tmlkyza
/
nanoparticlesims
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_28/melt.log

2089 lines
206 KiB
Plaintext
Raw Blame History

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_28.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 = 28 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1850
main_MD> Size of nv and nvoiz: 28 2800
main_MD> Size of nv and nvoiz: 28 2800
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 = 28
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> -7.7591885219729109E-002 -3.4470153981371050E-002 0.11325448475931056 initial drift of cluster / NP1 for coalescence
init> 0.28741429951856229 0.38008086577199945 0.26300768887566278 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.7278756935113907E-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) -0.39624 -0.54062 0.00714
force_rgl> df(natom) -0.58015 -0.45448 -0.39041
preparo> THERMALIZATION PROCESS AT 261.77470703816681
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -67.315212527301796 1.4645371790460144 -68.779749706347815 3.7017309833305471E-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 37
MELTING PROCESS: loop number 1 T-loop= 284.00000000000000
main_MD> interactions number 1 at Temperature= 284.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00466 0.45148 0.55131
force_rgl> df(natom) -0.53660 0.00101 -0.74224
5.0000 -68.34951 -67.48491 0.86459 1.63736 -67.50213 271.57400
10.0000 -68.50783 -67.41022 1.09762 1.64727 -67.41076 271.86461
15.0000 -68.32597 -67.08330 1.24267 1.65872 -67.30513 287.91760
20.0000 -68.25303 -67.22639 1.02664 1.67396 -67.16464 305.70767
25.0000 -68.57592 -67.80577 0.77015 1.64007 -67.47708 263.27110
30.0000 -68.51527 -67.64772 0.86755 1.61146 -67.74092 229.70275
35.0000 -68.34885 -67.35614 0.99271 1.63078 -67.56277 253.50817
40.0000 -68.30797 -67.36392 0.94405 1.65345 -67.35379 278.27438
45.0000 -68.47785 -67.47372 1.00413 1.65683 -67.32262 284.76883
50.0000 -68.38929 -67.39792 0.99137 1.63727 -67.50297 258.95426
55.0000 -68.45218 -67.51691 0.93527 1.62496 -67.61642 249.41249
60.0000 -68.26474 -67.06979 1.19495 1.65338 -67.35435 282.40252
65.0000 -68.38953 -67.60416 0.78537 1.64623 -67.42028 266.11080
70.0000 -68.52548 -67.61317 0.91231 1.62151 -67.64826 245.12962
75.0000 -68.40382 -67.44632 0.95750 1.64453 -67.43596 265.06535
80.0000 -68.10963 -67.30881 0.80082 1.65619 -67.32845 288.29469
85.0000 -68.05451 -67.21317 0.84134 1.66176 -67.27709 282.09137
90.0000 -67.65095 -66.52140 1.12955 1.69371 -66.98252 325.59951
95.0000 -68.22142 -66.91623 1.30519 1.73137 -66.63530 366.93073
100.0000 -67.97949 -66.80004 1.17945 1.70836 -66.84741 331.48637
105.0000 -68.12027 -67.20757 0.91270 1.67937 -67.11473 296.27962
110.0000 -68.14570 -67.14299 1.00271 1.68492 -67.06359 316.29666
115.0000 -68.21814 -67.20889 1.00925 1.68194 -67.09100 315.07133
120.0000 -68.20491 -67.07139 1.13352 1.67899 -67.11822 291.82774
125.0000 -68.15674 -66.89885 1.25789 1.69370 -66.98259 309.34753
130.0000 -68.19760 -67.16827 1.02933 1.69531 -66.96774 299.82575
135.0000 -68.01296 -66.96824 1.04472 1.69143 -67.00351 307.36088
140.0000 -68.10408 -66.95244 1.15164 1.69469 -66.97350 303.03754
145.0000 -68.09926 -67.04197 1.05729 1.69173 -67.00078 286.24031
150.0000 -68.08848 -67.05885 1.02963 1.70525 -66.87612 305.88305
155.0000 -67.96470 -67.04963 0.91507 1.68479 -67.06476 296.94335
160.0000 -68.25783 -67.54002 0.71781 1.65953 -67.29772 266.47423
165.0000 -68.27652 -67.10616 1.17036 1.67326 -67.17111 282.46813
170.0000 -68.01080 -67.08307 0.92773 1.68807 -67.03455 287.28756
175.0000 -68.36773 -66.96426 1.40347 1.69007 -67.01604 330.74498
180.0000 -68.03965 -67.00143 1.03822 1.69844 -66.93888 327.68391
185.0000 -68.40990 -67.24007 1.16983 1.66827 -67.21705 286.43017
190.0000 -68.06319 -67.12911 0.93408 1.67604 -67.14543 307.73721
195.0000 -68.61235 -67.60615 1.00621 1.65112 -67.37523 280.09044
200.0000 -68.43058 -67.38043 1.05015 1.63913 -67.48580 266.66515
205.0000 -68.58274 -67.55977 1.02296 1.63434 -67.52992 257.25269
210.0000 -68.65145 -67.52747 1.12398 1.63330 -67.53956 257.87411
215.0000 -68.40744 -67.45177 0.95567 1.63586 -67.51593 256.22877
220.0000 -68.07711 -67.12848 0.94862 1.66657 -67.23276 293.08881
225.0000 -68.35122 -67.37180 0.97942 1.64405 -67.44046 280.12019
230.0000 -68.56570 -67.67149 0.89421 1.62917 -67.57759 257.38044
235.0000 -68.42118 -67.62312 0.79806 1.61874 -67.67380 247.37795
240.0000 -68.35128 -67.31502 1.03626 1.64429 -67.43825 272.75859
245.0000 -68.22306 -67.33125 0.89181 1.66027 -67.29084 293.31064
250.0000 -68.52967 -67.43508 1.09459 1.63351 -67.53759 259.43185
MELTING PROCESS: loop number 2 T-loop= 309.00000000000000
main_MD> interactions number 2 at Temperature= 309.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.25041 -1.87485 -2.30018
force_rgl> df(natom) -1.12274 0.73067 0.13075
255.0000 -68.59164 -67.47908 1.11256 1.62964 -67.57329 251.48958
260.0000 -68.25358 -67.20893 1.04465 1.65595 -67.33070 282.98152
265.0000 -68.40920 -67.19526 1.21394 1.66159 -67.27865 288.74260
270.0000 -68.29222 -67.30565 0.98657 1.68657 -67.04831 308.45848
275.0000 -68.22267 -67.36644 0.85623 1.64385 -67.44227 247.85944
280.0000 -68.17281 -67.37313 0.79968 1.66790 -67.22050 280.41257
285.0000 -68.35083 -67.59852 0.75231 1.64159 -67.46308 249.13524
290.0000 -67.87331 -66.84282 1.03049 1.65493 -67.34006 261.05800
295.0000 -68.17835 -66.83376 1.34458 1.73032 -66.64490 347.59478
300.0000 -67.98252 -66.62144 1.36108 1.72655 -66.67966 343.66925
305.0000 -67.77158 -66.73714 1.03444 1.70034 -66.92143 307.69582
310.0000 -67.74037 -66.58838 1.15198 1.71813 -66.75738 326.67472
315.0000 -68.03230 -66.58814 1.44416 1.73172 -66.63203 350.81709
320.0000 -68.10549 -66.78325 1.32225 1.72479 -66.69593 325.41959
325.0000 -68.02941 -66.78958 1.23983 1.70729 -66.85729 311.04412
330.0000 -67.90130 -66.85092 1.05038 1.73159 -66.63327 342.64713
335.0000 -67.83990 -66.74031 1.09959 1.69822 -66.94089 301.69296
340.0000 -68.33240 -67.28193 1.05047 1.70258 -66.90068 293.34235
345.0000 -68.28396 -67.27226 1.01170 1.66146 -67.27991 263.15029
350.0000 -68.07707 -66.93052 1.14655 1.68310 -67.08037 291.82818
355.0000 -68.27535 -67.17005 1.10530 1.69664 -66.95554 309.83972
360.0000 -68.10854 -67.12972 0.97882 1.66345 -67.26153 273.84082
365.0000 -67.88002 -66.82650 1.05352 1.69884 -66.93520 300.56774
370.0000 -67.76210 -66.74306 1.01904 1.73044 -66.64387 337.34462
375.0000 -67.65526 -66.43470 1.22056 1.73033 -66.64482 348.11981
380.0000 -68.29912 -66.85031 1.44881 1.72917 -66.65554 353.15229
385.0000 -68.39345 -67.20073 1.19272 1.68164 -67.09384 302.46212
390.0000 -68.35227 -67.28084 1.07144 1.64850 -67.39939 265.58446
395.0000 -67.95831 -66.49794 1.46037 1.69670 -66.95497 321.76191
400.0000 -67.96658 -66.53548 1.43111 1.76240 -66.34914 371.56886
405.0000 -68.50340 -67.22152 1.28189 1.73023 -66.64578 362.36597
410.0000 -68.27485 -67.23959 1.03525 1.66455 -67.25137 298.11187
415.0000 -68.46793 -67.23469 1.23324 1.67559 -67.14962 302.27529
420.0000 -68.26354 -67.30083 0.96271 1.65863 -67.30594 289.44276
425.0000 -68.24925 -67.20758 1.04167 1.66810 -67.21866 302.15222
430.0000 -68.47179 -67.51681 0.95497 1.65694 -67.32158 291.68037
435.0000 -68.17452 -67.42493 0.74958 1.63298 -67.54250 258.57545
440.0000 -68.06416 -67.13754 0.92662 1.69515 -66.96923 334.89876
445.0000 -68.23955 -67.08693 1.15262 1.66568 -67.24102 294.26426
450.0000 -68.02915 -66.94656 1.08258 1.70248 -66.90168 334.54213
455.0000 -68.10794 -66.51546 1.59247 1.72664 -66.67885 374.43864
460.0000 -67.72268 -66.58826 1.13443 1.75585 -66.40955 405.13996
465.0000 -67.90241 -66.88740 1.01501 1.70786 -66.85203 305.51829
470.0000 -68.14240 -67.17905 0.96335 1.68917 -67.02435 296.13798
475.0000 -68.05335 -67.13571 0.91763 1.68200 -67.09050 276.14783
480.0000 -68.03971 -66.97873 1.06099 1.69833 -66.93995 301.25858
485.0000 -68.07827 -66.90103 1.17724 1.69235 -66.99506 290.75097
490.0000 -67.96855 -66.89403 1.07452 1.70182 -66.90770 312.14088
495.0000 -67.96026 -66.92022 1.04004 1.69896 -66.93408 313.50339
500.0000 -67.82617 -66.68962 1.13655 1.70005 -66.92408 311.96985
MELTING PROCESS: loop number 3 T-loop= 334.00000000000000
main_MD> interactions number 3 at Temperature= 334.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.48044 1.74274 0.28028
force_rgl> df(natom) 0.38621 3.18974 0.60090
505.0000 -67.96925 -67.17660 0.79265 1.68759 -67.03894 311.50654
510.0000 -67.99334 -66.93536 1.05799 1.69404 -66.97947 304.96079
515.0000 -67.79269 -66.74309 1.04960 1.70920 -66.83971 307.92121
520.0000 -68.21222 -66.78653 1.42569 1.72151 -66.72615 334.53229
525.0000 -67.86309 -66.82899 1.03410 1.72745 -66.67144 343.30901
530.0000 -67.81534 -66.73328 1.08206 1.71565 -66.78018 326.47641
535.0000 -67.67368 -66.40916 1.26452 1.72684 -66.67701 338.15716
540.0000 -68.22937 -66.65641 1.57296 1.72432 -66.70027 339.64620
545.0000 -67.56019 -66.66996 0.89022 1.73979 -66.55762 368.18706
550.0000 -67.96484 -66.77849 1.18635 1.71197 -66.81412 338.06117
555.0000 -67.92051 -67.15839 0.76213 1.68722 -67.04237 329.29138
560.0000 -68.34052 -67.35661 0.98392 1.67542 -67.15117 312.79328
565.0000 -68.41964 -67.75124 0.66840 1.62341 -67.63075 244.69537
570.0000 -68.25478 -67.25254 1.00225 1.65520 -67.33758 286.65238
575.0000 -68.08552 -66.92805 1.15747 1.68337 -67.07782 322.59037
580.0000 -68.02176 -66.85113 1.17064 1.70885 -66.84290 330.68221
585.0000 -67.99342 -66.76517 1.22825 1.71604 -66.77662 338.16131
590.0000 -68.28763 -67.03220 1.25543 1.69238 -66.99481 302.57551
595.0000 -67.96211 -66.79989 1.16222 1.71356 -66.79950 322.59702
600.0000 -67.89277 -66.55307 1.33970 1.70730 -66.85722 317.82192
605.0000 -67.83296 -66.61434 1.21862 1.72587 -66.68601 330.19651
610.0000 -67.91181 -66.61076 1.30104 1.73222 -66.62740 351.74865
615.0000 -67.92777 -67.07780 0.84998 1.71242 -66.80999 319.06739
620.0000 -67.84968 -66.64375 1.20593 1.73858 -66.56881 339.79824
625.0000 -68.03941 -66.69026 1.34914 1.71340 -66.80093 322.75720
630.0000 -68.00684 -66.71915 1.28768 1.74439 -66.51525 346.26724
635.0000 -67.92465 -66.35124 1.57341 1.73823 -66.57199 332.91557
640.0000 -68.09436 -66.95395 1.14041 1.73743 -66.57935 369.25828
645.0000 -67.41338 -66.25323 1.16015 1.73142 -66.63478 345.02707
650.0000 -67.75632 -66.65392 1.10240 1.75545 -66.41318 383.94173
655.0000 -67.86037 -66.85802 1.00234 1.70248 -66.90166 316.23964
660.0000 -68.01892 -66.78705 1.23187 1.70797 -66.85101 323.66036
665.0000 -68.20506 -66.92809 1.27697 1.70180 -66.90795 315.00601
670.0000 -67.95089 -66.87358 1.07731 1.69527 -66.96815 315.38630
675.0000 -68.01143 -66.93695 1.07449 1.71882 -66.75099 344.57870
680.0000 -67.86595 -66.71590 1.15005 1.70953 -66.83664 333.84350
685.0000 -68.16269 -66.95036 1.21233 1.70145 -66.91113 319.16699
690.0000 -68.18489 -66.85548 1.32941 1.68460 -67.06652 304.85619
695.0000 -68.09962 -66.40394 1.69568 1.72432 -66.70026 350.28562
700.0000 -68.02076 -66.55911 1.46165 1.75360 -66.43026 382.35863
705.0000 -67.72641 -66.50521 1.22120 1.72794 -66.66689 340.99662
710.0000 -68.18137 -66.89361 1.28776 1.73923 -66.56276 362.59341
715.0000 -68.18177 -67.04091 1.14086 1.70397 -66.88792 322.50529
720.0000 -68.35721 -67.45444 0.90277 1.66012 -67.29228 266.81029
725.0000 -68.21274 -67.02981 1.18293 1.65109 -67.37553 254.43913
730.0000 -67.67785 -66.66436 1.01349 1.70946 -66.83727 322.13056
735.0000 -67.39718 -65.97766 1.41951 1.75852 -66.38491 378.56554
740.0000 -67.52090 -66.28195 1.23895 1.77562 -66.22721 409.01146
745.0000 -67.82150 -66.47148 1.35002 1.74595 -66.50086 357.30416
750.0000 -67.97807 -67.05586 0.92220 1.70798 -66.85089 322.27135
MELTING PROCESS: loop number 4 T-loop= 359.00000000000000
main_MD> interactions number 4 at Temperature= 359.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.08864 0.23666 0.89065
force_rgl> df(natom) -0.65948 0.59049 -1.22984
755.0000 -68.22994 -66.89010 1.33984 1.72072 -66.73345 339.04886
760.0000 -67.72755 -66.39297 1.33458 1.72832 -66.66337 347.93452
765.0000 -67.74905 -66.54033 1.20873 1.74711 -66.49013 363.62626
770.0000 -67.29834 -66.01096 1.28737 1.76969 -66.28194 379.27549
775.0000 -67.59050 -66.44648 1.14402 1.76803 -66.29724 389.18548
780.0000 -67.53695 -66.04129 1.49566 1.76637 -66.31250 392.58225
785.0000 -67.60810 -66.00663 1.60147 1.78899 -66.10396 388.15167
790.0000 -67.72811 -66.35108 1.37703 1.77307 -66.25076 403.93790
795.0000 -68.11293 -66.75068 1.36224 1.73405 -66.61055 358.05604
800.0000 -67.88752 -66.42358 1.46394 1.76030 -66.36851 385.52049
805.0000 -67.79265 -66.45327 1.33938 1.76533 -66.32216 395.41103
810.0000 -68.01692 -66.35748 1.65944 1.74119 -66.54475 363.23520
815.0000 -68.16519 -66.80096 1.36423 1.72106 -66.73032 365.27483
820.0000 -68.12088 -66.81255 1.30833 1.73288 -66.62136 378.54865
825.0000 -67.97266 -66.73107 1.24160 1.70554 -66.87343 339.15111
830.0000 -68.20162 -66.97397 1.22765 1.69065 -67.01070 323.23678
835.0000 -68.27591 -67.05940 1.21652 1.69745 -66.94805 344.40393
840.0000 -68.02269 -67.03192 0.99077 1.69127 -67.00497 333.59047
845.0000 -68.05774 -66.92158 1.13616 1.68445 -67.06788 313.09411
850.0000 -68.21741 -66.86356 1.35385 1.69369 -66.98268 325.20125
855.0000 -67.96834 -67.01443 0.95391 1.70667 -66.86303 345.49836
860.0000 -68.32846 -67.24027 1.08819 1.66908 -67.20961 303.21565
865.0000 -68.35535 -66.88472 1.47063 1.68715 -67.04305 327.83381
