86847 -225.11524 14.75323 3.19836 -223.60362 1064.93807
7580.0000 -237.06919 -222.84303 14.22616 3.17234 -224.16041 1086.06243
7585.0000 -238.21042 -221.99914 16.21128 3.19794 -223.61264 1115.00726
7590.0000 -238.00154 -224.08917 13.91237 3.20498 -223.46194 1103.47850
7595.0000 -239.89767 -226.52948 13.36820 3.08394 -226.05213 1067.93850
7600.0000 -239.06460 -227.55838 11.50622 2.93859 -229.16279 979.49725
7605.0000 -238.15947 -225.83781 12.32166 3.11850 -225.31268 1050.89568
7610.0000 -238.14513 -223.22151 14.92362 3.15827 -224.46142 1059.16998
7615.0000 -238.17328 -225.72631 12.44698 3.13563 -224.94604 1063.75151
7620.0000 -239.20913 -226.14237 13.06675 3.08677 -225.99168 1036.38891
7625.0000 -237.33516 -224.24278 13.09238 3.13435 -224.97335 1035.24397
7630.0000 -237.74127 -221.69628 16.04499 3.21965 -223.14799 1108.91108
7635.0000 -238.18211 -223.98001 14.20210 3.25508 -222.38970 1146.20654
7640.0000 -238.94431 -226.76877 12.17554 3.13248 -225.01339 1051.68803
7645.0000 -239.47430 -225.38633 14.08797 3.05752 -226.61761 1034.44874
7650.0000 -237.30869 -224.38477 12.92392 3.16720 -224.27040 1095.25335
7655.0000 -239.11996 -223.22253 15.89744 3.21024 -223.34930 1111.32261
7660.0000 -238.54486 -225.07990 13.46496 3.16384 -224.34235 1080.78700
7665.0000 -237.55024 -223.64112 13.90912 3.19747 -223.62261 1105.89776
7670.0000 -240.63267 -227.85870 12.77398 3.07352 -226.27526 1036.87157
7675.0000 -238.31550 -224.07970 14.23579 3.06594 -226.43741 1014.35624
7680.0000 -238.33602 -224.40687 13.92915 3.15815 -224.46416 1090.52831
7685.0000 -239.24726 -224.77868 14.46858 3.14975 -224.64378 1059.52058
7690.0000 -238.66554 -222.28300 16.38254 3.23385 -222.84409 1123.88935
7695.0000 -238.97286 -223.59140 15.38146 3.26146 -222.25315 1161.93383
7700.0000 -237.23717 -221.47141 15.76576 3.30744 -221.26918 1166.03772
7705.0000 -237.22359 -223.31438 13.90920 3.22079 -223.12362 1132.76838
7710.0000 -237.94792 -222.88345 15.06446 3.19462 -223.68366 1103.61291
7715.0000 -237.81581 -225.35606 12.45975 3.19691 -223.63459 1102.39196
7720.0000 -238.05513 -224.31298 13.74215 3.17716 -224.05729 1106.99384
7725.0000 -237.48741 -224.58013 12.90729 3.18816 -223.82192 1102.63964
7730.0000 -237.52903 -224.87881 12.65022 3.17300 -224.14634 1093.88494
7735.0000 -239.51970 -225.33032 14.18938 3.15437 -224.54500 1076.13692
7740.0000 -236.30753 -222.68734 13.62019 3.16931 -224.22534 1086.27151
7745.0000 -237.70698 -224.00897 13.69801 3.18590 -223.87022 1087.56827
7750.0000 -238.15507 -222.91698 15.23809 3.21083 -223.33667 1093.11473
MELTING PROCESS: loop number 32 T-loop= 1092.0000000000000
main_MD> interactions number 32 at Temperature= 1092.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.69127 1.08544 -4.26780
force_rgl> df(natom) 0.11043 -0.99669 -5.38976
7755.0000 -236.39660 -221.61986 14.77674 3.24888 -222.52235 1134.57813
7760.0000 -238.80243 -221.72970 17.07273 3.25695 -222.34966 1150.02497
7765.0000 -236.89541 -222.44710 14.44831 3.23244 -222.87418 1118.64266
7770.0000 -239.82820 -223.98808 15.84012 3.22286 -223.07921 1148.03847
7775.0000 -238.84487 -224.16824 14.67664 3.17895 -224.01904 1087.78955
7780.0000 -238.97208 -224.91348 14.05860 3.12072 -225.26509 1033.88351
7785.0000 -237.34150 -223.83196 13.50954 3.19493 -223.67694 1103.71534
7790.0000 -237.65119 -224.02153 13.62966 3.18964 -223.79023 1118.93275
7795.0000 -238.55717 -226.25452 12.30265 3.18013 -223.99360 1132.87148
7800.0000 -235.94591 -221.77971 14.16620 3.22220 -223.09348 1116.29593
7805.0000 -239.33023 -224.35013 14.98010 3.20695 -223.41983 1102.62178
7810.0000 -239.39039 -225.09417 14.29622 3.15149 -224.60659 1097.62460
7815.0000 -240.39292 -227.25750 13.13542 3.07190 -226.30980 1027.21096
7820.0000 -238.34120 -224.85990 13.48130 3.09875 -225.73537 1049.36776
7825.0000 -238.31469 -223.90057 14.41412 3.18191 -223.95562 1100.67297
7830.0000 -237.39804 -224.72231 12.67573 3.15997 -224.42521 1079.16124
7835.0000 -239.09657 -224.24069 14.85588 3.12150 -225.24842 1067.88772
7840.0000 -237.32367 -224.69964 12.62403 3.11815 -225.32006 1028.86679
7845.0000 -236.73571 -222.96659 13.76912 3.22450 -223.04406 1120.32527
7850.0000 -235.49652 -221.45651 14.04001 3.23252 -222.87249 1125.15079
7855.0000 -239.99663 -224.15367 15.84296 3.24221 -222.66516 1127.38077
7860.0000 -239.11755 -224.99865 14.11890 3.16085 -224.40622 1076.46563
7865.0000 -238.28803 -222.61788 15.67015 3.23033 -222.91946 1128.39771
7870.0000 -236.94583 -223.65319 13.29263 3.23066 -222.91230 1115.64412
7875.0000 -238.07054 -224.71844 13.35210 3.13187 -225.02655 1051.55081
7880.0000 -239.68005 -226.81431 12.86575 3.09300 -225.85824 1080.07983
7885.0000 -237.65468 -225.59855 12.05612 3.02232 -227.37102 978.80447
7890.0000 -238.49934 -225.88911 12.61023 3.14418 -224.76308 1066.02746
7895.0000 -241.19164 -227.70679 13.48484 3.01803 -227.46282 986.26626
7900.0000 -240.79316 -225.11528 15.67788 3.04274 -226.93390 1027.60498
7905.0000 -237.48763 -223.41865 14.06898 3.17468 -224.11024 1123.19969
7910.0000 -237.57099 -224.09842 13.47257 3.19581 -223.65818 1122.45625
7915.0000 -233.71893 -217.91287 15.80606 3.31716 -221.06115 1183.70415
7920.0000 -236.08439 -224.58411 11.50028 3.28374 -221.77636 1125.38803
7925.0000 -237.12863 -221.57286 15.55577 3.16285 -224.36360 1090.72800
7930.0000 -238.52757 -221.48777 17.03980 3.33259 -220.73093 1198.81856
7935.0000 -237.49705 -223.13324 14.36381 3.30970 -221.22088 1175.01689
7940.0000 -237.56410 -223.31722 14.24688 3.17846 -224.02935 1082.51992
7945.0000 -240.05327 -224.39784 15.65543 3.19616 -223.65070 1118.13811
7950.0000 -236.49674 -223.39783 13.09891 3.11238 -225.44351 1070.80970
7955.0000 -238.46974 -224.29474 14.17500 3.19383 -223.70047 1087.77242
7960.0000 -240.72837 -228.39980 12.32857 3.07003 -226.34995 1028.39704
7965.0000 -240.76482 -227.77957 12.98526 2.98561 -228.15649 984.82970
7970.0000 -239.80849 -225.50794 14.30055 3.08556 -226.01754 1057.23625
7975.0000 -237.44307 -223.10968 14.33339 3.19842 -223.60231 1122.17047
7980.0000 -238.93902 -225.69480 13.24422 3.11668 -225.35163 1059.19640
7985.0000 -241.25553 -227.58307 13.67247 3.04599 -226.86445 1015.40640
7990.0000 -238.69503 -224.34337 14.35166 3.02548 -227.30333 1011.66361