870.0000 -68.42830 -66.97816 1.45013 1.70849 -66.84619 341.46753
875.0000 -67.60522 -66.44762 1.15760 1.73802 -66.57392 374.88641
880.0000 -67.99523 -66.77957 1.21566 1.72395 -66.70368 365.44405
885.0000 -68.21394 -66.83139 1.38255 1.69932 -66.93075 334.20635
890.0000 -67.93726 -66.69183 1.24543 1.73600 -66.59260 370.53923
895.0000 -67.79850 -66.20315 1.59535 1.73811 -66.57313 382.92173
900.0000 -67.83723 -66.13731 1.69992 1.78515 -66.13939 431.10390
905.0000 -67.51785 -66.07762 1.44024 1.79462 -66.05202 419.75901
910.0000 -68.07958 -66.56879 1.51080 1.79049 -66.09010 417.40239
915.0000 -68.19776 -67.09073 1.10703 1.68885 -67.02733 301.83063
920.0000 -68.02622 -66.50296 1.52326 1.72736 -66.67221 340.32106
925.0000 -67.98094 -66.72397 1.25697 1.73419 -66.60924 348.24610
930.0000 -68.04735 -66.94996 1.09739 1.69460 -66.97430 310.96622
935.0000 -68.14116 -66.88440 1.25676 1.69497 -66.97089 311.24987
940.0000 -67.70121 -66.75677 0.94444 1.71221 -66.81193 329.00219
945.0000 -67.60969 -66.50405 1.10565 1.72043 -66.73610 335.27321
950.0000 -67.88324 -66.57538 1.30787 1.73093 -66.63928 336.84867
955.0000 -67.86848 -66.70862 1.15986 1.74283 -66.52962 365.79168
960.0000 -68.06062 -66.57729 1.48333 1.73470 -66.60460 359.38739
965.0000 -67.93973 -66.82840 1.11133 1.70379 -66.88955 314.25315
970.0000 -67.79149 -66.66595 1.12554 1.72025 -66.73777 333.56538
975.0000 -68.22142 -66.86425 1.35717 1.69007 -67.01612 300.85346
980.0000 -68.12463 -67.05013 1.07450 1.70263 -66.90031 311.16333
985.0000 -67.90693 -66.46952 1.43741 1.73707 -66.58266 338.38512
990.0000 -67.96501 -66.97186 0.99315 1.74280 -66.52983 360.29675
995.0000 -68.14680 -66.94873 1.19807 1.71425 -66.79309 315.40465
1000.0000 -68.40130 -67.57012 0.83119 1.67866 -67.12126 315.48509
MELTING PROCESS: loop number 5 T-loop= 384.00000000000000
main_MD> interactions number 5 at Temperature= 384.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.46588 2.02999 0.44741
force_rgl> df(natom) 0.54919 0.01128 2.75789
1005.0000 -68.25010 -66.77973 1.47037 1.69514 -66.96929 327.89743
1010.0000 -67.57104 -66.10036 1.47068 1.74014 -66.55436 388.04148
1015.0000 -67.95328 -66.63368 1.31959 1.75538 -66.41382 407.90423
1020.0000 -68.25897 -66.93528 1.32369 1.71149 -66.81854 341.08170
1025.0000 -68.07330 -66.26622 1.80709 1.73216 -66.62797 362.13563
1030.0000 -67.57856 -66.34507 1.23348 1.76330 -66.34080 395.90260
1035.0000 -67.72990 -66.00217 1.72773 1.78022 -66.18483 403.96379
1040.0000 -67.96119 -66.62668 1.33450 1.74957 -66.46741 379.45722
1045.0000 -68.28636 -67.13941 1.14694 1.71878 -66.75131 335.01719
1050.0000 -67.93622 -66.62434 1.31189 1.71901 -66.74926 337.57003
1055.0000 -67.87315 -66.41739 1.45576 1.73291 -66.62107 371.94344
1060.0000 -68.00087 -66.07729 1.92358 1.75862 -66.38401 396.47568
1065.0000 -67.69476 -66.57035 1.12441 1.77628 -66.22113 388.85936
1070.0000 -68.05577 -66.93715 1.11863 1.73200 -66.62946 320.19916
1075.0000 -68.05921 -66.63700 1.42221 1.75084 -66.45574 386.90169
1080.0000 -68.34736 -67.04728 1.30007 1.70895 -66.84200 331.74405
1085.0000 -67.70362 -66.42769 1.27593 1.71633 -66.77398 340.13152
1090.0000 -68.03727 -66.61769 1.41958 1.72172 -66.72427 338.16695
1095.0000 -67.88363 -66.65943 1.22420 1.71841 -66.75476 357.71792
1100.0000 -68.02320 -66.39773 1.62547 1.72730 -66.67275 354.29925
1105.0000 -68.04368 -66.35070 1.69298 1.74377 -66.52092 381.21478
1110.0000 -67.77168 -66.69116 1.08052 1.73308 -66.61949 358.30992
1115.0000 -67.91206 -66.50468 1.40738 1.73774 -66.57655 359.11395
1120.0000 -68.03180 -66.80637 1.22543 1.72808 -66.66560 353.63717
1125.0000 -67.63170 -66.33750 1.29420 1.75160 -66.44869 381.68465
1130.0000 -67.79713 -66.29464 1.50249 1.76939 -66.28468 412.83122
1135.0000 -67.84624 -66.21348 1.63276 1.78881 -66.10558 436.92465
1140.0000 -68.00616 -66.39756 1.60860 1.77006 -66.27849 412.04511
1145.0000 -67.97009 -66.63760 1.33250 1.75274 -66.43818 391.51746
1150.0000 -67.96380 -66.53363 1.43017 1.73129 -66.63598 329.57624
1155.0000 -67.93461 -66.34286 1.59175 1.75220 -66.44318 375.37054
1160.0000 -67.49917 -66.02537 1.47380 1.77498 -66.23316 423.61584
1165.0000 -67.74416 -66.55768 1.18649 1.73988 -66.55680 385.55977
1170.0000 -67.69629 -66.03645 1.65984 1.79448 -66.05335 445.59027
1175.0000 -67.91504 -66.58620 1.32885 1.71046 -66.82804 358.56759
1180.0000 -68.17778 -66.75391 1.42387 1.74181 -66.53898 388.45953
1185.0000 -67.99367 -66.79266 1.20100 1.71848 -66.75414 347.30718
1190.0000 -68.24360 -66.71261 1.53099 1.70378 -66.88965 323.61329
1195.0000 -68.05299 -66.86277 1.19022 1.73530 -66.59902 377.82156
1200.0000 -68.11036 -67.11794 0.99242 1.70082 -66.91697 335.87582
1205.0000 -67.90702 -66.75322 1.15380 1.70661 -66.86354 334.18568
1210.0000 -67.62502 -66.52086 1.10416 1.74222 -66.53522 382.77892
1215.0000 -67.55767 -66.41919 1.13848 1.74905 -66.47224 393.45596
1220.0000 -67.99564 -66.36918 1.62647 1.75642 -66.40430 411.37617
1225.0000 -67.81155 -66.55941 1.25215 1.74427 -66.51634 394.94106
1230.0000 -68.08809 -66.84717 1.24092 1.71552 -66.78141 354.11995
1235.0000 -68.04205 -66.40052 1.64152 1.72864 -66.66041 367.05582
1240.0000 -68.00454 -66.49333 1.51120 1.74168 -66.54021 378.53797
1245.0000 -67.92397 -66.82892 1.09505 1.72622 -66.68276 346.58872
1250.0000 -67.93253 -67.02293 0.90960 1.72258 -66.71630 348.76231
MELTING PROCESS: loop number 6 T-loop= 409.00000000000000
main_MD> interactions number 6 at Temperature= 409.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.85700 -0.77054 0.55087
force_rgl> df(natom) -1.52277 -1.44767 2.18335
1255.0000 -67.63523 -66.25338 1.38185 1.72896 -66.65747 350.12250
1260.0000 -67.32671 -65.51295 1.81376 1.82166 -65.80269 444.47233
1265.0000 -67.52197 -66.10001 1.42196 1.81295 -65.88298 428.55475
1270.0000 -67.22793 -66.12973 1.09821 1.78598 -66.13170 403.34997
1275.0000 -68.19646 -66.23278 1.96368 1.77965 -66.19012 417.04376
1280.0000 -67.89314 -66.34645 1.54669 1.75567 -66.41114 410.89410
1285.0000 -67.75363 -66.22585 1.52778 1.76377 -66.33652 411.26325
1290.0000 -67.80366 -66.37083 1.43284 1.78687 -66.12352 424.83130
1295.0000 -67.62919 -66.12511 1.50407 1.76443 -66.33044 403.59109
1300.0000 -68.06183 -66.72381 1.33801 1.74779 -66.48386 385.93506
1305.0000 -67.72186 -65.88463 1.83723 1.76896 -66.28868 434.44454
1310.0000 -67.18675 -65.59087 1.59589 1.80917 -65.91790 432.09188
1315.0000 -67.48584 -65.94476 1.54109 1.83241 -65.70360 436.82096
1320.0000 -67.59747 -66.28601 1.31145 1.79421 -66.05586 415.18529
1325.0000 -67.45975 -65.82652 1.63323 1.81214 -65.89047 450.71655
1330.0000 -67.34833 -65.55343 1.79490 1.84434 -65.59356 482.23560
1335.0000 -68.20233 -66.37979 1.82254 1.82946 -65.73077 440.55810
1340.0000 -67.86339 -66.82246 1.04093 1.73663 -66.58679 380.40114
1345.0000 -67.48462 -66.07199 1.41263 1.75990 -66.37216 397.77903
1350.0000 -67.38187 -66.07639 1.30548 1.79064 -66.08875 406.52191
1355.0000 -67.26841 -65.88739 1.38102 1.79724 -66.02791 388.81900
1360.0000 -67.46615 -66.11644 1.34971 1.81169 -65.89461 419.77433
1365.0000 -67.23096 -65.94129 1.28967 1.80637 -65.94372 429.34425
1370.0000 -67.65391 -66.13868 1.51523 1.79234 -66.07302 425.90301
1375.0000 -67.79766 -66.04969 1.74797 1.76476 -66.32734 390.63386
1380.0000 -67.69030 -66.05344 1.63686 1.78887 -66.10506 416.54229
1385.0000 -67.69629 -65.96557 1.73072 1.76471 -66.32783 413.13480
1390.0000 -67.62764 -66.32335 1.30429 1.79098 -66.08564 425.08221
1395.0000 -68.18065 -66.69317 1.48748 1.73699 -66.58346 361.60292
1400.0000 -67.83977 -66.60360 1.23617 1.71862 -66.75286 343.18511
1405.0000 -67.68254 -66.72645 0.95609 1.73505 -66.60136 357.30631
1410.0000 -67.57667 -66.15221 1.42447 1.76812 -66.29643 404.38493
1415.0000 -67.68676 -66.02056 1.66620 1.80214 -65.98270 421.10896
1420.0000 -67.39535 -65.67008 1.72527 1.81522 -65.86207 437.09122
1425.0000 -67.23619 -65.94301 1.29318 1.82982 -65.72751 457.76532
1430.0000 -67.00540 -65.16808 1.83732 1.85335 -65.51053 449.15236
1435.0000 -67.38052 -65.79852 1.58199 1.82676 -65.75564 427.91837
1440.0000 -67.90737 -66.71519 1.19218 1.74244 -66.53314 357.61105
1445.0000 -67.44395 -66.29190 1.15205 1.76828 -66.29490 402.63761
1450.0000 -67.69713 -66.33356 1.36357 1.80852 -65.92391 420.38260
1455.0000 -67.40698 -66.01998 1.38700 1.77417 -66.24056 376.72741
1460.0000 -67.50930 -65.72465 1.78465 1.79763 -66.02429 404.44769
1465.0000 -67.79351 -66.30920 1.48431 1.82815 -65.74285 455.47585
1470.0000 -67.62048 -66.29840 1.32208 1.76917 -66.28674 409.05337
1475.0000 -67.03896 -65.83466 1.20430 1.81877 -65.82934 449.56274
1480.0000 -67.43949 -65.48610 1.95338 1.83797 -65.65236 483.23974
1485.0000 -67.58762 -66.14236 1.44526 1.80788 -65.92976 471.09614
1490.0000 -67.57190 -66.04278 1.52912 1.76970 -66.28185 416.38920
1495.0000 -67.20004 -65.75851 1.44153 1.80677 -65.93996 429.61723
1500.0000 -67.84025 -66.41506 1.42519 1.76884 -66.28976 390.47709
MELTING PROCESS: loop number 7 T-loop= 434.00000000000000
main_MD> interactions number 7 at Temperature= 434.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.40889 0.91783 -0.01376
force_rgl> df(natom) -1.05975 -1.88367 -1.59669
1505.0000 -67.55883 -66.09864 1.46020 1.77236 -66.25727 394.96246
1510.0000 -68.06475 -66.63832 1.42642 1.76538 -66.32168 389.82172
1515.0000 -67.96699 -66.56564 1.40134 1.75205 -66.44459 377.31016
1520.0000 -67.41997 -65.88016 1.53981 1.78696 -66.12266 421.06796
1525.0000 -67.81800 -66.08177 1.73624 1.79671 -66.03276 410.69787
1530.0000 -67.42407 -66.06370 1.36036 1.77757 -66.20926 420.63501
1535.0000 -67.78175 -66.27076 1.51099 1.76726 -66.30433 384.27376
1540.0000 -67.19521 -65.71354 1.48167 1.78352 -66.15442 412.73456
1545.0000 -67.23657 -65.53198 1.70458 1.85108 -65.53141 490.05521
1550.0000 -67.30792 -65.89934 1.40858 1.79907 -66.01097 453.44787
1555.0000 -67.97683 -66.63172 1.34511 1.79007 -66.09397 443.11008
1560.0000 -67.92484 -66.50449 1.42035 1.72977 -66.64998 367.14043
1565.0000 -67.69918 -66.36504 1.33415 1.76648 -66.31151 400.81469
1570.0000 -67.99391 -66.63348 1.36043 1.76342 -66.33972 416.92361
1575.0000 -67.71519 -65.96881 1.74638 1.79712 -66.02901 454.67821
1580.0000 -67.83838 -66.17692 1.66146 1.78778 -66.11512 430.12156
1585.0000 -67.67115 -66.21611 1.45504 1.77915 -66.19467 400.89051
1590.0000 -67.43041 -65.91298 1.51743 1.81533 -65.86106 418.36171
1595.0000 -67.39279 -66.00698 1.38581 1.82149 -65.80431 448.87820
1600.0000 -67.80565 -66.04340 1.76226 1.78527 -66.13827 430.58970
1605.0000 -67.13692 -65.98048 1.15644 1.79851 -66.01614 430.47458
1610.0000 -67.84707 -66.46496 1.38211 1.77997 -66.18711 414.90375
1615.0000 -67.25804 -66.12168 1.13636 1.76227 -66.35035 374.48356
1620.0000 -67.62876 -65.93091 1.69785 1.79437 -66.05436 405.60557
1625.0000 -67.70072 -66.17603 1.52469 1.80991 -65.91108 434.58134
1630.0000 -67.68830 -66.25353 1.43477 1.77114 -66.26856 412.49460
1635.0000 -67.60817 -66.04472 1.56344 1.80016 -66.00093 439.96178
1640.0000 -67.41350 -65.58239 1.83111 1.82934 -65.73186 446.92018
1645.0000 -67.87995 -66.22645 1.65351 1.81688 -65.84677 438.33252
1650.0000 -67.36527 -65.67823 1.68703 1.81729 -65.84299 438.42713
1655.0000 -67.46426 -66.22646 1.23780 1.80322 -65.97273 421.49801
1660.0000 -67.63719 -65.68352 1.95367 1.77755 -66.20941 405.95721
1665.0000 -67.26241 -65.95672 1.30569 1.81750 -65.84110 447.04319
1670.0000 -67.58519 -65.87269 1.71250 1.77417 -66.24057 409.17986
1675.0000 -66.87219 -65.36478 1.50741 1.85113 -65.53093 478.56299
1680.0000 -67.78668 -66.59260 1.19408 1.78031 -66.18398 403.02301
1685.0000 -67.83402 -66.37835 1.45567 1.73872 -66.56750 370.39255
1690.0000 -67.73642 -66.45438 1.28204 1.75900 -66.38053 392.36709
1695.0000 -67.88966 -66.42269 1.46697 1.77283 -66.25293 382.76804
1700.0000 -67.80149 -66.44503 1.35646 1.74456 -66.51363 373.29286
1705.0000 -68.02160 -66.61564 1.40597 1.76419 -66.33267 401.34571
1710.0000 -68.00828 -66.40251 1.60577 1.75203 -66.44476 395.15362
1715.0000 -67.83990 -66.20320 1.63671 1.81384 -65.87485 471.34945
1720.0000 -67.49102 -66.08990 1.40112 1.80239 -65.98037 444.44517
1725.0000 -67.57973 -66.35354 1.22620 1.76562 -66.31943 387.06888
1730.0000 -67.36449 -66.14243 1.22206 1.77422 -66.24013 397.02124
1735.0000 -67.87930 -66.09612 1.78318 1.77776 -66.20746 405.88666
1740.0000 -66.75147 -65.47564 1.27582 1.83959 -65.63742 484.31237
1745.0000 -67.24367 -65.33509 1.90857 1.86738 -65.38115 509.41719
1750.0000 -67.74390 -65.72683 2.01707 1.84285 -65.60727 476.59416
MELTING PROCESS: loop number 8 T-loop= 459.00000000000000
main_MD> interactions number 8 at Temperature= 459.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.32073 1.20241 4.77802
force_rgl> df(natom) -1.88791 2.66562 1.85114
1755.0000 -67.61942 -66.21337 1.40605 1.79744 -66.02602 436.63885
1760.0000 -67.55436 -65.73826 1.81609 1.80960 -65.91388 418.85374
1765.0000 -67.17913 -65.89505 1.28408 1.82670 -65.75626 455.98487
1770.0000 -67.29829 -65.03329 2.26501 1.86388 -65.41342 504.26510
1775.0000 -67.13889 -65.45246 1.68643 1.83831 -65.64918 484.20088
1780.0000 -67.78266 -65.59392 2.18875 1.82449 -65.77659 468.58288
1785.0000 -66.64952 -65.18257 1.46695 1.84625 -65.57594 485.03679
1790.0000 -67.50638 -65.74984 1.75654 1.86062 -65.44342 502.06190
1795.0000 -66.96016 -65.48191 1.47825 1.84396 -65.59707 455.59965
1800.0000 -66.69082 -65.48052 1.21030 1.86357 -65.41629 486.83359
1805.0000 -67.49652 -65.49882 1.99770 1.86262 -65.42504 472.71596