7995.0000 -235.70378 -220.67845 15.02534 3.24271 -222.65448 1151.84484
8000.0000 -236.81535 -222.64093 14.17442 3.26646 -222.14614 1129.42468
MELTING PROCESS: loop number 33 T-loop= 1117.0000000000000
main_MD> interactions number 33 at Temperature= 1117.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.18528 1.50973 0.54973
force_rgl> df(natom) 1.42661 -4.49202 -0.11866
8005.0000 -237.04759 -223.54327 13.50432 3.26771 -222.11936 1168.29881
8010.0000 -238.13689 -223.03214 15.10475 3.18324 -223.92718 1109.54335
8015.0000 -237.00084 -225.88555 11.11529 3.13743 -224.90749 1050.87232
8020.0000 -234.61427 -221.07635 13.53793 3.18271 -223.93843 1092.80227
8025.0000 -235.88008 -219.26727 16.61281 3.38561 -219.59643 1227.28862
8030.0000 -238.02525 -222.34417 15.68108 3.30468 -221.32829 1143.97122
8035.0000 -236.91342 -222.89692 14.01650 3.24475 -222.61084 1115.09269
8040.0000 -238.05711 -223.02298 15.03413 3.21809 -223.18142 1105.12240
8045.0000 -236.35934 -221.33902 15.02033 3.28033 -221.84942 1142.99187
8050.0000 -236.30305 -221.35328 14.94977 3.29281 -221.58225 1191.03605
8055.0000 -238.46305 -224.36496 14.09809 3.32051 -220.98955 1194.38687
8060.0000 -238.01182 -223.71144 14.30039 3.19637 -223.64621 1067.66100
8065.0000 -239.31717 -225.68240 13.63476 3.12124 -225.25398 1047.67220
8070.0000 -238.20748 -224.69838 13.50911 3.18595 -223.86914 1135.34469
8075.0000 -238.75225 -224.74110 14.01115 3.12137 -225.25118 1055.74759
8080.0000 -239.94396 -225.37592 14.56803 3.07379 -226.26945 1053.10617
8085.0000 -237.33439 -223.81248 13.52191 3.18180 -223.95798 1082.33796
8090.0000 -235.41091 -221.18881 14.22210 3.25035 -222.49090 1152.18485
8095.0000 -236.99369 -220.27276 16.72093 3.29051 -221.63147 1167.10367
8100.0000 -237.82387 -223.08411 14.73976 3.27553 -221.95204 1159.81316
8105.0000 -235.88205 -222.69326 13.18879 3.26937 -222.08386 1142.56448
8110.0000 -238.03371 -225.33098 12.70273 3.17639 -224.07382 1091.26076
8115.0000 -239.36166 -227.02801 12.33365 3.13592 -224.93990 1082.46592
8120.0000 -240.67329 -227.54214 13.13115 3.07704 -226.19987 1060.07509
8125.0000 -239.77740 -228.09805 11.67935 3.05886 -226.58902 1031.72307
8130.0000 -239.88706 -226.07095 13.81611 3.01458 -227.53646 1004.02380
8135.0000 -238.63051 -224.41583 14.21468 3.08816 -225.96193 1063.75878
8140.0000 -236.91549 -223.69773 13.21776 3.21161 -223.32001 1123.81751
8145.0000 -236.90437 -223.25469 13.64968 3.22884 -222.95122 1105.63136
8150.0000 -239.01774 -224.19124 14.82650 3.20451 -223.47190 1100.25731
8155.0000 -237.31042 -222.91723 14.39319 3.18302 -223.93187 1086.94922
8160.0000 -236.75745 -221.62007 15.13738 3.27372 -221.99073 1129.05244
8165.0000 -239.31778 -222.71573 16.60205 3.23530 -222.81297 1123.29071
8170.0000 -237.31320 -222.92862 14.38458 3.18583 -223.87172 1101.18299
8175.0000 -237.05844 -223.96197 13.09647 3.15817 -224.46355 1071.42059
8180.0000 -238.58443 -223.55665 15.02778 3.23202 -222.88326 1130.59496
8185.0000 -236.33757 -222.55200 13.78557 3.19406 -223.69562 1088.14928
8190.0000 -239.21887 -222.54986 16.66901 3.25932 -222.29904 1177.60311