1810.0000 -67.27715 -65.48154 1.79562 1.85039 -65.53783 470.80714
1815.0000 -67.39237 -65.62251 1.76986 1.84948 -65.54614 476.43865
1820.0000 -67.44138 -65.85755 1.58383 1.84118 -65.62273 489.68975
1825.0000 -67.86686 -66.21394 1.65291 1.79604 -66.03894 423.38217
1830.0000 -67.84510 -66.34287 1.50223 1.78189 -66.16942 412.65340
1835.0000 -67.70788 -65.95458 1.75330 1.76506 -66.32464 385.89008
1840.0000 -67.73572 -65.77843 1.95729 1.80138 -65.98970 440.14822
1845.0000 -67.63581 -65.68656 1.94924 1.81573 -65.85740 484.80733
1850.0000 -67.19053 -65.65432 1.53621 1.81634 -65.85179 464.45189
1855.0000 -67.24463 -65.82525 1.41938 1.79979 -66.00436 428.45996
1860.0000 -68.03450 -66.09496 1.93954 1.78308 -66.15844 395.61936
1865.0000 -67.29093 -65.73272 1.55821 1.82033 -65.81494 449.13111
1870.0000 -67.13511 -65.26605 1.86906 1.82562 -65.76617 457.51780
1875.0000 -67.44112 -65.96420 1.47692 1.87591 -65.30250 492.46425
1880.0000 -67.63275 -66.29820 1.33455 1.79866 -66.01478 428.90188
1885.0000 -67.32943 -65.83597 1.49346 1.76981 -66.28078 383.11186
1890.0000 -67.21206 -65.84405 1.36800 1.79656 -66.03418 399.87551
1895.0000 -67.13752 -65.58483 1.55270 1.84688 -65.57018 468.80355
1900.0000 -66.97157 -65.45756 1.51402 1.87913 -65.27279 514.95908
1905.0000 -67.35866 -65.82296 1.53571 1.84258 -65.60983 465.15403
1910.0000 -67.64947 -65.53013 2.11934 1.86014 -65.44785 489.19681
1915.0000 -67.24208 -65.00197 2.24011 1.87132 -65.34482 522.46568
1920.0000 -67.33665 -65.07198 2.26467 1.87514 -65.30959 535.83579
1925.0000 -67.05623 -65.26366 1.79257 1.88346 -65.23281 524.22449
1930.0000 -67.43405 -65.65546 1.77859 1.83921 -65.64090 467.78314
1935.0000 -67.62518 -66.55289 1.07229 1.78068 -66.18061 391.52845
1940.0000 -67.28479 -65.53433 1.75046 1.78900 -66.10383 422.72607
1945.0000 -67.06279 -65.39795 1.66484 1.84585 -65.57969 464.96759
1950.0000 -66.94959 -65.02299 1.92660 1.89779 -65.10073 523.37811
1955.0000 -67.28112 -65.22602 2.05510 1.89760 -65.10243 543.40166
1960.0000 -67.46361 -65.60394 1.85968 1.85023 -65.53922 490.02290
1965.0000 -67.45935 -65.99465 1.46471 1.83049 -65.72131 472.60864
1970.0000 -67.11003 -65.58860 1.52143 1.81970 -65.82077 450.46696
1975.0000 -67.45285 -65.87991 1.57294 1.82762 -65.74774 440.97340
1980.0000 -67.57199 -65.92244 1.64956 1.80868 -65.92237 452.15285
1985.0000 -67.65592 -65.88405 1.77187 1.80205 -65.98355 442.93506
1990.0000 -68.00813 -66.32470 1.68343 1.77547 -66.22862 428.82832
1995.0000 -68.40352 -67.05361 1.34991 1.72252 -66.71683 368.45532
2000.0000 -67.84644 -66.03756 1.80887 1.72003 -66.73984 367.38874
MELTING PROCESS: loop number 9 T-loop= 484.00000000000000
main_MD> interactions number 9 at Temperature= 484.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70077 1.21414 -0.27930
force_rgl> df(natom) -2.69195 0.27410 2.37508
2005.0000 -67.18169 -65.89121 1.29048 1.80538 -65.95284 460.02601
2010.0000 -67.44087 -66.08647 1.35440 1.79767 -66.02389 445.41305
2015.0000 -67.54379 -65.87108 1.67271 1.81368 -65.87631 470.71171
2020.0000 -66.90581 -65.15218 1.75364 1.87769 -65.28602 501.04143
2025.0000 -67.66595 -65.92058 1.74537 1.83847 -65.64769 454.64425
2030.0000 -67.30590 -65.47986 1.82604 1.85075 -65.53443 468.78315
2035.0000 -67.60874 -65.89855 1.71020 1.86591 -65.39469 496.36439
2040.0000 -67.12022 -65.23995 1.88027 1.84285 -65.60729 466.89823
2045.0000 -67.61398 -66.05981 1.55418 1.86316 -65.42006 496.60052
2050.0000 -67.53704 -65.74358 1.79346 1.79113 -66.08423 428.97090
2055.0000 -67.48648 -66.01666 1.46982 1.79597 -66.03954 425.22905
2060.0000 -66.73578 -65.23829 1.49748 1.86476 -65.40528 504.25197
2065.0000 -67.19945 -65.53812 1.66133 1.84930 -65.54785 481.26627
2070.0000 -66.98595 -65.34682 1.63913 1.86906 -65.36560 474.41181
2075.0000 -67.22722 -65.70191 1.52531 1.86811 -65.37441 473.52929
2080.0000 -67.18802 -65.68443 1.50359 1.79910 -66.01072 417.66796
2085.0000 -66.70567 -65.41603 1.28964 1.83961 -65.63717 455.80282
2090.0000 -67.00473 -65.50877 1.49596 1.85259 -65.51747 496.17095
2095.0000 -67.17636 -65.36418 1.81218 1.89396 -65.13603 523.76696
2100.0000 -66.62278 -64.73086 1.89192 1.91393 -64.95191 519.00887
2105.0000 -66.98199 -65.42474 1.55725 1.90388 -65.04457 528.48596
2110.0000 -67.25666 -65.14369 2.11296 1.89074 -65.16571 516.08211
2115.0000 -67.19180 -65.28102 1.91078 1.87966 -65.26791 497.93430
2120.0000 -67.56890 -65.62902 1.93988 1.86278 -65.42358 501.73167
2125.0000 -67.04407 -65.57461 1.46945 1.85849 -65.46312 501.65205
2130.0000 -67.27299 -65.77202 1.50097 1.81389 -65.87439 449.06151
2135.0000 -67.46994 -65.78259 1.68734 1.83310 -65.69725 466.66488
2140.0000 -67.32260 -65.64964 1.67297 1.83807 -65.65140 463.40843
2145.0000 -67.31685 -65.21622 2.10063 1.89031 -65.16973 511.79789
2150.0000 -67.00185 -65.42780 1.57405 1.89656 -65.11206 533.84693
2155.0000 -67.31968 -65.43128 1.88840 1.86749 -65.38009 491.81607
2160.0000 -67.08539 -65.35592 1.72947 1.83983 -65.63515 444.94186
2165.0000 -67.09317 -65.11446 1.97871 1.91454 -64.94631 545.16095
2170.0000 -67.35219 -65.37672 1.97546 1.85765 -65.47081 478.22720
2175.0000 -67.31378 -65.65090 1.66287 1.84772 -65.56243 479.02878
2180.0000 -67.23434 -65.70982 1.52452 1.85876 -65.46063 495.36748
2185.0000 -67.42830 -65.52822 1.90008 1.85606 -65.48549 490.75547
2190.0000 -67.02555 -65.38916 1.63639 1.88041 -65.26096 519.74476
2195.0000 -66.80197 -64.90597 1.89600 1.92376 -64.86121 549.15331
2200.0000 -67.25295 -65.49342 1.75952 1.88848 -65.18657 560.84372
2205.0000 -67.32051 -65.53893 1.78158 1.89669 -65.11083 548.89789
2210.0000 -66.77494 -65.41219 1.36275 1.84954 -65.54567 483.50211
2215.0000 -67.71867 -66.23990 1.47877 1.82063 -65.81220 458.44401
2220.0000 -67.27916 -65.75954 1.51962 1.78946 -66.09959 420.73050
2225.0000 -66.98686 -65.66198 1.32488 1.85383 -65.50608 494.71513
2230.0000 -67.34364 -65.41242 1.93122 1.85168 -65.52594 502.57706
2235.0000 -67.36246 -65.76411 1.59836 1.84431 -65.59382 482.37594
2240.0000 -66.99582 -65.05067 1.94515 1.85603 -65.48578 491.38494
2245.0000 -67.31583 -65.13186 2.18397 1.91272 -64.96309 558.45633
2250.0000 -67.46738 -65.50941 1.95797 1.86553 -65.39821 505.57192
MELTING PROCESS: loop number 10 T-loop= 509.00000000000000
main_MD> interactions number 10 at Temperature= 509.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.10575 1.04538 2.13876
force_rgl> df(natom) 0.93137 1.28392 -0.03737
2255.0000 -67.64169 -65.84184 1.79985 1.83582 -65.67213 477.10674
2260.0000 -67.11798 -65.44730 1.67068 1.83955 -65.63771 460.00920
2265.0000 -66.86968 -65.09779 1.77189 1.85559 -65.48987 464.40272
2270.0000 -67.01800 -65.31755 1.70045 1.88567 -65.21247 523.63788
2275.0000 -67.20518 -65.18521 2.01997 1.85538 -65.49174 485.95441
2280.0000 -67.19568 -65.13223 2.06345 1.89666 -65.11115 555.65955
2285.0000 -67.35411 -65.55603 1.79808 1.85855 -65.46252 493.88694
2290.0000 -67.36852 -65.34096 2.02756 1.85039 -65.53777 472.58234
2295.0000 -67.08273 -65.01962 2.06311 1.86108 -65.43922 511.32614
2300.0000 -66.82553 -65.11389 1.71164 1.87776 -65.28544 505.99487
2305.0000 -67.02997 -65.37591 1.65406 1.88349 -65.23254 503.82888
2310.0000 -66.96465 -64.83941 2.12524 1.88995 -65.17300 532.98820
2315.0000 -67.24939 -65.09469 2.15471 1.88096 -65.25591 506.75272
2320.0000 -67.17613 -65.20860 1.96753 1.87641 -65.29789 503.93121
2325.0000 -66.97799 -64.85485 2.12314 1.88689 -65.20122 517.10627
2330.0000 -66.82366 -64.70256 2.12110 1.92463 -64.85323 559.30840
2335.0000 -67.22781 -65.24391 1.98389 1.89197 -65.15437 509.66371
2340.0000 -66.79952 -65.06418 1.73534 1.87339 -65.32574 460.23945
2345.0000 -66.60292 -65.12450 1.47843 1.87625 -65.29935 473.87343
2350.0000 -67.18735 -65.47874 1.70862 1.85274 -65.51613 484.71234
2355.0000 -67.62720 -65.77606 1.85114 1.85245 -65.51879 508.30849
2360.0000 -66.97738 -65.15849 1.81889 1.87200 -65.33857 511.60618
2365.0000 -67.37514 -65.65608 1.71906 1.88247 -65.24203 504.69981
2370.0000 -67.60051 -65.64080 1.95971 1.84055 -65.62848 492.54154
2375.0000 -66.72369 -64.89695 1.82674 1.88334 -65.23400 530.88628
2380.0000 -67.00340 -65.19222 1.81118 1.93229 -64.78261 567.83381
2385.0000 -66.80581 -65.09485 1.71096 1.89010 -65.17163 524.09989
2390.0000 -67.34132 -65.16465 2.17667 1.90175 -65.06424 519.69003
2395.0000 -66.94457 -65.04044 1.90414 1.91330 -64.95768 550.45408
2400.0000 -66.45301 -64.46414 1.98887 1.96874 -64.44649 629.06286
2405.0000 -67.01015 -64.39579 2.61436 1.97160 -64.42016 631.11891
2410.0000 -67.29856 -65.54789 1.75068 1.91813 -64.91317 542.32621
2415.0000 -67.69430 -66.19778 1.49652 1.81031 -65.90733 440.43951
2420.0000 -67.09637 -65.76970 1.32667 1.79850 -66.01625 416.59021
2425.0000 -66.94694 -65.18249 1.76444 1.89817 -65.09718 528.38836
2430.0000 -67.45762 -65.31766 2.13996 1.88455 -65.22282 546.46824
2435.0000 -67.22563 -65.52040 1.70523 1.86348 -65.41706 512.18993
2440.0000 -67.47898 -65.32434 2.15465 1.87091 -65.34861 518.88637
2445.0000 -66.98632 -65.41460 1.57172 1.85526 -65.49291 477.51206
2450.0000 -67.37595 -64.77790 2.59806 1.91700 -64.92361 558.93090
2455.0000 -66.91524 -64.81100 2.10424 1.92573 -64.84309 558.50922
2460.0000 -67.47617 -65.82944 1.64673 1.87221 -65.33656 510.30213
2465.0000 -66.79093 -65.03950 1.75143 1.85913 -65.45722 497.10720
2470.0000 -67.43657 -65.43406 2.00252 1.86906 -65.36564 510.23123
2475.0000 -67.64344 -65.70933 1.93411 1.81883 -65.82882 451.23578
2480.0000 -67.11910 -65.34354 1.77556 1.83383 -65.69049 460.47969
2485.0000 -67.31819 -65.48599 1.83219 1.86546 -65.39884 501.04227
2490.0000 -67.44196 -65.76008 1.68188 1.83176 -65.70955 449.40794
2495.0000 -66.90978 -65.04232 1.86746 1.88767 -65.19404 532.76748
2500.0000 -66.97084 -64.79594 2.17489 1.89355 -65.13981 534.63304
MELTING PROCESS: loop number 11 T-loop= 534.00000000000000
main_MD> interactions number 11 at Temperature= 534.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.16029 -1.09370 -0.19243
force_rgl> df(natom) 2.78201 0.74840 0.59723
2505.0000 -66.97651 -64.89267 2.08384 1.96266 -64.50260 614.39782
2510.0000 -66.44821 -64.86167 1.58654 1.93289 -64.77711 537.20836
2515.0000 -66.19860 -64.02098 2.17761 1.97466 -64.39189 563.25657
2520.0000 -66.34264 -64.66510 1.67754 1.99753 -64.18099 599.35825
2525.0000 -67.11184 -64.83203 2.27982 1.95731 -64.55185 599.92106
2530.0000 -66.86962 -64.95477 1.91486 1.92799 -64.82226 591.86451
2535.0000 -66.84528 -64.79803 2.04725 1.95286 -64.59289 585.00585
2540.0000 -66.58012 -64.76959 1.81054 1.93570 -64.75112 561.38602
2545.0000 -66.84289 -64.36793 2.47496 1.96409 -64.48937 576.15739
2550.0000 -66.62479 -64.90782 1.71697 1.95415 -64.58104 575.48841
2555.0000 -67.30318 -65.95322 1.34997 1.87010 -65.35602 490.16546
2560.0000 -67.33502 -64.96525 2.36976 1.84432 -65.59374 467.73117
2565.0000 -66.93628 -65.14185 1.79443 1.90174 -65.06427 542.78241
2570.0000 -67.69410 -66.00873 1.68538 1.86715 -65.38327 507.54552
2575.0000 -66.92827 -65.32452 1.60374 1.82543 -65.76795 470.22807
2580.0000 -67.17200 -65.69855 1.47344 1.84558 -65.58214 474.71017
2585.0000 -67.53620 -65.69563 1.84057 1.81949 -65.82271 453.88658
2590.0000 -67.12949 -65.51284 1.61664 1.85843 -65.46368 476.94294
2595.0000 -66.32377 -64.11540 2.20837 1.90255 -65.05681 543.69283
2600.0000 -67.05371 -64.84691 2.20680 1.93777 -64.73206 591.15625
2605.0000 -66.88020 -64.85844 2.02175 1.92015 -64.89453 574.53233
2610.0000 -67.44515 -65.41249 2.03266 1.88683 -65.20176 552.98325
2615.0000 -66.98094 -65.05213 1.92880 1.85308 -65.51300 475.71963
2620.0000 -67.15049 -64.87312 2.27737 1.92578 -64.84265 569.48532
2625.0000 -67.31736 -64.74189 2.57548 1.92587 -64.84180 574.76070
2630.0000 -67.14759 -65.18102 1.96657 1.90989 -64.98918 571.43152
2635.0000 -66.96280 -65.15217 1.81063 1.89304 -65.14451 526.99662
2640.0000 -67.20926 -65.30585 1.90340 1.89450 -65.13105 559.52410
2645.0000 -67.42604 -65.08860 2.33744 1.88036 -65.26144 528.99689
2650.0000 -66.83572 -64.58571 2.25001 1.92621 -64.83868 571.17376
2655.0000 -66.86652 -64.79081 2.07571 1.96769 -64.45622 594.54557
2660.0000 -67.08653 -65.37820 1.70834 1.91774 -64.91681 557.08836
2665.0000 -66.56059 -65.00023 1.56036 1.89415 -65.13432 501.87106
2670.0000 -66.49003 -64.74650 1.74353 1.92841 -64.81838 532.59283
2675.0000 -67.16768 -65.25729 1.91040 1.91952 -64.90039 524.49788
2680.0000 -66.86151 -64.63609 2.22542 1.91762 -64.91790 537.74890
2685.0000 -66.74394 -64.46746 2.27648 1.99121 -64.23926 603.25738
2690.0000 -66.67194 -63.62919 3.04274 1.99076 -64.24346 605.61873
2695.0000 -66.09086 -63.98742 2.10344 2.02634 -63.91534 654.94790
2700.0000 -67.23716 -65.14673 2.09043 1.94441 -64.67085 587.52591
2705.0000 -67.14091 -65.57219 1.56872 1.85211 -65.52194 491.81915
2710.0000 -67.20006 -65.55567 1.64439 1.87712 -65.29128 487.81522
2715.0000 -67.06684 -65.23462 1.83222 1.89490 -65.12740 502.66242
2720.0000 -66.78372 -65.35641 1.42732 1.86038 -65.44569 451.56043
2725.0000 -66.85684 -65.05122 1.80562 1.91462 -64.94551 498.28078
2730.0000 -66.72011 -65.19914 1.52097 1.87788 -65.28430 516.96147
2735.0000 -66.64687 -65.40860 1.23827 1.87134 -65.34461 495.75998
2740.0000 -66.90631 -64.98045 1.92586 1.89080 -65.16514 522.71259
2745.0000 -67.04531 -64.90432 2.14099 1.89769 -65.10162 535.03256
2750.0000 -66.60656 -64.64556 1.96100 1.89944 -65.08554 540.00721
MELTING PROCESS: loop number 12 T-loop= 559.00000000000000
main_MD> interactions number 12 at Temperature= 559.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.01715 1.15445 -2.33104
force_rgl> df(natom) 0.48970 1.53898 -0.30374
2755.0000 -66.51150 -64.00660 2.50490 2.00808 -64.08371 615.97667
2760.0000 -66.88022 -64.72724 2.15298 1.95339 -64.58802 595.70940
2765.0000 -66.69229 -64.21688 2.47540 1.99296 -64.22321 637.47741
2770.0000 -67.18976 -65.32225 1.86751 1.90082 -65.07279 518.19148
2775.0000 -66.45772 -64.73060 1.72711 1.88587 -65.21059 529.89601
2780.0000 -67.03896 -64.62632 2.41264 1.95263 -64.59504 608.62039
2785.0000 -66.78487 -64.91417 1.87070 1.92765 -64.82535 582.04352
2790.0000 -66.92205 -64.21748 2.70458 1.95537 -64.56980 593.96919
2795.0000 -66.61006 -64.82709 1.78297 1.97226 -64.41405 621.35197
2800.0000 -66.63981 -64.90022 1.73959 1.89590 -65.11818 530.53019
2805.0000 -66.22756 -63.74302 2.48454 1.97674 -64.37277 606.31033
2810.0000 -66.31811 -63.62577 2.69235 2.04295 -63.76225 649.65377
2815.0000 -66.54654 -64.39355 2.15299 2.00854 -64.07946 613.76750
2820.0000 -66.70941 -64.38616 2.32325 1.97028 -64.43234 607.72323
2825.0000 -66.29236 -64.51321 1.77915 1.94209 -64.69221 568.25858
2830.0000 -66.71750 -64.36307 2.35443 1.95603 -64.56371 567.68571
2835.0000 -66.97294 -64.94132 2.03163 1.97022 -64.43286 620.35758
2840.0000 -66.63741 -64.41238 2.22503 1.94048 -64.70706 586.89329
2845.0000 -66.87991 -65.38090 1.49900 1.93297 -64.77629 570.79004
2850.0000 -66.87038 -64.89219 1.97819 1.87337 -65.32590 514.80350
2855.0000 -67.37081 -65.33589 2.03492 1.88646 -65.20518 534.96065
2860.0000 -67.29383 -65.18160 2.11223 1.90635 -65.02182 540.24319
2865.0000 -66.66843 -64.60616 2.06227 1.86832 -65.37248 505.78530
2870.0000 -67.05697 -65.22189 1.83508 1.91334 -64.95735 537.31280
2875.0000 -67.05973 -65.29632 1.76341 1.87020 -65.35516 497.24199
2880.0000 -67.18839 -65.50708 1.68131 1.88178 -65.24838 523.02949
2885.0000 -67.60231 -65.43171 2.17060 1.88974 -65.17491 550.88222
2890.0000 -66.89487 -64.65801 2.23686 1.90218 -65.06024 557.79256
2895.0000 -66.73649 -64.37738 2.35911 1.96775 -64.45565 612.88284
2900.0000 -67.05654 -64.77712 2.27942 1.94745 -64.64278 599.52667
2905.0000 -67.49777 -65.66825 1.82952 1.90277 -65.05478 572.58994
2910.0000 -67.33732 -65.33589 2.00144 1.82448 -65.77670 480.35449
2915.0000 -67.44868 -65.68986 1.75882 1.83350 -65.69349 453.38034
2920.0000 -67.43648 -65.71963 1.71685 1.83385 -65.69032 473.18354
2925.0000 -66.95263 -65.47883 1.47379 1.81672 -65.84824 452.40217
2930.0000 -67.59205 -65.62030 1.97175 1.84848 -65.55543 502.00424
2935.0000 -67.10415 -65.10067 2.00348 1.88937 -65.17834 504.10772
2940.0000 -66.66737 -64.72009 1.94728 1.90934 -64.99424 577.06617
2945.0000 -66.81946 -64.44286 2.37660 1.92570 -64.84340 586.84500
2950.0000 -67.07839 -65.16266 1.91572 1.93395 -64.76726 532.03437
2955.0000 -66.73119 -64.51915 2.21204 1.93716 -64.73770 569.24125
2960.0000 -66.62574 -64.09439 2.53135 1.98527 -64.29405 617.54126
2965.0000 -66.77374 -64.81073 1.96301 1.95617 -64.56244 571.23244
2970.0000 -66.24338 -64.50178 1.74160 1.94381 -64.67634 570.51917
2975.0000 -66.55295 -64.31999 2.23295 1.96772 -64.45591 612.71357
2980.0000 -66.48384 -64.57405 1.90980 1.95326 -64.58921 546.88788
2985.0000 -66.14557 -64.50615 1.63943 1.96026 -64.52467 596.69345
2990.0000 -66.44503 -64.28928 2.15575 1.98427 -64.30329 604.93067
2995.0000 -66.43472 -64.23589 2.19883 1.99305 -64.22234 602.03345
3000.0000 -66.42325 -64.87272 1.55053 1.96464 -64.48434 590.05754
MELTING PROCESS: loop number 13 T-loop= 584.00000000000000
main_MD> interactions number 13 at Temperature= 584.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.14350 3.45308 -3.10116
force_rgl> df(natom) 1.97813 1.47501 0.87822
3005.0000 -66.24335 -64.27660 1.96675 1.92837 -64.81874 571.90751
3010.0000 -66.89974 -65.05831 1.84143 1.93109 -64.79364 558.92573
3015.0000 -67.13306 -64.92031 2.21275 1.91759 -64.91816 552.41201
3020.0000 -66.89319 -64.81369 2.07950 1.94444 -64.67053 573.39945
3025.0000 -66.67746 -64.96082 1.71664 1.91325 -64.95814 554.23642
3030.0000 -66.43594 -64.93688 1.49906 1.91494 -64.94262 559.16665
3035.0000 -67.10931 -65.03744 2.07187 1.90883 -64.99888 547.49871
3040.0000 -66.25862 -64.34081 1.91781 1.90210 -65.06102 503.66232
3045.0000 -66.83494 -65.23373 1.60121 1.95771 -64.54820 607.52749
3050.0000 -67.56507 -65.35458 2.21048 1.86098 -65.44010 494.70486
3055.0000 -66.79175 -64.84189 1.94986 1.89554 -65.12144 527.70606
3060.0000 -67.19897 -65.22575 1.97322 1.92853 -64.81729 560.09094
3065.0000 -67.24986 -65.20151 2.04836 1.87210 -65.33759 511.45715
3070.0000 -67.30312 -65.23371 2.06940 1.85723 -65.47476 498.14550
3075.0000 -66.88039 -65.37539 1.50500 1.84394 -65.59725 489.72081
3080.0000 -67.37246 -65.83737 1.53510 1.86760 -65.37908 519.81950
3085.0000 -67.26122 -65.47363 1.78759 1.83306 -65.69759 500.50932
3090.0000 -66.73318 -64.88903 1.84415 1.91153 -64.97401 554.86483
3095.0000 -66.67812 -64.58503 2.09310 1.95478 -64.57518 591.84187
3100.0000 -66.44248 -64.41912 2.02336 1.96370 -64.49296 615.80951
3105.0000 -66.39975 -63.90659 2.49316 1.98137 -64.33003 634.77035
3110.0000 -66.48321 -64.21957 2.26364 1.99102 -64.24107 632.80812
3115.0000 -66.13877 -63.80867 2.33010 2.05471 -63.65377 676.49573
3120.0000 -65.97814 -63.87711 2.10103 2.02350 -63.94159 635.57470
3125.0000 -67.11324 -65.28072 1.83253 1.97226 -64.41400 627.92406
3130.0000 -67.20774 -65.23407 1.97367 1.86364 -65.41561 491.07442
3135.0000 -67.09192 -64.60477 2.48715 1.92101 -64.88657 561.11491
3140.0000 -67.02580 -65.09678 1.92903 1.91199 -64.96977 540.00980
3145.0000 -66.84999 -64.75287 2.09713 1.91657 -64.92751 558.70038
3150.0000 -67.07959 -64.81867 2.26092 1.94185 -64.69444 588.93647
3155.0000 -66.84221 -64.42172 2.42050 1.96663 -64.46596 624.55416
3160.0000 -66.99817 -64.59487 2.40330 1.97956 -64.34669 622.18954
3165.0000 -67.09007 -65.15328 1.93679 1.91956 -64.89997 564.34538
3170.0000 -67.12637 -64.71365 2.41271 1.90312 -65.05156 543.59350
3175.0000 -66.80563 -64.38496 2.42067 1.97278 -64.40925 606.10472
3180.0000 -66.32855 -63.93928 2.38927 1.98092 -64.33416 633.63249
3185.0000 -67.29993 -64.87431 2.42562 1.94138 -64.69874 583.44200
3190.0000 -66.84198 -64.73983 2.10215 1.91341 -64.95672 529.93870
3195.0000 -66.60871 -63.66371 2.94500 1.96462 -64.48452 608.54484
3200.0000 -66.54607 -63.96146 2.58461 2.00223 -64.13767 624.33584
3205.0000 -66.58660 -64.63222 1.95438 1.98060 -64.33712 634.15648
3210.0000 -66.60535 -64.57464 2.03071 1.95512 -64.57206 599.31491
3215.0000 -65.93808 -63.82647 2.11161 2.01445 -64.02501 662.89985
3220.0000 -66.62736 -64.14723 2.48013 2.03324 -63.85173 671.42324
3225.0000 -66.66321 -63.99761 2.66560 1.97569 -64.38242 592.91383
3230.0000 -66.80109 -64.64111 2.15998 1.95804 -64.54521 591.71049
3235.0000 -66.49397 -64.52744 1.96653 1.96978 -64.43688 604.74007
3240.0000 -66.10102 -63.76669 2.33433 1.97174 -64.41883 631.87326
3245.0000 -66.74649 -64.70905 2.03744 1.99419 -64.21186 618.27749
3250.0000 -67.17276 -65.37409 1.79867 1.92041 -64.89217 573.97229
MELTING PROCESS: loop number 14 T-loop= 609.00000000000000
main_MD> interactions number 14 at Temperature= 609.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.10701 -0.42243 1.66360
force_rgl> df(natom) 1.26087 -3.27120 -2.12587
3255.0000 -67.19286 -65.10320 2.08966 1.84907 -65.54993 486.92690
3260.0000 -66.52756 -64.15279 2.37477 2.01238 -64.04413 673.87903
3265.0000 -66.14487 -63.74415 2.40072 2.03818 -63.80622 686.96234
3270.0000 -66.25463 -63.95728 2.29735 2.02959 -63.88541 639.15589
3275.0000 -66.32586 -64.18206 2.14380 2.00123 -64.14694 596.53748
3280.0000 -66.39857 -64.52660 1.87198 1.94394 -64.67522 568.32570
3285.0000 -67.01693 -64.91640 2.10053 1.93403 -64.76657 544.66295
3290.0000 -66.14009 -64.13135 2.00874 1.94869 -64.63140 571.54693
3295.0000 -65.97909 -64.06493 1.91416 1.99259 -64.22654 615.28069
3300.0000 -66.07441 -64.29109 1.78332 1.99387 -64.21474 643.48833
3305.0000 -66.22558 -64.60601 1.61957 1.95484 -64.57465 589.51876
3310.0000 -65.88302 -63.43712 2.44590 2.02910 -63.88994 627.11975
3315.0000 -66.49767 -64.30404 2.19363 2.04033 -63.78634 644.73371
3320.0000 -66.29082 -64.27726 2.01356 1.99601 -64.19508 621.44427
3325.0000 -66.95392 -64.84967 2.10425 1.93968 -64.71444 566.01260
3330.0000 -66.86787 -64.36565 2.50222 1.94230 -64.69034 578.58837
3335.0000 -67.20821 -64.91941 2.28880 1.89917 -65.08799 543.10838
3340.0000 -67.11932 -64.93728 2.18205 1.89959 -65.08411 544.83328
3345.0000 -67.30124 -65.17872 2.12252 1.90491 -65.03505 524.92928
3350.0000 -66.98499 -64.74782 2.23717 1.93939 -64.71713 554.97626
3355.0000 -66.36169 -64.11853 2.24317 1.98085 -64.33487 589.70424
3360.0000 -66.07412 -63.49868 2.57544 1.99554 -64.19942 635.47386
3365.0000 -66.14205 -63.61153 2.53052 2.04728 -63.72233 655.07414
3370.0000 -66.20708 -64.05624 2.15084 2.01096 -64.05724 600.86414
3375.0000 -66.57714 -64.29129 2.28585 1.96870 -64.44684 594.64006
3380.0000 -66.39336 -64.44530 1.94806 1.98975 -64.25277 628.97469
3385.0000 -67.01603 -64.89234 2.12369 1.96556 -64.47585 578.18585
3390.0000 -67.15941 -65.32856 1.83085 1.88629 -65.20676 505.98742
3395.0000 -66.25533 -64.67374 1.58160 1.93288 -64.77719 587.36165
3400.0000 -67.34733 -64.91816 2.42917 1.92097 -64.88694 583.88167
3405.0000 -66.77567 -64.17936 2.59631 1.91109 -64.97805 556.97786
3410.0000 -66.34219 -63.84805 2.49413 1.99972 -64.16087 656.99538
3415.0000 -65.90010 -63.04544 2.85466 2.04290 -63.76268 688.02895
3420.0000 -66.44785 -63.75691 2.69094 2.08598 -63.36543 744.07910
3425.0000 -66.55839 -64.17791 2.38048 1.96372 -64.49280 603.80967
3430.0000 -67.19935 -64.58669 2.61266 1.98424 -64.30361 634.82739
3435.0000 -66.23386 -63.96666 2.26719 2.01809 -63.99143 640.31961
3440.0000 -66.14598 -64.05930 2.08668 1.98432 -64.30287 587.42133
3445.0000 -66.73240 -64.91769 1.81470 1.95127 -64.60758 538.97451
3450.0000 -66.22906 -63.53562 2.69345 1.98576 -64.28954 582.97400
3455.0000 -65.73761 -62.84227 2.89535 2.08964 -63.33171 695.20911
3460.0000 -66.32899 -63.77766 2.55134 2.06648 -63.54522 701.80036
3465.0000 -66.64808 -64.62961 2.01847 2.02969 -63.88447 672.91431
3470.0000 -65.85705 -63.73557 2.12148 1.97542 -64.38493 613.42429
3475.0000 -66.52834 -64.46582 2.06252 2.01228 -64.04499 670.40707
3480.0000 -66.38952 -64.63527 1.75425 1.95651 -64.55928 570.86142
3485.0000 -66.81694 -64.43615 2.38079 1.97268 -64.41016 604.14953
3490.0000 -66.67644 -64.18545 2.49098 1.96236 -64.50537 578.57502
3495.0000 -66.99625 -64.94892 2.04733 1.95542 -64.56935 588.19545
3500.0000 -67.06823 -65.02341 2.04482 1.94292 -64.68457 569.20893
MELTING PROCESS: loop number 15 T-loop= 634.00000000000000
main_MD> interactions number 15 at Temperature= 634.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.18212 -1.49840 -3.52339
force_rgl> df(natom) 2.94063 0.53471 1.83426
3505.0000 -66.22407 -63.85653 2.36753 1.97094 -64.42623 604.71971
3510.0000 -66.66166 -64.27651 2.38515 2.04654 -63.72913 702.27203
3515.0000 -67.18334 -64.52129 2.66205 1.94159 -64.69681 598.09561
3520.0000 -66.58970 -64.61333 1.97638 1.95726 -64.55235 591.16469
3525.0000 -66.37078 -63.86165 2.50913 1.98191 -64.32503 647.12065
3530.0000 -66.92011 -65.21629 1.70382 1.93595 -64.74883 557.03872
3535.0000 -66.71064 -64.49963 2.21101 1.95738 -64.55123 579.68506
3540.0000 -67.12855 -64.73991 2.38864 1.96856 -64.44819 613.21627
3545.0000 -67.00813 -64.74463 2.26350 1.93336 -64.77276 585.37148
3550.0000 -66.12556 -64.31911 1.80645 1.94994 -64.61981 597.41726
3555.0000 -66.66344 -64.71257 1.95087 1.98968 -64.25340 634.55062
3560.0000 -66.86585 -64.37698 2.48887 1.96756 -64.45737 617.46353
3565.0000 -66.26002 -63.89323 2.36679 2.03209 -63.86239 674.91745
3570.0000 -66.44858 -63.80407 2.64451 2.03488 -63.83660 658.86194
3575.0000 -66.27488 -63.49199 2.78290 2.06847 -63.52692 709.78334
3580.0000 -66.72189 -64.33597 2.38592 2.00406 -64.12077 703.18419
3585.0000 -66.58130 -64.52447 2.05684 2.00453 -64.11647 653.23688
3590.0000 -66.32568 -64.17667 2.14902 1.97813 -64.35995 606.71999
3595.0000 -66.66819 -64.66270 2.00549 1.92463 -64.85327 566.91684
3600.0000 -66.30295 -64.14509 2.15786 1.99914 -64.16622 631.19215
3605.0000 -66.56983 -64.50995 2.05988 1.96049 -64.52259 599.73251
3610.0000 -65.28918 -62.86059 2.42859 2.04174 -63.77334 642.16480
3615.0000 -65.90650 -63.57560 2.33090 2.08639 -63.36170 679.89491
3620.0000 -66.26743 -63.62294 2.64449 2.04583 -63.73567 681.63796
3625.0000 -67.37853 -65.60990 1.76863 1.95948 -64.53193 603.01750
3630.0000 -67.41564 -64.69074 2.72490 1.89817 -65.09726 541.68697
3635.0000 -66.33856 -64.18404 2.15451 1.97076 -64.42791 573.29253
3640.0000 -66.49088 -64.17716 2.31373 2.00225 -64.13749 627.91156
3645.0000 -65.57518 -63.12675 2.44843 2.07176 -63.49658 689.47051
3650.0000 -66.19097 -64.09916 2.09181 2.01942 -63.97917 642.20503
3655.0000 -66.39890 -63.91026 2.48864 2.05464 -63.65439 702.25416
3660.0000 -66.28949 -64.62646 1.66303 1.98232 -64.32129 600.37892
3665.0000 -66.92718 -64.80637 2.12080 1.94255 -64.68801 577.44039
3670.0000 -66.21935 -63.79980 2.41955 1.93604 -64.74805 576.24988
3675.0000 -66.18002 -63.39961 2.78041 2.06961 -63.51643 671.61467
3680.0000 -66.14911 -63.90072 2.24840 2.04478 -63.74532 666.80780
3685.0000 -66.67010 -64.43197 2.23813 2.00561 -64.10651 647.93672
3690.0000 -66.56619 -64.92076 1.64543 1.91344 -64.95644 572.45678
3695.0000 -66.46768 -64.72192 1.74576 1.95456 -64.57728 608.11885