8195.0000 -238.04664 -222.21451 15.83213 3.31869 -221.02836 1223.46851
8200.0000 -236.82442 -223.58303 13.24140 3.26345 -222.21051 1137.36864
8205.0000 -236.43604 -222.92424 13.51180 3.26572 -222.16194 1143.44454
8210.0000 -234.17448 -221.27666 12.89783 3.24524 -222.60039 1086.39672
8215.0000 -236.67535 -223.40642 13.26893 3.23856 -222.74333 1116.30365
8220.0000 -236.03386 -222.14831 13.88555 3.26486 -222.18038 1159.14532
8225.0000 -239.42710 -226.28209 13.14501 3.18434 -223.90368 1110.01780
8230.0000 -238.07412 -224.55824 13.51588 3.07691 -226.20271 1029.38966
8235.0000 -238.26073 -222.51661 15.74412 3.12736 -225.12292 1042.49581
8240.0000 -235.61535 -220.05332 15.56203 3.32848 -220.81904 1169.69918
8245.0000 -236.06048 -224.83467 11.22581 3.27309 -222.00429 1148.04285
8250.0000 -239.41597 -224.86050 14.55548 3.15548 -224.52132 1060.03928
MELTING PROCESS: loop number 34 T-loop= 1142.0000000000000
main_MD> interactions number 34 at Temperature= 1142.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.67242 1.06951 1.48948
force_rgl> df(natom) 0.68981 5.42449 -3.99619
8255.0000 -236.36086 -223.68940 12.67146 3.18699 -223.84684 1093.99825
8260.0000 -238.60806 -224.68252 13.92555 3.16911 -224.22960 1068.11992
8265.0000 -236.23133 -223.37968 12.85164 3.16610 -224.29393 1096.10152
8270.0000 -235.92507 -222.78113 13.14394 3.26211 -222.23925 1118.48334
8275.0000 -238.66542 -224.72062 13.94481 3.25279 -222.43869 1137.71942
8280.0000 -236.97541 -223.67130 13.30411 3.14723 -224.69769 1077.05177
8285.0000 -236.88103 -224.48156 12.39947 3.25112 -222.47446 1140.82216
8290.0000 -235.58292 -219.48145 16.10147 3.28052 -221.84534 1153.67289
8295.0000 -235.36938 -219.19525 16.17414 3.42963 -218.65418 1231.28165
8300.0000 -235.81992 -220.52977 15.29016 3.39673 -219.35835 1181.27162
8305.0000 -241.00307 -227.15941 13.84366 3.18543 -223.88017 1086.82513
8310.0000 -238.19294 -223.96573 14.22721 3.13539 -224.95106 1077.77286
8315.0000 -238.67652 -224.00210 14.67443 3.22146 -223.10925 1122.31238
8320.0000 -239.11714 -222.95102 16.16611 3.20425 -223.47763 1112.73386
8325.0000 -237.90901 -224.96960 12.93941 3.19535 -223.66802 1100.88052
8330.0000 -240.48133 -224.30272 16.17861 3.05077 -226.76199 1037.22771
8335.0000 -237.15057 -219.64860 17.50197 3.27437 -221.97688 1145.75382
8340.0000 -235.00004 -222.62362 12.37642 3.29697 -221.49332 1171.55494
8345.0000 -238.81577 -223.13329 15.68248 3.24635 -222.57654 1121.14211
8350.0000 -236.73598 -223.57308 13.16289 3.18368 -223.91775 1065.29869
8355.0000 -238.43942 -224.45149 13.98793 3.17881 -224.02205 1087.25537
8360.0000 -237.81386 -223.53179 14.28207 3.21560 -223.23473 1124.59339
8365.0000 -235.10700 -220.83758 14.26943 3.23630 -222.79156 1111.67828
8370.0000 -236.92473 -221.50299 15.42173 3.33595 -220.65909 1194.34597
8375.0000 -237.53497 -222.31300 15.22196 3.20579 -223.44465 1123.20234
8380.0000 -236.78276 -219.95353 16.82924 3.30080 -221.41125 1169.74075
8385.0000 -233.91761 -218.96895 14.94867 3.43613 -218.51521 1263.74499
8390.0000 -233.20442 -218.28865 14.91577 3.46800 -217.83313 1270.00480