3700.0000 -66.87373 -63.94309 2.93063 1.98049 -64.33816 639.26667
3705.0000 -66.94001 -64.53851 2.40150 1.99797 -64.17698 629.01164
3710.0000 -66.40281 -64.44368 1.95913 1.97640 -64.37589 612.12620
3715.0000 -66.98978 -64.45865 2.53113 1.94269 -64.68673 575.07446
3720.0000 -67.29967 -64.74794 2.55173 1.95968 -64.53008 601.95434
3725.0000 -66.45439 -64.72944 1.72494 1.94127 -64.69982 563.99742
3730.0000 -65.25328 -63.22634 2.02695 2.02358 -63.94085 647.37910
3735.0000 -65.78243 -63.28493 2.49750 2.06652 -63.54485 673.41446
3740.0000 -66.79493 -64.42816 2.36677 2.07886 -63.43105 648.89593
3745.0000 -65.86299 -63.07531 2.78768 2.08748 -63.35166 668.03846
3750.0000 -66.03960 -63.73303 2.30656 2.07926 -63.42742 697.58161
MELTING PROCESS: loop number 16 T-loop= 659.00000000000000
main_MD> interactions number 16 at Temperature= 659.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.06597 0.55035 -3.18344
force_rgl> df(natom) -1.37379 -0.25624 -0.67123
3755.0000 -65.99744 -63.63830 2.35914 2.01701 -64.00138 641.16951
3760.0000 -65.71797 -63.92407 1.79390 2.06504 -63.55850 673.19762
3765.0000 -65.66413 -63.28781 2.37632 2.04240 -63.76730 639.26631
3770.0000 -65.93048 -63.29398 2.63649 2.06617 -63.54815 679.00366
3775.0000 -65.89025 -63.21375 2.67650 2.10442 -63.19538 683.95217
3780.0000 -65.91766 -63.30635 2.61131 2.11133 -63.13168 729.40637
3785.0000 -66.02453 -63.35057 2.67396 2.08835 -63.34362 725.74183
3790.0000 -66.06155 -63.97873 2.08282 2.07497 -63.46699 681.93372
3795.0000 -66.45175 -63.77301 2.67874 2.05858 -63.61811 654.13889
3800.0000 -66.22486 -64.29270 1.93216 1.99771 -64.17935 610.27643
3805.0000 -66.84299 -64.68091 2.16208 1.96548 -64.47653 605.91824
3810.0000 -66.83438 -64.57702 2.25737 1.96899 -64.44422 590.68935
3815.0000 -65.81160 -64.07854 1.73306 1.97395 -64.39847 598.72657
3820.0000 -66.04913 -64.04887 2.00026 2.00496 -64.11255 606.48089
3825.0000 -66.33267 -63.52549 2.80717 2.00309 -64.12981 586.73253
3830.0000 -66.65416 -64.79033 1.86384 2.03541 -63.83171 671.96013
3835.0000 -67.48080 -65.06924 2.41156 1.88797 -65.19127 513.35709
3840.0000 -66.83750 -64.87031 1.96719 1.91728 -64.92097 576.22810
3845.0000 -66.56863 -64.11737 2.45126 1.92275 -64.87059 577.23613
3850.0000 -65.78437 -64.12561 1.65875 2.00415 -64.11998 606.71421
3855.0000 -66.64812 -64.08447 2.56364 1.97915 -64.35048 639.26718
3860.0000 -66.66217 -63.96755 2.69462 1.99677 -64.18802 644.57610
3865.0000 -66.79425 -64.34758 2.44667 2.00195 -64.14030 646.28647
3870.0000 -66.41687 -63.97679 2.44007 1.99049 -64.24591 635.16367
3875.0000 -66.45169 -63.15360 3.29810 2.04237 -63.76758 705.53624
3880.0000 -65.17266 -62.94284 2.22982 2.12224 -63.03108 738.73152
3885.0000 -65.74486 -63.15074 2.59412 2.08286 -63.39425 745.56454
3890.0000 -66.56161 -63.62042 2.94119 2.09655 -63.26797 728.36298
3895.0000 -66.55778 -64.02146 2.53632 2.01775 -63.99460 665.74667
3900.0000 -66.48596 -64.30193 2.18403 1.96375 -64.49252 604.73095
3905.0000 -66.54680 -64.12281 2.42399 1.98966 -64.25362 633.26332
3910.0000 -65.94951 -63.48347 2.46604 2.06213 -63.58538 700.07605
3915.0000 -66.54361 -63.97105 2.57255 2.04270 -63.76449 697.60630
3920.0000 -66.79133 -64.95645 1.83488 1.96618 -64.47009 571.19213
3925.0000 -66.93416 -65.18140 1.75276 1.91707 -64.92290 557.41792
3930.0000 -66.41179 -63.92422 2.48757 1.95809 -64.54471 638.41923
3935.0000 -66.66266 -64.42304 2.23963 2.03357 -63.84872 661.41840
3940.0000 -67.00575 -64.73731 2.26844 1.97375 -64.40034 581.97971
3945.0000 -65.83771 -63.77895 2.05876 2.03596 -63.82665 655.76367
3950.0000 -66.70563 -63.56546 3.14017 2.03654 -63.82134 698.87562
3955.0000 -66.27988 -64.23884 2.04104 2.00534 -64.10906 651.14649
3960.0000 -66.68686 -64.13440 2.55247 1.97898 -64.35212 636.40277
3965.0000 -66.83264 -64.61447 2.21817 1.98438 -64.30227 634.53902
3970.0000 -66.30614 -64.03671 2.26944 1.96705 -64.46208 598.10863
3975.0000 -66.71796 -64.25285 2.46511 2.02714 -63.90796 661.37658
3980.0000 -65.88208 -63.83119 2.05089 2.03996 -63.78978 702.70796
3985.0000 -66.63303 -64.37303 2.26000 1.97370 -64.40075 602.81159
3990.0000 -67.05964 -65.16521 1.89444 1.89134 -65.16015 535.12554
3995.0000 -67.60820 -64.65992 2.94828 1.90849 -65.00205 542.92140
4000.0000 -66.61942 -64.53337 2.08605 1.97869 -64.35473 609.35175
MELTING PROCESS: loop number 17 T-loop= 684.00000000000000
main_MD> interactions number 17 at Temperature= 684.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.74896 -1.08958 -2.38132
force_rgl> df(natom) 1.03848 -2.15844 -1.17887
4005.0000 -66.08795 -64.26753 1.82042 2.00300 -64.13059 629.57837
4010.0000 -66.11344 -63.62622 2.48722 2.01282 -64.04001 657.01447
4015.0000 -66.20412 -64.24278 1.96134 2.01060 -64.06051 639.55940
4020.0000 -65.97367 -63.68940 2.28427 1.97366 -64.40114 576.87960
4025.0000 -65.44566 -62.06096 3.38470 2.13777 -62.88791 753.08491
4030.0000 -65.43415 -62.92933 2.50481 2.19310 -62.37775 802.97915
4035.0000 -65.66198 -62.71822 2.94377 2.12647 -62.99209 728.26350
4040.0000 -66.10308 -63.58231 2.52077 2.14085 -62.85948 790.02259
4045.0000 -66.66847 -63.83274 2.83573 2.03430 -63.84202 697.43499
4050.0000 -66.78727 -64.96736 1.81990 1.97498 -64.38893 609.69213
4055.0000 -65.69519 -63.67850 2.01669 1.97442 -64.39417 605.96007
4060.0000 -66.53044 -63.84225 2.68819 2.02887 -63.89201 689.18249
4065.0000 -65.89545 -63.48555 2.40990 2.05682 -63.63430 665.60219
4070.0000 -66.25750 -63.40428 2.85322 2.04801 -63.71552 675.17405
4075.0000 -66.63580 -63.84464 2.79116 2.05049 -63.69269 673.94845
4080.0000 -66.18489 -63.33882 2.84606 2.01615 -64.00930 611.59582
4085.0000 -65.78311 -62.81299 2.97012 2.10030 -63.23336 737.54486
4090.0000 -65.71054 -63.25180 2.45874 2.16225 -62.66220 783.37337
4095.0000 -65.97401 -62.97157 3.00245 2.11282 -63.11794 726.77788
4100.0000 -66.17342 -63.45553 2.71788 2.11274 -63.11867 735.48120
4105.0000 -66.21205 -63.30390 2.90815 2.10506 -63.18947 747.93993
4110.0000 -66.43298 -64.28319 2.14979 2.01054 -64.06103 633.21588
4115.0000 -66.32866 -63.49623 2.83243 2.02444 -63.93287 643.34328
4120.0000 -66.05444 -63.05211 3.00233 2.06000 -63.60501 701.03701
4125.0000 -66.29947 -63.39041 2.90906 2.13195 -62.94156 736.39998
4130.0000 -65.93115 -63.42982 2.50133 2.07231 -63.49152 667.94684
4135.0000 -66.64946 -64.54073 2.10873 1.99276 -64.22498 661.97327
4140.0000 -66.33697 -64.03113 2.30584 1.97215 -64.41506 618.79142
4145.0000 -66.59741 -63.66857 2.92884 1.98824 -64.26673 627.30916
4150.0000 -66.12543 -63.66009 2.46534 2.07852 -63.43427 731.60456
4155.0000 -65.45661 -62.67161 2.78500 2.10931 -63.15035 739.25696
4160.0000 -65.25049 -62.72284 2.52765 2.16119 -62.67191 780.95166
4165.0000 -65.51348 -63.05443 2.45905 2.14983 -62.77667 761.38067
4170.0000 -65.05029 -62.43004 2.62024 2.16157 -62.66848 797.85105
4175.0000 -65.75333 -64.12271 1.63062 2.08311 -63.39188 735.13618
4180.0000 -66.53063 -63.93816 2.59247 1.99380 -64.21541 628.06044
4185.0000 -66.03315 -63.18419 2.84896 2.05305 -63.66909 682.03520
4190.0000 -66.31612 -62.70549 3.61063 2.10599 -63.18097 720.43900
4195.0000 -66.14459 -63.32766 2.81692 2.09317 -63.29915 708.19967
4200.0000 -65.57408 -62.94411 2.62997 2.12669 -62.99008 782.04260
4205.0000 -66.20068 -63.92223 2.27845 2.09021 -63.32648 702.38574
4210.0000 -66.43238 -63.72981 2.70258 2.05608 -63.64112 678.58716
4215.0000 -65.06759 -62.65656 2.41103 2.10593 -63.18148 695.35092
4220.0000 -66.24839 -63.91753 2.33085 2.06634 -63.54654 706.56260
4225.0000 -65.94871 -63.82349 2.12522 2.05812 -63.62237 670.14228
4230.0000 -65.59106 -62.33603 3.25503 2.10181 -63.21952 752.48214
4235.0000 -65.87039 -63.23359 2.63679 2.11393 -63.10771 754.32968
4240.0000 -65.03223 -62.27196 2.76026 2.18071 -62.49199 805.54162
4245.0000 -65.93717 -62.75340 3.18377 2.14822 -62.79158 785.78329
4250.0000 -66.40113 -62.62260 3.77853 2.14347 -62.83533 730.63348
MELTING PROCESS: loop number 18 T-loop= 709.00000000000000
main_MD> interactions number 18 at Temperature= 709.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00137 1.09739 2.39595
force_rgl> df(natom) 0.01662 1.42589 2.07114
4255.0000 -65.99485 -62.82600 3.16885 2.08267 -63.39601 692.93398
4260.0000 -65.94658 -63.42842 2.51816 2.09808 -63.25386 751.58061
4265.0000 -66.05328 -63.13045 2.92283 2.11627 -63.08611 772.17582
4270.0000 -66.01200 -63.41692 2.59508 2.10975 -63.14631 753.20442
4275.0000 -66.45035 -63.06999 3.38036 2.06216 -63.58505 715.52108
4280.0000 -65.87547 -63.56826 2.30721 2.10052 -63.23138 747.01412
4285.0000 -66.41955 -64.50329 1.91626 2.03082 -63.87410 666.57595
4290.0000 -66.40123 -63.36589 3.03534 2.05180 -63.68066 708.58836
4295.0000 -65.78957 -63.91668 1.87289 2.10753 -63.16676 719.80275
4300.0000 -66.66286 -64.12238 2.54048 1.97568 -64.38253 600.73457
4305.0000 -65.96490 -63.62834 2.33656 2.08792 -63.34760 687.25320
4310.0000 -66.22173 -63.80284 2.41888 2.04768 -63.71864 651.96580
4315.0000 -66.61630 -64.03615 2.58015 1.96391 -64.49104 579.24462
4320.0000 -66.21640 -64.28840 1.92799 1.98425 -64.30351 569.27892
4325.0000 -66.30411 -63.89969 2.40442 2.03365 -63.84798 658.19715
4330.0000 -65.64972 -63.04456 2.60516 2.07396 -63.47632 717.46739
4335.0000 -66.07631 -63.23118 2.84513 2.11431 -63.10426 787.73426
4340.0000 -64.49482 -61.57966 2.91516 2.20185 -62.29699 839.86186
4345.0000 -64.92309 -62.82688 2.09620 2.19835 -62.32932 811.80699
4350.0000 -66.28753 -63.41874 2.86879 2.08682 -63.35772 691.11973
4355.0000 -66.11276 -63.39582 2.71694 2.10971 -63.14661 727.19195
4360.0000 -65.59058 -63.37767 2.21291 2.08360 -63.38735 693.72928
4365.0000 -66.32287 -63.89158 2.43129 2.07821 -63.43713 727.04727
4370.0000 -66.30058 -64.13954 2.16104 2.03415 -63.84336 691.89382
4375.0000 -66.42891 -63.18279 3.24612 2.03398 -63.84495 702.40974
4380.0000 -66.08706 -63.04812 3.03894 2.12596 -62.99682 751.24010
4385.0000 -65.22446 -62.47406 2.75040 2.14013 -62.86617 790.42779
4390.0000 -65.94073 -63.64825 2.29248 2.09045 -63.32420 704.34973
4395.0000 -65.67270 -63.00080 2.67190 2.08266 -63.39607 717.54306
4400.0000 -65.94087 -63.97426 1.96661 2.14141 -62.85436 740.40707
4405.0000 -66.41732 -63.67423 2.74309 2.00798 -64.08467 592.14966
4410.0000 -66.06743 -63.92409 2.14334 2.03532 -63.83256 648.41782
4415.0000 -65.71782 -63.37345 2.34437 2.07509 -63.46589 696.46771
4420.0000 -66.10257 -62.65242 3.45015 2.12265 -63.02730 744.51521
4425.0000 -64.98535 -61.89971 3.08564 2.19279 -62.38055 820.99716
4430.0000 -65.16982 -62.85919 2.31063 2.19803 -62.33225 845.85520
4435.0000 -66.24604 -63.45895 2.78709 2.13644 -62.90018 790.16618
4440.0000 -65.30693 -63.03794 2.26899 2.07404 -63.47556 676.95132
4445.0000 -64.42665 -62.20598 2.22067 2.12297 -63.02438 728.70561
4450.0000 -66.10055 -62.85890 3.24165 2.21234 -62.20028 798.56606
4455.0000 -65.70134 -62.89097 2.81037 2.12092 -63.04323 762.90251
4460.0000 -65.75365 -63.45953 2.29412 2.09100 -63.31914 710.82168
4465.0000 -65.74554 -63.64154 2.10401 2.02007 -63.97321 663.87036
4470.0000 -66.89833 -64.53946 2.35886 2.01832 -63.98935 651.80449
4475.0000 -66.58234 -64.55878 2.02356 1.94945 -64.62435 593.25502
4480.0000 -66.74760 -64.51680 2.23080 1.97758 -64.36497 633.47687
4485.0000 -66.51717 -63.99350 2.52366 2.02349 -63.94165 672.36644
4490.0000 -66.75269 -64.53085 2.22184 1.99471 -64.20703 660.91103
4495.0000 -65.98545 -63.95959 2.02586 2.00542 -64.10828 641.08152
4500.0000 -66.54694 -64.07238 2.47457 2.00885 -64.07662 594.67092
MELTING PROCESS: loop number 19 T-loop= 734.00000000000000
main_MD> interactions number 19 at Temperature= 734.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.36135 1.48889 1.52826
force_rgl> df(natom) -2.37437 1.16196 2.97388
4505.0000 -65.65650 -63.80073 1.85577 2.07497 -63.46695 670.05974
4510.0000 -65.31425 -62.59289 2.72136 2.14784 -62.79507 736.55419
4515.0000 -65.86058 -63.47066 2.38992 2.15492 -62.72972 741.78387
4520.0000 -66.41119 -64.33227 2.07892 2.03351 -63.84928 602.88888
4525.0000 -65.75561 -63.28621 2.46939 2.04203 -63.77074 668.35911
4530.0000 -65.76918 -63.54513 2.22405 2.08524 -63.37230 689.48044
4535.0000 -65.56675 -63.12944 2.43731 2.11546 -63.09363 748.43080
4540.0000 -65.77059 -63.17100 2.59959 2.13017 -62.95800 767.39024
4545.0000 -66.03367 -63.25523 2.77844 2.10415 -63.19786 705.00755
4550.0000 -65.25349 -63.15036 2.10313 2.12503 -63.00534 720.40642
4555.0000 -65.41983 -62.09715 3.32268 2.15548 -62.72461 800.71185
4560.0000 -65.86811 -62.49487 3.37325 2.22627 -62.07187 812.92191
4565.0000 -66.03232 -63.23713 2.79520 2.08606 -63.36470 713.91295
4570.0000 -66.63657 -63.99895 2.63762 2.02636 -63.91518 678.53779
4575.0000 -66.27728 -63.98528 2.29200 1.97349 -64.40271 607.13244
4580.0000 -65.80163 -63.40543 2.39619 2.01606 -64.01016 621.97493
4585.0000 -65.90082 -63.77348 2.12734 2.05917 -63.61265 654.84128
4590.0000 -65.47207 -63.55404 1.91803 2.06946 -63.51779 731.82581
4595.0000 -64.78494 -62.34281 2.44213 2.12415 -63.01349 759.68941
4600.0000 -64.53571 -62.34642 2.18929 2.18048 -62.49406 794.92945
4605.0000 -65.08854 -62.46271 2.62582 2.20330 -62.28368 806.28925
4610.0000 -64.95424 -62.92146 2.03278 2.17439 -62.55026 816.85714
4615.0000 -65.91194 -63.15195 2.75999 2.14084 -62.85961 781.30475
4620.0000 -66.29109 -63.27809 3.01300 2.09413 -63.29030 745.19278
4625.0000 -65.68315 -63.20041 2.48274 2.09558 -63.27689 703.56380
4630.0000 -65.55399 -63.10441 2.44958 2.10055 -63.23113 724.59636
4635.0000 -65.65548 -62.77934 2.87614 2.13145 -62.94621 775.38131
4640.0000 -65.54855 -62.53476 3.01379 2.19021 -62.40437 832.93939
4645.0000 -65.89620 -63.27917 2.61702 2.13656 -62.89904 757.89868
4650.0000 -66.36938 -63.64562 2.72376 2.08566 -63.36843 698.57865
4655.0000 -65.38711 -63.13917 2.24794 2.10991 -63.14477 755.99435
4660.0000 -66.46162 -63.46366 2.99796 2.14931 -62.78150 784.26594
4665.0000 -64.91277 -61.73835 3.17441 2.15273 -62.74996 757.06107
4670.0000 -65.72723 -63.21947 2.50776 2.18069 -62.49214 829.81734
4675.0000 -66.55222 -63.82533 2.72688 2.06559 -63.55343 690.46839
4680.0000 -66.49698 -64.00746 2.48952 2.01010 -64.06517 631.67692
4685.0000 -66.00718 -63.66122 2.34596 2.02404 -63.93657 647.06322
4690.0000 -65.83667 -63.14999 2.68668 2.08101 -63.41125 690.65015
4695.0000 -65.95264 -62.74690 3.20574 2.12735 -62.98394 804.11000
4700.0000 -66.08303 -63.61779 2.46524 2.04122 -63.77813 699.18488
4705.0000 -66.32751 -63.61610 2.71140 2.08425 -63.38143 687.26566
4710.0000 -66.00648 -63.83348 2.17300 2.06191 -63.58735 688.76689
4715.0000 -66.87890 -63.93733 2.94156 2.03987 -63.79062 697.42526
4720.0000 -66.01564 -63.17293 2.84271 2.04156 -63.77507 683.57838
4725.0000 -65.78054 -63.23599 2.54455 2.10804 -63.16199 718.48384
4730.0000 -66.39744 -64.61073 1.78671 2.04910 -63.70552 632.36248
4735.0000 -66.39643 -63.75364 2.64279 1.99265 -64.22601 591.14713
4740.0000 -66.74717 -64.47954 2.26763 2.04405 -63.75206 700.69982
4745.0000 -65.92178 -63.85195 2.06983 2.02216 -63.95392 671.88547
4750.0000 -65.74415 -64.01361 1.73054 2.02307 -63.94557 616.52703
MELTING PROCESS: loop number 20 T-loop= 759.00000000000000
main_MD> interactions number 20 at Temperature= 759.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.17344 -1.02540 3.32589
force_rgl> df(natom) -4.69993 1.83689 -1.22015
4755.0000 -65.85529 -63.71908 2.13621 2.00503 -64.11184 646.54477
4760.0000 -66.36124 -64.34019 2.02105 2.02739 -63.90568 626.15524
4765.0000 -66.26294 -63.28200 2.98094 2.04252 -63.76618 686.05964
4770.0000 -65.30522 -62.90963 2.39558 2.10293 -63.20911 735.10318
4775.0000 -65.57124 -63.03629 2.53495 2.10766 -63.16550 747.29567
4780.0000 -64.78891 -62.20159 2.58732 2.14734 -62.79964 773.40380
4785.0000 -64.43079 -62.19307 2.23772 2.19411 -62.36839 784.55624
4790.0000 -66.46069 -63.07721 3.38348 2.18954 -62.41054 824.16334
4795.0000 -65.62902 -63.19035 2.43867 2.07963 -63.42403 673.63929
4800.0000 -65.93472 -62.47205 3.46267 2.19887 -62.32452 857.33371
4805.0000 -65.76983 -63.42357 2.34626 2.17300 -62.56301 763.54351
4810.0000 -66.04905 -63.43095 2.61810 2.13009 -62.95871 738.52764
4815.0000 -65.82177 -62.98348 2.83829 2.10745 -63.16744 743.89092
4820.0000 -66.30827 -63.17258 3.13568 2.08797 -63.34712 737.86125
4825.0000 -66.65688 -63.43471 3.22217 2.04371 -63.75521 630.91883
4830.0000 -66.36591 -63.69674 2.66917 2.05487 -63.65232 716.38895
4835.0000 -64.86613 -62.47069 2.39544 2.07003 -63.51254 706.02376
4840.0000 -65.21983 -63.00193 2.21789 2.12668 -62.99013 746.46501
4845.0000 -65.30259 -63.30231 2.00028 2.07760 -63.44271 679.88393
4850.0000 -65.50936 -62.44793 3.06143 2.15615 -62.71840 758.55883
4855.0000 -65.12153 -62.15081 2.97072 2.22221 -62.10929 849.74954
4860.0000 -64.55709 -61.55846 2.99863 2.24326 -61.91514 851.53771
4865.0000 -64.37920 -61.70700 2.67221 2.27968 -61.57932 897.36207
4870.0000 -65.69525 -63.19668 2.49857 2.27221 -61.64823 917.10804
4875.0000 -65.70069 -63.00119 2.69950 2.10148 -63.22256 718.01498
4880.0000 -66.70654 -63.63977 3.06677 2.09669 -63.26666 711.09857
4885.0000 -64.85765 -61.93251 2.92515 2.12031 -63.04886 761.97621
4890.0000 -65.87573 -63.33523 2.54051 2.17465 -62.54786 807.34085
4895.0000 -65.94851 -63.14890 2.79961 2.07885 -63.43117 718.62373
4900.0000 -65.84419 -63.37244 2.47175 2.06695 -63.54092 700.70078
4905.0000 -66.45338 -64.04749 2.40589 2.09641 -63.26924 720.70788
4910.0000 -66.71189 -63.72801 2.98388 2.00578 -64.10492 622.07755
4915.0000 -65.79374 -63.44120 2.35254 2.06049 -63.60044 678.42485
4920.0000 -65.47859 -62.90565 2.57294 2.13239 -62.93748 750.72509
4925.0000 -65.95859 -63.55240 2.40619 2.08759 -63.35059 729.91003
4930.0000 -65.68498 -62.76279 2.92219 2.09517 -63.28072 725.70595
4935.0000 -66.02305 -63.27872 2.74433 2.14356 -62.83451 769.09487
4940.0000 -65.56172 -62.82690 2.73483 2.08790 -63.34770 715.55857
4945.0000 -66.80230 -63.94499 2.85730 2.08604 -63.36491 696.36744
4950.0000 -65.81747 -62.63545 3.18202 2.17570 -62.53814 818.59547
4955.0000 -65.31633 -62.93085 2.38548 2.19082 -62.39869 800.16025
4960.0000 -66.17714 -64.08203 2.09511 2.08030 -63.41784 701.92785
4965.0000 -66.23379 -63.36991 2.86388 2.09643 -63.26913 689.56880
4970.0000 -65.39430 -62.76546 2.62884 2.10895 -63.15364 686.27613
4975.0000 -64.80843 -62.17628 2.63215 2.19097 -62.39732 776.25552
4980.0000 -65.60323 -62.35952 3.24371 2.18994 -62.40686 783.68519
4985.0000 -65.29548 -62.05147 3.24401 2.21740 -62.15367 836.92843
4990.0000 -65.36317 -62.07849 3.28468 2.23608 -61.98138 782.73385
4995.0000 -65.32489 -62.62094 2.70395 2.21361 -62.18854 780.99256
5000.0000 -65.78934 -62.93463 2.85471 2.13045 -62.95536 733.38544
MELTING PROCESS: loop number 21 T-loop= 784.00000000000000
main_MD> interactions number 21 at Temperature= 784.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.69600 -0.40640 -0.48600
force_rgl> df(natom) 1.34285 -0.65382 1.04270
5005.0000 -65.44697 -62.63606 2.81092 2.20715 -62.24815 791.55844
5010.0000 -65.52571 -62.50302 3.02270 2.19646 -62.34674 811.93694
5015.0000 -65.18385 -62.76112 2.42273 2.19215 -62.38644 820.68169
5020.0000 -65.58662 -62.44985 3.13677 2.17735 -62.52297 770.29716
5025.0000 -65.28696 -62.25208 3.03488 2.18722 -62.43189 770.46037
5030.0000 -65.17142 -62.79998 2.37144 2.19071 -62.39971 789.57193
5035.0000 -66.01389 -63.10236 2.91153 2.15147 -62.76155 752.59277
5040.0000 -66.22742 -63.28276 2.94467 2.12056 -63.04655 753.26830
5045.0000 -66.22710 -63.20782 3.01929 2.10810 -63.16150 755.11950
5050.0000 -65.30800 -62.65504 2.65296 2.14112 -62.85701 798.24252
5055.0000 -65.10290 -62.81966 2.28324 2.11178 -63.12757 755.28567
5060.0000 -66.08284 -63.69721 2.38563 2.08089 -63.41236 686.36490
5065.0000 -65.24106 -62.84401 2.39704 2.08941 -63.33379 745.71272
5070.0000 -65.02652 -62.45279 2.57373 2.16975 -62.59300 793.40234
5075.0000 -65.23924 -63.41749 1.82174 2.15332 -62.74449 707.71787
5080.0000 -66.23905 -63.89683 2.34222 2.05987 -63.60619 667.26126
5085.0000 -66.56429 -63.96982 2.59447 2.03492 -63.83625 637.57013
5090.0000 -65.87343 -63.59731 2.27612 2.03973 -63.79189 689.73120
5095.0000 -65.14335 -63.14086 2.00249 2.06933 -63.51900 703.96582
5100.0000 -65.03813 -61.57405 3.46408 2.20788 -62.24140 811.12018
5105.0000 -64.56550 -61.82236 2.74315 2.25879 -61.77196 857.81463
5110.0000 -65.18842 -62.01779 3.17062 2.26346 -61.72888 873.29546
5115.0000 -65.76921 -62.50075 3.26846 2.23386 -62.00187 837.73018
5120.0000 -65.41987 -62.69620 2.72366 2.14200 -62.84891 757.17387
5125.0000 -64.97624 -61.87020 3.10604 2.25064 -61.84714 896.56047
5130.0000 -63.93930 -61.20847 2.73083 2.27223 -61.64810 840.31009
5135.0000 -64.04620 -60.69871 3.34750 2.29812 -61.40934 870.50601
5140.0000 -66.12458 -61.81182 4.31276 2.28788 -61.50378 899.45963
5145.0000 -64.47321 -61.45978 3.01342 2.27813 -61.59363 888.26166
5150.0000 -64.26085 -60.58051 3.68034 2.30033 -61.38893 918.67789
5155.0000 -63.81826 -61.09424 2.72402 2.34309 -60.99465 987.13658
5160.0000 -65.06152 -62.29846 2.76306 2.25105 -61.84333 841.75047
5165.0000 -65.61853 -61.10589 4.51264 2.25804 -61.77891 875.06689
5170.0000 -65.85015 -63.15697 2.69319 2.23359 -62.00440 857.17949
5175.0000 -66.31446 -63.36473 2.94972 2.10869 -63.15607 722.82533
5180.0000 -66.04769 -63.61044 2.43725 2.08897 -63.33783 704.09595
5185.0000 -66.31827 -63.58729 2.73097 2.05342 -63.66568 684.15700
5190.0000 -65.68004 -63.01256 2.66748 2.04300 -63.76173 695.26147
5195.0000 -65.58354 -63.34706 2.23647 2.12580 -62.99830 781.17415
5200.0000 -65.33077 -62.11323 3.21755 2.13931 -62.87371 783.78597
5205.0000 -65.58894 -62.48790 3.10104 2.23511 -61.99032 893.43511
5210.0000 -65.56627 -62.76681 2.79946 2.21490 -62.17669 828.54640
5215.0000 -65.45280 -62.61475 2.83805 2.14519 -62.81946 744.46458
5220.0000 -65.30430 -62.06765 3.23664 2.24039 -61.94166 844.35453
5225.0000 -65.46561 -62.41909 3.04652 2.22671 -62.06775 805.47573
5230.0000 -65.58088 -62.14283 3.43805 2.21668 -62.16031 814.22808
5235.0000 -66.54851 -63.06982 3.47869 2.16280 -62.65708 766.16478
5240.0000 -65.26550 -62.52774 2.73777 2.14155 -62.85305 752.69577
5245.0000 -65.51829 -62.64444 2.87386 2.20782 -62.24193 831.60896
5250.0000 -66.23813 -63.09942 3.13871 2.14701 -62.80272 789.51296
MELTING PROCESS: loop number 22 T-loop= 809.00000000000000
main_MD> interactions number 22 at Temperature= 809.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.39824 1.38531 -0.25386
force_rgl> df(natom) -2.44500 -2.41926 -1.93380
5255.0000 -64.94970 -62.18612 2.76358 2.22132 -62.11748 844.14101
5260.0000 -64.54031 -62.17964 2.36067 2.21600 -62.16652 789.69644
5265.0000 -63.77750 -61.22163 2.55587 2.29362 -61.45078 841.32633
5270.0000 -64.30210 -61.75736 2.54474 2.31464 -61.25702 872.53894
5275.0000 -64.81899 -61.51251 3.30648 2.30718 -61.32581 850.02927
5280.0000 -65.76836 -62.79842 2.96994 2.13480 -62.91525 753.83058
5285.0000 -65.53766 -63.01728 2.52038 2.15628 -62.71724 773.82441
5290.0000 -65.83794 -62.91424 2.92370 2.12441 -63.01109 787.83634
5295.0000 -66.30236 -63.41859 2.88377 2.09133 -63.31614 756.79096
5300.0000 -65.47661 -62.10828 3.36833 2.10405 -63.19884 762.03006
5305.0000 -65.13452 -62.83858 2.29594 2.20741 -62.24579 848.60984
5310.0000 -66.28400 -63.45911 2.82489 2.09278 -63.30270 746.80473
5315.0000 -66.24376 -63.25066 2.99310 2.07936 -63.42650 726.63522
5320.0000 -65.86888 -63.18653 2.68235 2.09844 -63.25057 734.25559
5325.0000 -64.96177 -61.60145 3.36032 2.22078 -62.12246 828.52299
5330.0000 -65.55507 -62.11360 3.44148 2.25921 -61.76811 872.28141
5335.0000 -65.53125 -61.97628 3.55497 2.25840 -61.77555 872.98389
5340.0000 -65.17955 -62.05415 3.12541 2.20801 -62.24019 844.24374
5345.0000 -64.59920 -61.91346 2.68575 2.23733 -61.96990 820.07536
5350.0000 -64.58951 -60.92656 3.66295 2.29366 -61.45049 880.48203
5355.0000 -64.25035 -61.47460 2.77574 2.34466 -60.98020 961.21186
5360.0000 -64.48924 -60.97214 3.51709 2.22053 -62.12482 779.67846
5365.0000 -64.35453 -61.41444 2.94009 2.31130 -61.28780 913.82735
5370.0000 -65.29307 -61.34332 3.94976 2.28481 -61.53203 870.77952
5375.0000 -64.19294 -60.67563 3.51731 2.27577 -61.61538 897.74762
5380.0000 -65.50195 -62.17575 3.32620 2.25498 -61.80708 824.01276
5385.0000 -64.92068 -61.95120 2.96948 2.21459 -62.17954 804.36791
5390.0000 -65.78858 -63.13639 2.65220 2.17062 -62.58498 783.87266
5395.0000 -65.43386 -62.58520 2.84866 2.12904 -62.96843 728.80209
5400.0000 -65.81586 -63.19666 2.61920 2.09198 -63.31012 712.23016
5405.0000 -66.04106 -63.18149 2.85957 2.12997 -62.95981 751.14632
5410.0000 -65.29012 -62.85822 2.43190 2.11568 -63.09159 726.92198
5415.0000 -64.82016 -62.37528 2.44489 2.19027 -62.40382 753.89510
5420.0000 -65.40488 -62.39227 3.01261 2.18032 -62.49554 782.93034
5425.0000 -65.05737 -61.83680 3.22057 2.24873 -61.86479 834.26897
5430.0000 -64.97100 -62.17365 2.79735 2.20796 -62.24065 827.17766
5435.0000 -64.68448 -61.58892 3.09556 2.26994 -61.66921 891.30362
5440.0000 -65.36861 -60.89751 4.47110 2.35705 -60.86590 920.30136
5445.0000 -64.80429 -61.51942 3.28487 2.33700 -61.05078 920.72565
5450.0000 -64.61456 -61.55590 3.05866 2.37890 -60.66450 1000.90654
5455.0000 -65.88779 -62.51367 3.37412 2.21330 -62.19146 830.95760
5460.0000 -64.75127 -61.73383 3.01743 2.22027 -62.12713 830.04980
5465.0000 -65.15037 -61.30553 3.84484 2.24439 -61.90479 876.95125
5470.0000 -65.56876 -62.82852 2.74024 2.24926 -61.85986 903.67655
5475.0000 -64.86188 -62.63303 2.22885 2.12298 -63.02430 693.23829
5480.0000 -65.73036 -62.92749 2.80287 2.16854 -62.60414 776.98389
5485.0000 -66.06957 -62.42527 3.64430 2.17716 -62.52469 806.06215
5490.0000 -65.52241 -62.17767 3.34475 2.20630 -62.25598 822.84147
5495.0000 -64.46929 -61.92809 2.54120 2.24057 -61.94002 828.59455
5500.0000 -64.92488 -62.12307 2.80181 2.21794 -62.14866 773.51612
MELTING PROCESS: loop number 23 T-loop= 834.00000000000000
main_MD> interactions number 23 at Temperature= 834.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.76665 -0.59394 -0.91121
force_rgl> df(natom) -1.43932 0.51187 2.27685
5505.0000 -65.44095 -61.98778 3.45317 2.25294 -61.82594 876.19740
5510.0000 -65.44464 -62.45263 2.99202 2.22642 -62.07046 834.55155
5515.0000 -64.42991 -60.79544 3.63447 2.33510 -61.06831 902.46644
5520.0000 -64.34033 -61.99160 2.34873 2.30001 -61.39190 885.95394
5525.0000 -65.08937 -62.68815 2.40122 2.17383 -62.55543 805.32745
5530.0000 -65.25814 -62.31731 2.94083 2.16232 -62.66151 804.49365
5535.0000 -65.50883 -62.56406 2.94476 2.20179 -62.29756 781.48988
5540.0000 -64.38015 -61.88727 2.49288 2.20506 -62.26739 801.46258
5545.0000 -64.57055 -61.93079 2.63976 2.25353 -61.82050 811.93993
5550.0000 -65.45349 -62.73549 2.71800 2.26603 -61.70526 886.54252
5555.0000 -65.42838 -62.93247 2.49591 2.14397 -62.83071 774.94507
5560.0000 -65.24194 -62.51256 2.72939 2.12660 -62.99090 715.61374
5565.0000 -65.60828 -63.35053 2.25775 2.11220 -63.12363 723.34519