8395.0000 -234.92081 -220.56262 14.35819 3.40504 -219.18043 1226.61664
8400.0000 -235.04199 -220.85234 14.18965 3.30543 -221.31225 1162.55195
8405.0000 -236.33528 -218.72555 17.60973 3.35431 -220.26621 1209.23184
8410.0000 -238.24900 -220.72121 17.52779 3.40517 -219.17780 1257.90670
8415.0000 -235.32171 -220.48554 14.83617 3.33255 -220.73192 1186.83163
8420.0000 -237.34419 -223.57005 13.77414 3.24166 -222.67696 1120.73781
8425.0000 -235.71383 -222.42695 13.28688 3.18535 -223.88194 1094.28935
8430.0000 -239.23797 -224.66010 14.57787 3.20254 -223.51411 1099.79571
8435.0000 -236.91841 -221.04886 15.86955 3.19601 -223.65388 1104.69178
8440.0000 -237.53719 -222.73413 14.80306 3.27981 -221.86046 1146.69413
8445.0000 -239.32959 -223.37601 15.95358 3.24619 -222.57994 1154.03024
8450.0000 -238.22665 -225.43498 12.79167 3.08464 -226.03727 1050.87548
8455.0000 -238.91841 -224.76817 14.15024 3.09419 -225.83281 1057.21942
8460.0000 -239.04054 -225.20274 13.83780 3.11729 -225.33853 1065.74697
8465.0000 -237.03504 -223.98339 13.05165 3.10924 -225.51081 1057.18246
8470.0000 -239.86489 -225.54884 14.31605 3.11836 -225.31551 1055.64327
8475.0000 -238.18280 -223.50167 14.68112 3.15611 -224.50764 1080.30691
8480.0000 -237.58873 -223.65147 13.93727 3.18606 -223.86678 1116.70612
8485.0000 -238.35338 -224.38678 13.96660 3.23387 -222.84363 1144.47747
8490.0000 -237.49265 -224.26287 13.22978 3.13071 -225.05128 1044.27588
8495.0000 -239.65145 -224.41621 15.23525 3.15556 -224.51955 1085.59423
8500.0000 -237.06788 -223.00301 14.06487 3.14456 -224.75485 1084.22075
MELTING PROCESS: loop number 35 T-loop= 1167.0000000000000
main_MD> interactions number 35 at Temperature= 1167.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20776 -1.08676 4.27424
force_rgl> df(natom) 0.70266 0.48040 3.71566
8505.0000 -239.51047 -224.98397 14.52651 3.23671 -222.78280 1135.58017
8510.0000 -234.17311 -219.26424 14.90887 3.25464 -222.39924 1137.22734
8515.0000 -236.04106 -222.30969 13.73137 3.37684 -219.78394 1217.92982
8520.0000 -234.60462 -221.03146 13.57316 3.28134 -221.82766 1138.54187
8525.0000 -237.03170 -221.74679 15.28491 3.26453 -222.18747 1160.35357
8530.0000 -236.72707 -221.62495 15.10212 3.20436 -223.47526 1123.72112
8535.0000 -236.04355 -222.08481 13.95874 3.24979 -222.50293 1158.33129
8540.0000 -234.14203 -220.03632 14.10570 3.31246 -221.16185 1180.39702
8545.0000 -236.80635 -222.86983 13.93651 3.30600 -221.30010 1169.36058
8550.0000 -237.94200 -223.08133 14.86066 3.25176 -222.46086 1149.66707
8555.0000 -236.12972 -221.85803 14.27170 3.22577 -223.01693 1140.15812
8560.0000 -239.40629 -223.25352 16.15277 3.23688 -222.77916 1149.22830
8565.0000 -238.52356 -223.95553 14.56803 3.21294 -223.29153 1114.28537
8570.0000 -236.62614 -222.33857 14.28757 3.23566 -222.80528 1122.43712
8575.0000 -236.53620 -221.27772 15.25848 3.32497 -220.89402 1160.37233
8580.0000 -234.33636 -220.78803 13.54833 3.36834 -219.96593 1207.42123
8585.0000 -238.02069 -222.41515 15.60554 3.26883 -222.09558 1154.05515
8590.0000 -235.54719 -221.38177 14.16541 3.28071 -221.84134 1170.04070
8595.0000 -237.52769 -223.22640 14.30129 3.30221 -221.38111 1159.45630
8600.0000 -236.42958 -221.68103 14.74856 3.23839 -222.74696 1134.46611
8605.0000 -236.65589 -222.52465 14.13124 3.23708 -222.77502 1131.07426
8610.0000 -234.61742 -220.81639 13.80103 3.23471 -222.82572 1111.51491
8615.0000 -235.83670 -222.46052 13.37618 3.29506 -221.53421 1162.87459
8620.0000 -238.01245 -222.75927 15.25318 3.28343 -221.78311 1167.39223
8625.0000 -237.48426 -224.21821 13.26605 3.16432 -224.33196 1073.47479
8630.0000 -236.94638 -222.21913 14.72725 3.23657 -222.78577 1130.49392
8635.0000 -236.44775 -222.10952 14.33824 3.23368 -222.84777 1131.88734
8640.0000 -238.71871 -224.35382 14.36489 3.22829 -222.96298 1131.27066
8645.0000 -235.20978 -220.87936 14.33041 3.29087 -221.62382 1168.26597
8650.0000 -235.10481 -221.80461 13.30019 3.35209 -220.31359 1171.50451
8655.0000 -237.92493 -222.53281 15.39212 3.27070 -222.05537 1159.51633
8660.0000 -236.30580 -223.06014 13.24566 3.26655 -222.14432 1145.48740
8665.0000 -236.62785 -221.53299 15.09486 3.25786 -222.33021 1125.66121
8670.0000 -237.39442 -223.55191 13.84251 3.23683 -222.78029 1113.24896
8675.0000 -237.06124 -221.91575 15.14549 3.19167 -223.74670 1099.48753
8680.0000 -235.87170 -221.85167 14.02003 3.32157 -220.96684 1188.01025
8685.0000 -237.87780 -224.44356 13.43423 3.25641 -222.36118 1153.13386
8690.0000 -237.58791 -221.39669 16.19122 3.16870 -224.23836 1056.18189
8695.0000 -235.44774 -219.55572 15.89202 3.33706 -220.63541 1144.29407
8700.0000 -235.10438 -221.02541 14.07897 3.36463 -220.04529 1176.22127
8705.0000 -235.31022 -220.78773 14.52249 3.32122 -220.97441 1180.44321
8710.0000 -238.06743 -223.50628 14.56115 3.29372 -221.56289 1138.88367
8715.0000 -236.14002 -223.01437 13.12565 3.22419 -223.05081 1130.49167
8720.0000 -238.21038 -223.79859 14.41179 3.19038 -223.77435 1095.61591
8725.0000 -237.46269 -223.93059 13.53211 3.13048 -225.05622 1050.91701
8730.0000 -239.01665 -223.94938 15.06727 3.16388 -224.34138 1101.48669
8735.0000 -241.56107 -226.19486 15.36621 3.18274 -223.93776 1105.84019
8740.0000 -239.44062 -225.64559 13.79503 3.11880 -225.30610 1059.92662
8745.0000 -238.34714 -224.34954 13.99760 3.15738 -224.48056 1096.05599
8750.0000 -235.18031 -218.61215 16.56816 3.24718 -222.55890 1112.13596
MELTING PROCESS: loop number 36 T-loop= 1192.0000000000000
main_MD> interactions number 36 at Temperature= 1192.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.63877 -0.64716 0.89111
force_rgl> df(natom) 0.00550 0.55146 -1.56543
8755.0000 -233.75811 -218.18938 15.56873 3.43131 -218.61825 1222.13944
8760.0000 -235.05545 -219.20635 15.84910 3.45349 -218.14356 1271.37188
8765.0000 -233.95373 -220.28602 13.66771 3.32011 -220.99795 1191.71274
8770.0000 -234.94664 -217.19777 17.74887 3.41972 -218.86626 1222.28647
8775.0000 -236.72124 -221.95820 14.76304 3.37477 -219.82842 1211.08607
8780.0000 -239.28229 -224.09313 15.18916 3.21303 -223.28952 1112.50566
8785.0000 -237.23392 -223.47001 13.76391 3.18841 -223.81644 1091.37837
8790.0000 -236.43180 -220.13369 16.29811 3.22573 -223.01774 1095.67987
8795.0000 -235.36543 -219.56422 15.80122 3.36158 -220.11068 1188.44353