5570.0000 -65.95029 -63.25208 2.69821 2.18346 -62.46661 801.71663
5575.0000 -65.34481 -61.84409 3.50072 2.18185 -62.48146 835.12006
5580.0000 -66.18845 -63.10987 3.07858 2.18954 -62.41051 773.65185
5585.0000 -65.06226 -61.83214 3.23012 2.16303 -62.65500 775.41524
5590.0000 -64.89289 -62.44969 2.44320 2.24762 -61.87497 861.49586
5595.0000 -65.85496 -63.82553 2.02943 2.15265 -62.75067 764.97214
5600.0000 -65.72756 -62.96368 2.76388 2.10694 -63.17215 769.93914
5605.0000 -64.43895 -61.60392 2.83503 2.22833 -62.05288 825.09641
5610.0000 -65.45215 -62.79670 2.65544 2.19364 -62.37273 770.78457
5615.0000 -64.43714 -61.53494 2.90220 2.19061 -62.40067 786.38544
5620.0000 -65.30068 -61.77658 3.52410 2.27750 -61.59949 894.42213
5625.0000 -65.27908 -61.70985 3.56923 2.23803 -61.96339 872.73689
5630.0000 -65.33950 -61.85945 3.48005 2.22577 -62.07648 854.78348
5635.0000 -65.21552 -63.00540 2.21012 2.17545 -62.54042 822.32341
5640.0000 -65.34781 -61.28029 4.06753 2.21745 -62.15322 832.32152
5645.0000 -65.85968 -62.61681 3.24288 2.25070 -61.84658 864.31332
5650.0000 -65.14223 -62.90571 2.23652 2.18462 -62.45592 828.00101
5655.0000 -64.70411 -61.93401 2.77010 2.20222 -62.29358 795.77352
5660.0000 -65.15389 -62.58506 2.56883 2.20418 -62.27555 805.00176
5665.0000 -65.40609 -61.95092 3.45517 2.14592 -62.81273 744.18170
5670.0000 -64.66977 -61.82041 2.84936 2.29241 -61.46194 892.63744
5675.0000 -63.43066 -59.68531 3.74534 2.35340 -60.89962 896.78689
5680.0000 -66.13060 -63.68774 2.44287 2.32698 -61.14325 900.02293
5685.0000 -65.48669 -63.88115 1.60554 2.04546 -63.73906 663.16590
5690.0000 -64.95299 -62.96592 1.98707 2.09884 -63.24686 674.49074
5695.0000 -64.80949 -61.81277 2.99673 2.20527 -62.26552 824.41174
5700.0000 -65.30296 -62.23555 3.06741 2.26583 -61.70711 901.84121
5705.0000 -64.46914 -61.08399 3.38515 2.31332 -61.26920 917.86863
5710.0000 -63.43744 -60.99955 2.43789 2.31044 -61.29569 917.16352
5715.0000 -64.46250 -59.44772 5.01477 2.45193 -59.99102 1036.41532
5720.0000 -64.18312 -59.51931 4.66382 2.49434 -59.59999 1093.09716
5725.0000 -64.83182 -60.44219 4.38963 2.48229 -59.71111 1124.40619
5730.0000 -64.71820 -61.29521 3.42299 2.35050 -60.92632 966.22149
5735.0000 -64.10398 -62.06953 2.03446 2.26379 -61.72589 835.73133
5740.0000 -65.19554 -62.66301 2.53253 2.22442 -62.08887 831.78582
5745.0000 -64.50954 -62.21324 2.29629 2.18237 -62.47665 785.82128
5750.0000 -65.05971 -61.93257 3.12714 2.25144 -61.83978 875.54446
MELTING PROCESS: loop number 24 T-loop= 859.00000000000000
main_MD> interactions number 24 at Temperature= 859.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.68766 1.36689 0.59714
force_rgl> df(natom) -1.23795 0.65825 -0.78395
5755.0000 -64.81180 -61.84232 2.96948 2.25216 -61.83315 866.76165
5760.0000 -65.09723 -62.59362 2.50362 2.19628 -62.34836 795.72501
5765.0000 -64.98954 -62.17943 2.81010 2.20046 -62.30987 853.21260
5770.0000 -64.85588 -61.47195 3.38393 2.24898 -61.86245 876.68968
5775.0000 -64.94939 -61.24285 3.70654 2.29718 -61.41799 881.95130
5780.0000 -65.07788 -61.17682 3.90106 2.37780 -60.67461 988.05262
5785.0000 -65.67051 -62.60075 3.06976 2.24538 -61.89567 842.36424
5790.0000 -66.43514 -63.87783 2.55731 2.13237 -62.93772 789.61399
5795.0000 -66.55863 -63.03773 3.52090 2.09914 -63.24410 753.17979
5800.0000 -65.55241 -62.83879 2.71362 2.14217 -62.84736 780.49925
5805.0000 -65.27383 -61.73644 3.53740 2.23001 -62.03733 858.18782
5810.0000 -63.65558 -60.50294 3.15263 2.31437 -61.25947 895.38227
5815.0000 -64.71134 -61.86051 2.85082 2.33295 -61.08812 905.40367
5820.0000 -66.03660 -62.08963 3.94698 2.23666 -61.97607 859.06566
5825.0000 -65.90025 -62.94393 2.95632 2.12590 -62.99730 754.92500
5830.0000 -66.26061 -63.64813 2.61249 2.12158 -63.03722 742.44223
5835.0000 -66.48867 -63.82163 2.66704 2.04813 -63.71442 683.12055
5840.0000 -65.06803 -61.89893 3.16910 2.13789 -62.88680 731.16030
5845.0000 -65.69018 -63.42918 2.26100 2.13028 -62.95700 751.71942
5850.0000 -65.62249 -62.82993 2.79256 2.11451 -63.10234 717.92075
5855.0000 -64.72370 -62.18195 2.54175 2.23259 -62.01356 784.91077
5860.0000 -64.31062 -60.90457 3.40605 2.31159 -61.28513 897.27500
5865.0000 -64.85575 -61.99543 2.86032 2.27259 -61.64475 908.98738
5870.0000 -65.30510 -62.14797 3.15713 2.25403 -61.81589 871.80585
5875.0000 -63.77271 -60.42554 3.34718 2.28326 -61.54632 938.48234
5880.0000 -64.18307 -60.57774 3.60533 2.39239 -60.54012 993.98917
5885.0000 -63.51355 -59.55916 3.95438 2.40600 -60.41459 981.92301
5890.0000 -64.82874 -61.64866 3.18008 2.35113 -60.92056 980.34888
5895.0000 -65.27556 -62.01869 3.25687 2.25151 -61.83907 874.63969
5900.0000 -64.35556 -62.07362 2.28194 2.26028 -61.75827 853.64712
5905.0000 -64.55041 -61.22020 3.33021 2.24192 -61.92757 843.07162
5910.0000 -64.49655 -61.51452 2.98203 2.32559 -61.15599 943.22788
5915.0000 -62.94803 -59.97404 2.97398 2.38531 -60.60534 953.05021
5920.0000 -64.12471 -60.88731 3.23741 2.40697 -60.40568 1039.86336
5925.0000 -65.21259 -62.14019 3.07239 2.32421 -61.16878 915.40507
5930.0000 -65.61992 -62.10746 3.51246 2.25633 -61.79464 872.34700
5935.0000 -65.46826 -62.07281 3.39545 2.18935 -62.41229 815.01465
5940.0000 -64.97732 -61.74481 3.23250 2.17674 -62.52852 789.20023
5945.0000 -66.24715 -63.16384 3.08332 2.16358 -62.64987 794.42658
5950.0000 -66.03440 -63.18819 2.84621 2.11332 -63.11334 782.37175
5955.0000 -66.06543 -62.79271 3.27272 2.08891 -63.33844 759.34457
5960.0000 -66.03706 -62.68948 3.34758 2.14798 -62.79379 752.02347
5965.0000 -65.47152 -62.92244 2.54908 2.14029 -62.86463 798.13012
5970.0000 -65.96917 -63.31035 2.65882 2.14101 -62.85806 773.09085
5975.0000 -65.80241 -63.20952 2.59289 2.07508 -63.46592 685.21860
5980.0000 -64.69028 -62.27507 2.41521 2.18947 -62.41121 808.56318
5985.0000 -65.56417 -62.68895 2.87522 2.15861 -62.69571 751.34417
5990.0000 -64.17811 -61.14548 3.03263 2.32537 -61.15809 937.26215
5995.0000 -64.93484 -62.46716 2.46769 2.25072 -61.84638 846.16349
6000.0000 -65.87029 -62.71294 3.15736 2.22400 -62.09277 830.09664
MELTING PROCESS: loop number 25 T-loop= 884.00000000000000
main_MD> interactions number 25 at Temperature= 884.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.11209 4.53534 1.73503
force_rgl> df(natom) 6.37205 4.40019 0.04457
6005.0000 -64.54830 -61.08822 3.46007 2.24151 -61.93136 867.15970
6010.0000 -64.26180 -60.80937 3.45243 2.41088 -60.36958 1011.77374
6015.0000 -64.69774 -61.16136 3.53637 2.39494 -60.51657 1034.70920
6020.0000 -63.99128 -61.19998 2.79130 2.33477 -61.07134 911.73901
6025.0000 -64.74247 -61.15193 3.59054 2.29297 -61.45682 878.51775
6030.0000 -64.59927 -61.32440 3.27487 2.32213 -61.18794 946.25472
6035.0000 -64.97786 -61.72286 3.25500 2.28039 -61.57282 883.41650
6040.0000 -64.14438 -60.88709 3.25729 2.30716 -61.32599 928.33454
6045.0000 -63.80149 -60.86714 2.93435 2.34462 -60.98055 920.62071
6050.0000 -64.48176 -61.72108 2.76068 2.34784 -60.95087 911.76424
6055.0000 -64.48368 -61.89194 2.59174 2.21272 -62.19677 816.27292
6060.0000 -64.29073 -60.78359 3.50713 2.29034 -61.48103 856.48204
6065.0000 -63.31947 -60.75970 2.55977 2.37242 -60.72422 1001.76640
6070.0000 -65.48120 -61.45731 4.02389 2.32509 -61.16068 905.22667
6075.0000 -65.36413 -61.93828 3.42585 2.28667 -61.51490 921.51159
6080.0000 -64.67935 -61.19236 3.48699 2.33944 -61.02834 928.57961
6085.0000 -64.00342 -60.24897 3.75446 2.36930 -60.75298 931.39239
6090.0000 -64.86809 -61.91972 2.94837 2.34715 -60.95724 936.72993
6095.0000 -65.87305 -62.15469 3.71836 2.18881 -62.41726 813.65525
6100.0000 -65.07976 -61.97721 3.10255 2.29341 -61.45273 910.08105
6105.0000 -65.37961 -61.47069 3.90892 2.31247 -61.27705 914.63286
6110.0000 -64.90430 -61.48518 3.41912 2.28789 -61.50364 883.70941
6115.0000 -64.28190 -61.12859 3.15332 2.29270 -61.45931 824.45156
6120.0000 -64.50805 -61.59654 2.91152 2.30154 -61.37781 898.68915
6125.0000 -64.60876 -61.03998 3.56878 2.24182 -61.92844 820.67582
6130.0000 -64.07396 -60.91880 3.15516 2.32643 -61.14830 932.51544
6135.0000 -65.72836 -61.71895 4.00941 2.28080 -61.56903 833.38669
6140.0000 -64.88176 -61.70874 3.17303 2.26382 -61.72557 851.08968
6145.0000 -65.23508 -62.29250 2.94258 2.20723 -62.24741 828.86195
6150.0000 -65.97094 -62.93802 3.03292 2.19027 -62.40381 824.32535
6155.0000 -65.17635 -61.78097 3.39538 2.15299 -62.74753 756.82226
6160.0000 -65.33507 -62.22329 3.11177 2.25851 -61.77460 823.94029
6165.0000 -64.92949 -62.48584 2.44364 2.19689 -62.34276 778.86230
6170.0000 -65.98245 -62.68508 3.29737 2.18373 -62.46412 838.29928
6175.0000 -64.48360 -61.14168 3.34192 2.29465 -61.44134 910.45649
6180.0000 -65.08965 -60.92022 4.16944 2.30126 -61.38041 904.72116
6185.0000 -64.50143 -61.64321 2.85821 2.29749 -61.41509 912.47054
6190.0000 -64.72103 -61.99612 2.72490 2.23290 -62.01075 891.94725
6195.0000 -64.43841 -61.27362 3.16479 2.29897 -61.40152 899.62548
6200.0000 -63.64996 -61.14436 2.50560 2.30851 -61.31354 933.56045
6205.0000 -63.33177 -60.45480 2.87697 2.34290 -60.99640 977.80057
6210.0000 -65.55011 -62.07867 3.47144 2.29715 -61.41827 886.35343
6215.0000 -64.10376 -60.67920 3.42455 2.24652 -61.88511 869.07039
6220.0000 -65.24881 -61.78337 3.46544 2.27040 -61.66497 901.93000
6225.0000 -64.51106 -61.38234 3.12873 2.29955 -61.39613 914.75839
6230.0000 -64.61783 -60.55720 4.06063 2.31457 -61.25762 942.99397
6235.0000 -65.34690 -62.26288 3.08402 2.31557 -61.24844 935.26387
6240.0000 -64.30322 -61.67254 2.63068 2.26598 -61.70565 895.74997
6245.0000 -64.77562 -61.48998 3.28564 2.25908 -61.76934 797.85613
6250.0000 -64.42086 -61.60461 2.81625 2.26215 -61.74099 873.66200
MELTING PROCESS: loop number 26 T-loop= 909.00000000000000
main_MD> interactions number 26 at Temperature= 909.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60508 0.96901 -1.86722
force_rgl> df(natom) 1.00804 -0.31731 -1.06994
6255.0000 -64.83452 -61.60259 3.23193 2.26532 -61.71180 848.49985
6260.0000 -65.10963 -61.52183 3.58781 2.30115 -61.38135 923.27688
6265.0000 -64.61394 -60.73585 3.87809 2.34642 -60.96398 951.76436
6270.0000 -64.75925 -61.06966 3.68960 2.36082 -60.83119 944.13643
6275.0000 -64.67423 -61.99725 2.67698 2.27673 -61.60661 875.28233
6280.0000 -65.69344 -63.05778 2.63566 2.21765 -62.15129 863.62542
6285.0000 -64.32390 -61.56080 2.76310 2.20294 -62.28696 778.37319
6290.0000 -65.15784 -62.13563 3.02221 2.27519 -61.62076 845.86422
6295.0000 -65.44051 -61.51043 3.93009 2.31167 -61.28439 947.74758
6300.0000 -65.92420 -61.89877 4.02542 2.28033 -61.57337 961.59569
6305.0000 -65.34548 -62.23549 3.10998 2.21045 -62.21770 861.94927
6310.0000 -65.21762 -62.35355 2.86407 2.15546 -62.72474 788.48276
6315.0000 -64.88926 -62.24618 2.64308 2.20829 -62.23763 848.08449
6320.0000 -66.24182 -61.84785 4.39397 2.21087 -62.21388 838.97726
6325.0000 -63.46618 -60.92084 2.54534 2.28900 -61.49343 915.66699
6330.0000 -64.02760 -60.51973 3.50786 2.31976 -61.20983 887.55277
6335.0000 -63.98998 -60.51580 3.47418 2.43565 -60.14122 1062.69722
6340.0000 -63.58388 -59.87330 3.71058 2.46301 -59.88894 1065.76642
6345.0000 -62.96568 -59.68000 3.28568 2.49782 -59.56794 1015.15653
6350.0000 -64.17544 -61.38405 2.79139 2.41079 -60.37040 1019.36886
6355.0000 -64.11987 -61.39092 2.72895 2.29350 -61.45194 871.52741
6360.0000 -64.70812 -61.05969 3.64843 2.32536 -61.15818 960.09323
6365.0000 -63.77570 -60.92298 2.85272 2.32474 -61.16384 915.12837
6370.0000 -65.08738 -61.67759 3.40978 2.34161 -61.00832 973.07869
6375.0000 -64.19245 -60.88737 3.30509 2.35239 -60.90889 930.75895
6380.0000 -65.05630 -62.26490 2.79140 2.25228 -61.83201 848.02310
6385.0000 -64.32155 -60.20366 4.11789 2.35326 -60.90087 976.39246
6390.0000 -63.43324 -58.59090 4.84235 2.51615 -59.39888 1128.83563
6395.0000 -63.60426 -59.27371 4.33054 2.46432 -59.87678 1016.73844
6400.0000 -64.89988 -61.36782 3.53206 2.46658 -59.85601 1074.09966
6405.0000 -65.46858 -62.07337 3.39521 2.23574 -61.98455 871.23182
6410.0000 -65.50644 -62.03117 3.47527 2.20374 -62.27955 841.25266
6415.0000 -65.07826 -62.34340 2.73486 2.18882 -62.41717 785.06083
6420.0000 -64.40180 -61.68408 2.71772 2.27099 -61.65945 925.15415
6425.0000 -64.17128 -61.01186 3.15942 2.30940 -61.30530 893.48055
6430.0000 -65.20705 -62.45092 2.75613 2.28677 -61.51399 902.08066
6435.0000 -65.03968 -61.92922 3.11046 2.19922 -62.32124 874.85481
6440.0000 -65.71974 -61.96082 3.75892 2.24646 -61.88564 798.71662
6445.0000 -64.68896 -61.66293 3.02603 2.21592 -62.16728 869.80787
6450.0000 -63.67307 -60.27685 3.39622 2.39843 -60.48434 971.81397
6455.0000 -63.09515 -60.38441 2.71074 2.34601 -60.96776 932.18449
6460.0000 -64.83740 -61.21258 3.62482 2.38198 -60.63602 1003.36028
6465.0000 -64.68731 -61.60461 3.08270 2.31373 -61.26535 935.15070
6470.0000 -63.45714 -60.36820 3.08895 2.33661 -61.05441 948.87788
6475.0000 -64.43402 -61.16576 3.26827 2.38087 -60.64633 959.88818
6480.0000 -64.42692 -61.17612 3.25080 2.31601 -61.24437 916.40818
6485.0000 -65.49958 -62.06319 3.43639 2.24368 -61.91132 834.80041
6490.0000 -65.19869 -62.32695 2.87174 2.23231 -62.01616 849.46746
6495.0000 -65.67473 -63.04927 2.62546 2.17569 -62.53822 782.44644
6500.0000 -64.55608 -61.76035 2.79573 2.18799 -62.42484 806.06396
MELTING PROCESS: loop number 27 T-loop= 934.00000000000000
main_MD> interactions number 27 at Temperature= 934.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.13542 -1.75435 -1.13602
force_rgl> df(natom) 1.44413 -3.34838 1.74980