8800.0000 -234.29004 -220.72364 13.56640 3.37887 -219.74052 1215.66811
8805.0000 -238.79374 -222.62438 16.16936 3.31898 -221.02223 1194.20535
8810.0000 -233.30987 -218.92862 14.38125 3.42681 -218.71462 1204.20221
8815.0000 -234.15726 -219.10465 15.05261 3.44783 -218.26482 1264.84066
8820.0000 -235.67286 -221.78565 13.88722 3.29151 -221.61016 1172.04212
8825.0000 -235.57497 -220.40020 15.17477 3.30720 -221.27443 1158.75222
8830.0000 -237.24609 -222.29550 14.95060 3.26534 -222.17007 1146.24639
8835.0000 -234.98312 -219.73415 15.24897 3.30387 -221.34556 1146.71995
8840.0000 -235.32047 -219.90129 15.41917 3.31233 -221.16449 1225.15222
8845.0000 -237.00835 -218.93039 18.07796 3.42473 -218.75912 1254.53241
8850.0000 -236.72355 -222.20023 14.52332 3.38399 -219.63098 1195.34490
8855.0000 -236.36174 -220.56035 15.80139 3.31297 -221.15077 1164.64930
8860.0000 -236.81178 -222.95548 13.85630 3.26699 -222.13485 1153.86193
8865.0000 -236.42294 -221.52628 14.89665 3.29805 -221.47018 1155.16186
8870.0000 -236.68705 -223.86504 12.82201 3.25760 -222.33590 1139.79686
8875.0000 -236.17232 -220.88193 15.29039 3.25082 -222.48085 1149.27569
8880.0000 -233.48619 -218.62906 14.85713 3.29601 -221.51391 1185.73386
8885.0000 -234.38266 -218.30776 16.07491 3.40972 -219.08033 1203.27894
8890.0000 -235.32110 -217.18642 18.13468 3.41267 -219.01721 1245.03097
8895.0000 -233.07285 -216.67872 16.39413 3.47239 -217.73926 1269.09472
8900.0000 -230.67828 -215.96991 14.70837 3.50189 -217.10785 1273.12248
8905.0000 -235.51412 -217.48590 18.02822 3.52652 -216.58082 1300.67427
8910.0000 -233.45282 -217.75057 15.70225 3.46995 -217.79138 1260.21727
8915.0000 -237.04801 -222.07935 14.96866 3.38732 -219.55977 1236.78324
8920.0000 -237.71605 -221.33246 16.38359 3.28228 -221.80757 1146.18129
8925.0000 -236.70514 -222.35009 14.35505 3.26256 -222.22960 1128.42975
8930.0000 -239.51399 -225.61721 13.89678 3.18820 -223.82102 1122.24277
8935.0000 -236.26967 -221.67400 14.59567 3.19308 -223.71664 1077.86067
8940.0000 -238.64267 -222.87299 15.76969 3.28411 -221.76847 1167.31186
8945.0000 -237.16694 -220.92362 16.24332 3.28585 -221.73134 1158.37864
8950.0000 -236.62242 -221.24329 15.37913 3.27272 -222.01213 1150.77163
8955.0000 -234.11609 -220.46738 13.64871 3.37087 -219.91168 1225.17154
8960.0000 -238.33794 -224.33081 14.00714 3.23534 -222.81208 1127.73529
8965.0000 -237.88789 -222.81597 15.07191 3.19076 -223.76624 1130.55420
8970.0000 -235.03859 -220.14764 14.89095 3.27021 -222.06594 1141.53903
8975.0000 -235.83580 -221.81125 14.02455 3.31357 -221.13791 1187.31551
8980.0000 -236.24084 -218.84339 17.39745 3.29818 -221.46743 1190.39276
8985.0000 -235.63742 -220.19427 15.44315 3.36176 -220.10679 1224.53208
8990.0000 -235.78952 -219.41078 16.37874 3.33736 -220.62896 1155.52231
8995.0000 -236.75161 -218.35373 18.39788 3.33275 -220.72758 1177.39001
9000.0000 -234.91348 -219.86074 15.05275 3.42034 -218.85316 1253.99222
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 17 [min], 20.1077954 [s].
main_MD> Deallocating global variables
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