6505.0000 -64.56235 -60.87030 3.69204 2.28419 -61.53777 882.59268
6510.0000 -64.72108 -61.18412 3.53696 2.34328 -60.99296 922.13716
6515.0000 -63.29873 -59.84354 3.45519 2.39908 -60.47843 1018.45668
6520.0000 -64.94195 -61.76533 3.17662 2.39543 -60.51201 1013.67187
6525.0000 -66.04799 -62.31085 3.73714 2.24619 -61.88821 876.18761
6530.0000 -65.53514 -62.14761 3.38753 2.24828 -61.86887 911.76834
6535.0000 -64.90103 -62.33869 2.56235 2.23734 -61.96979 856.77665
6540.0000 -64.31146 -60.55543 3.75603 2.37747 -60.67762 919.81923
6545.0000 -64.49281 -61.03319 3.45962 2.35492 -60.88559 988.72506
6550.0000 -64.73120 -61.25294 3.47827 2.27586 -61.61462 933.97290
6555.0000 -62.91018 -58.50156 4.40862 2.35217 -60.91092 963.75083
6560.0000 -64.34184 -61.27049 3.07135 2.41667 -60.31616 1008.71257
6565.0000 -64.98261 -62.37595 2.60666 2.24000 -61.94520 856.65781
6570.0000 -63.92825 -60.80090 3.12735 2.26486 -61.71601 876.28743
6575.0000 -63.58998 -61.08761 2.50237 2.33762 -61.04506 931.65304
6580.0000 -64.82929 -61.46732 3.36197 2.26822 -61.68506 891.00722
6585.0000 -65.32529 -62.27749 3.04780 2.22313 -62.10079 859.68379
6590.0000 -64.33760 -60.54121 3.79639 2.31181 -61.28308 926.22513
6595.0000 -65.17930 -60.70271 4.47659 2.38541 -60.60447 995.13245
6600.0000 -63.46774 -59.10714 4.36061 2.50184 -59.53081 1074.93115
6605.0000 -62.75493 -58.47151 4.28342 2.67853 -57.90158 1239.31281
6610.0000 -63.12564 -59.69170 3.43394 2.54736 -59.11109 1133.14891
6615.0000 -63.15664 -59.27605 3.88059 2.51071 -59.44905 1146.05970
6620.0000 -63.35727 -60.22532 3.13194 2.45816 -59.93366 1050.93111
6625.0000 -65.22411 -61.03275 4.19136 2.43372 -60.15900 1062.74785
6630.0000 -64.71545 -60.79033 3.92512 2.38330 -60.62392 965.91175
6635.0000 -65.27219 -62.50667 2.76552 2.29739 -61.41605 878.71745
6640.0000 -65.20737 -61.04977 4.15760 2.26932 -61.67486 868.30599
6645.0000 -65.10868 -61.40277 3.70592 2.36008 -60.83804 939.84776
6650.0000 -64.56827 -61.51629 3.05199 2.31218 -61.27964 953.79982
6655.0000 -64.35374 -60.98230 3.37144 2.30676 -61.32962 909.82048
6660.0000 -64.57375 -61.34177 3.23198 2.36273 -60.81353 967.24340
6665.0000 -62.92420 -59.88075 3.04345 2.36241 -60.81653 945.24637
6670.0000 -62.70169 -58.20171 4.49998 2.51043 -59.45162 1000.91853
6675.0000 -64.35162 -60.26424 4.08738 2.53947 -59.18389 1102.30939
6680.0000 -63.80353 -60.30067 3.50286 2.41705 -60.31265 1020.03717
6685.0000 -64.88282 -62.02499 2.85784 2.35198 -60.91268 961.62574
6690.0000 -64.81750 -61.88488 2.93261 2.28172 -61.56059 856.85651
6695.0000 -65.22400 -62.41943 2.80456 2.26402 -61.72374 864.90446
6700.0000 -64.47383 -61.81051 2.66332 2.21783 -62.14968 829.66718
6705.0000 -65.51977 -62.84090 2.67886 2.20967 -62.22493 836.94332
6710.0000 -63.65740 -60.92250 2.73491 2.26690 -61.69716 918.37834
6715.0000 -63.86671 -60.62304 3.24367 2.32770 -61.13660 906.47376
6720.0000 -64.70184 -60.59153 4.11030 2.39222 -60.54163 945.05442
6725.0000 -64.06710 -61.60709 2.46001 2.33289 -61.08876 932.74987
6730.0000 -64.34405 -61.22043 3.12362 2.30922 -61.30696 930.30499
6735.0000 -65.82816 -62.72186 3.10630 2.26075 -61.75387 907.39013
6740.0000 -66.07880 -62.83475 3.24405 2.16049 -62.67843 801.93542
6745.0000 -63.43707 -59.34852 4.08855 2.33548 -61.06485 939.35294
6750.0000 -63.27489 -60.50476 2.77012 2.48524 -59.68393 1015.08007
MELTING PROCESS: loop number 28 T-loop= 959.00000000000000
main_MD> interactions number 28 at Temperature= 959.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.85087 6.38278 1.95059
force_rgl> df(natom) 1.99784 -1.66339 -2.63301
6755.0000 -64.13409 -60.95223 3.18186 2.39855 -60.48328 939.84712
6760.0000 -62.36443 -58.86432 3.50012 2.45925 -59.92353 1050.80010
6765.0000 -64.39012 -60.79227 3.59786 2.48184 -59.71531 1061.07939
6770.0000 -64.26630 -60.57172 3.69458 2.41679 -60.31512 1030.14223
6775.0000 -63.88654 -60.77795 3.10859 2.38150 -60.64046 993.10440
6780.0000 -64.89638 -61.24724 3.64914 2.33856 -61.03639 954.39325
6785.0000 -64.45089 -61.23729 3.21360 2.36968 -60.74951 983.63256
6790.0000 -63.70524 -59.94183 3.76340 2.42067 -60.27929 1014.77949
6795.0000 -64.49718 -61.45535 3.04183 2.40263 -60.44565 1019.50198
6800.0000 -63.33303 -60.18468 3.14835 2.37196 -60.72846 938.51301
6805.0000 -64.94367 -61.40769 3.53598 2.35103 -60.92150 932.57121
6810.0000 -65.00735 -60.80438 4.20296 2.36828 -60.76235 957.91133
6815.0000 -64.19052 -61.74779 2.44273 2.31275 -61.27441 908.19896
6820.0000 -64.85826 -61.61261 3.24565 2.22508 -62.08283 849.21616
6825.0000 -64.72319 -61.32521 3.39798 2.27693 -61.60471 867.91059
6830.0000 -64.88900 -61.27151 3.61749 2.40982 -60.37936 1025.76649
6835.0000 -65.47154 -62.17900 3.29254 2.36075 -60.83178 943.71987
6840.0000 -64.93747 -60.91494 4.02253 2.30325 -61.36199 914.99300
6845.0000 -64.51365 -60.82001 3.69365 2.31894 -61.21732 902.67589
6850.0000 -64.55905 -61.85517 2.70388 2.33762 -61.04514 922.88645
6855.0000 -64.98398 -61.69243 3.29155 2.23838 -61.96018 875.72352
6860.0000 -64.08248 -60.47892 3.60357 2.39656 -60.50159 1011.98852
6865.0000 -63.84034 -60.37955 3.46080 2.36183 -60.82183 950.93267
6870.0000 -64.33458 -61.27960 3.05497 2.34373 -60.98876 908.51405
6875.0000 -65.07863 -61.88299 3.19564 2.25427 -61.81366 881.28341
6880.0000 -64.31277 -61.45028 2.86249 2.27210 -61.64927 850.69972
6885.0000 -65.13466 -60.54171 4.59295 2.29895 -61.40164 914.13970
6890.0000 -64.23808 -60.99975 3.23834 2.37439 -60.70605 999.35370
6895.0000 -63.31626 -59.89513 3.42113 2.43949 -60.10574 1037.50211
6900.0000 -64.06816 -60.58264 3.48551 2.49040 -59.63637 1050.95555
6905.0000 -64.28676 -61.00251 3.28425 2.33453 -61.07358 939.45420
6910.0000 -65.27219 -61.61281 3.65937 2.33862 -61.03586 965.54748
6915.0000 -64.43478 -60.93887 3.49590 2.23636 -61.97880 831.69482
6920.0000 -63.56602 -60.24264 3.32339 2.43676 -60.13092 1004.78949
6925.0000 -64.73125 -60.27217 4.45909 2.46717 -59.85050 1016.93793
6930.0000 -64.19171 -60.60688 3.58483 2.38052 -60.64955 950.09121
6935.0000 -63.91611 -59.39847 4.51763 2.41501 -60.33151 1019.75097
6940.0000 -64.17389 -61.69106 2.48282 2.38464 -60.61151 979.15327
6945.0000 -65.28196 -62.36782 2.91413 2.24652 -61.88514 840.01669
6950.0000 -64.60421 -61.22535 3.37886 2.30650 -61.33207 908.72684
6955.0000 -64.12210 -60.23299 3.88911 2.39308 -60.53372 988.49851
6960.0000 -63.61551 -60.59675 3.01876 2.38175 -60.63815 972.29586
6965.0000 -64.48997 -61.17017 3.31981 2.34054 -61.01818 911.51358
6970.0000 -64.62824 -60.90051 3.72773 2.32835 -61.13057 949.42535
6975.0000 -64.04404 -61.14985 2.89419 2.35203 -60.91223 875.31525
6980.0000 -64.05804 -60.82228 3.23575 2.45816 -59.93358 1050.12168
6985.0000 -64.51984 -60.63085 3.88900 2.40362 -60.43655 1049.02639
6990.0000 -64.73670 -61.38369 3.35301 2.34267 -60.99857 916.45876
6995.0000 -64.04648 -61.19882 2.84766 2.33196 -61.09730 926.97453
7000.0000 -64.43252 -60.90694 3.52558 2.38634 -60.59582 954.65788
MELTING PROCESS: loop number 29 T-loop= 984.00000000000000
main_MD> interactions number 29 at Temperature= 984.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.19862 0.86362 -0.65614
force_rgl> df(natom) -0.09678 -0.34875 -0.77207
7005.0000 -64.02947 -60.49045 3.53901 2.30936 -61.30566 934.73526
7010.0000 -63.63013 -59.11977 4.51036 2.46562 -59.86484 1070.08026
7015.0000 -63.22644 -58.83183 4.39461 2.63120 -58.33807 1212.19450
7020.0000 -63.49065 -58.64113 4.84952 2.52092 -59.35493 1094.13427
7025.0000 -63.48159 -60.28429 3.19730 2.53889 -59.18917 1106.41010
7030.0000 -64.42726 -59.91013 4.51713 2.46287 -59.89015 1102.54653
7035.0000 -63.57986 -60.75797 2.82189 2.36986 -60.74780 984.07151
7040.0000 -64.89829 -61.45821 3.44008 2.33333 -61.08469 882.44905
7045.0000 -63.68564 -59.29264 4.39300 2.39044 -60.55808 961.64855
7050.0000 -62.98307 -60.03433 2.94873 2.47859 -59.74526 1077.62435
7055.0000 -63.40122 -60.08277 3.31845 2.39276 -60.53668 996.09622
7060.0000 -63.59051 -60.08065 3.50986 2.39439 -60.52162 972.70539
7065.0000 -63.51525 -60.16658 3.34867 2.44656 -60.04062 1054.62978
7070.0000 -63.44385 -60.42601 3.01784 2.44384 -60.06565 1051.10241
7075.0000 -64.17271 -60.96572 3.20699 2.31893 -61.21741 911.60575
7080.0000 -64.25535 -60.62437 3.63098 2.33262 -61.09118 964.75192
7085.0000 -63.67804 -60.15214 3.52590 2.44394 -60.06470 1067.84857
7090.0000 -64.12196 -60.75146 3.37051 2.38571 -60.60167 972.56578
7095.0000 -64.61711 -60.29353 4.32358 2.38897 -60.57160 957.68089
7100.0000 -64.87440 -61.33709 3.53731 2.38100 -60.64508 984.18064
7105.0000 -65.11177 -61.39552 3.71625 2.28522 -61.52825 923.02334
7110.0000 -65.15462 -61.28425 3.87037 2.29396 -61.44768 889.12061
7115.0000 -64.85625 -60.94148 3.91477 2.25523 -61.80485 939.60929
7120.0000 -64.00581 -60.45567 3.55014 2.34213 -61.00355 978.66351
7125.0000 -61.53611 -56.66109 4.87501 2.58666 -58.74871 1082.05662
7130.0000 -63.76791 -60.40851 3.35941 2.60839 -58.54836 1181.41377
7135.0000 -63.02807 -58.94134 4.08674 2.52670 -59.30162 1089.39499
7140.0000 -63.30870 -59.70427 3.60442 2.48988 -59.64113 1018.63794
7145.0000 -64.47347 -60.75956 3.71392 2.44252 -60.07784 1038.89592
7150.0000 -62.79107 -58.91180 3.87927 2.47053 -59.81953 983.83881
7155.0000 -63.45515 -59.50437 3.95078 2.54806 -59.10468 1154.80481
7160.0000 -64.06881 -60.47880 3.59001 2.46327 -59.88654 1042.76824
7165.0000 -63.32001 -60.78545 2.53456 2.35969 -60.84159 907.19366
7170.0000 -63.79120 -60.49885 3.29235 2.36033 -60.83573 948.07195
7175.0000 -64.51790 -61.75546 2.76243 2.33493 -61.06992 939.56602
7180.0000 -64.34105 -60.34498 3.99607 2.35199 -60.91260 959.13857
7185.0000 -64.09900 -60.15098 3.94802 2.38435 -60.61423 1025.21549
7190.0000 -63.47054 -60.37486 3.09568 2.38644 -60.59495 1049.93284
7195.0000 -63.82984 -59.54075 4.28909 2.41457 -60.33559 979.39648
7200.0000 -64.88107 -60.96258 3.91849 2.50287 -59.52138 1171.12790
7205.0000 -64.56281 -60.41391 4.14889 2.41859 -60.29852 1027.49162
7210.0000 -64.69795 -59.93735 4.76060 2.45556 -59.95758 1071.02615
7215.0000 -63.68361 -59.54085 4.14277 2.45866 -59.92903 1092.48803
7220.0000 -64.54112 -61.33002 3.21110 2.44463 -60.05838 1040.84578
7225.0000 -65.47331 -61.61537 3.85795 2.34544 -60.97303 966.94418
7230.0000 -65.17747 -61.54141 3.63607 2.32353 -61.17502 987.73993
7235.0000 -63.83391 -60.90016 2.93375 2.28909 -61.49257 935.48095
7240.0000 -64.34333 -61.28886 3.05447 2.28732 -61.50892 854.35869
7245.0000 -64.39421 -61.72464 2.66957 2.35438 -60.89056 979.75708
7250.0000 -64.47782 -60.85429 3.62352 2.33935 -61.02913 933.42733
MELTING PROCESS: loop number 30 T-loop= 1009.0000000000000
main_MD> interactions number 30 at Temperature= 1009.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.09273 0.83353 -1.85689
force_rgl> df(natom) 3.90082 0.32030 -0.45411
7255.0000 -64.91998 -60.93686 3.98313 2.32099 -61.19848 900.27481
7260.0000 -64.60096 -62.22080 2.38017 2.27564 -61.61661 855.75292
7265.0000 -65.24252 -61.70660 3.53591 2.22622 -62.07228 889.62334
7270.0000 -64.64708 -60.72714 3.91993 2.34092 -61.01471 900.99247
7275.0000 -62.65034 -59.62657 3.02377 2.47364 -59.79091 1049.37869
7280.0000 -63.57785 -58.91756 4.66029 2.44886 -60.01940 975.82955
7285.0000 -63.43326 -60.60594 2.82731 2.54927 -59.09355 1098.51688
7290.0000 -64.94578 -61.58381 3.36197 2.33744 -61.04674 911.46172
7295.0000 -64.48823 -61.78072 2.70752 2.28486 -61.53163 862.29017
7300.0000 -65.69997 -62.25926 3.44071 2.28429 -61.53682 882.46256
7305.0000 -64.06390 -60.91699 3.14690 2.23096 -62.02862 859.49192
7310.0000 -65.55065 -61.94338 3.60727 2.31259 -61.27590 935.28306
7315.0000 -64.58639 -61.58018 3.00621 2.22440 -62.08905 848.37822
7320.0000 -63.61371 -60.16976 3.44396 2.30702 -61.32725 901.04588
7325.0000 -62.33420 -59.59352 2.74068 2.50353 -59.51523 1046.91083
7330.0000 -63.78976 -59.74378 4.04598 2.48392 -59.69607 1049.89359
7335.0000 -64.41856 -60.51884 3.89972 2.43704 -60.12833 967.75239
7340.0000 -63.54088 -59.62907 3.91181 2.42219 -60.26531 1033.77436
7345.0000 -63.93841 -61.22542 2.71299 2.41915 -60.29336 995.47416
7350.0000 -63.87237 -59.14200 4.73037 2.48363 -59.69879 1087.30140
7355.0000 -63.62742 -60.23486 3.39256 2.45095 -60.00006 1009.77051
7360.0000 -64.49074 -60.75329 3.73746 2.38533 -60.60517 988.89025
7365.0000 -64.69147 -60.76208 3.92939 2.35364 -60.89743 952.60474
7370.0000 -64.98385 -61.58790 3.39595 2.32146 -61.19409 960.60946
7375.0000 -64.73016 -61.53627 3.19388 2.21707 -62.15671 842.88583
7380.0000 -65.04528 -61.48699 3.55829 2.32774 -61.13618 936.25684
7385.0000 -63.25083 -60.04975 3.20108 2.42012 -60.28437 1024.07140
7390.0000 -63.56945 -60.65307 2.91638 2.35764 -60.86052 942.58123
7395.0000 -63.64781 -60.50331 3.14449 2.39184 -60.54515 989.78777
7400.0000 -64.71270 -60.91437 3.79833 2.39018 -60.56041 957.46383
7405.0000 -65.10173 -61.74586 3.35587 2.28397 -61.53980 915.08230
7410.0000 -65.31145 -61.51077 3.80068 2.24081 -61.93781 808.91214
7415.0000 -64.37585 -61.18053 3.19532 2.28712 -61.51075 846.23289
7420.0000 -63.92381 -60.82992 3.09388 2.34907 -60.93955 952.95268
7425.0000 -64.83287 -61.08712 3.74575 2.34269 -60.99839 950.00006
7430.0000 -61.71193 -58.01768 3.69425 2.47588 -59.77025 1028.54915
7435.0000 -62.83260 -58.35943 4.47317 2.63363 -58.31562 1126.17823
7440.0000 -63.62204 -60.03182 3.59022 2.57912 -58.81823 1127.05252
7445.0000 -63.40658 -60.59682 2.80976 2.38846 -60.57630 1012.78002
7450.0000 -63.09162 -60.03419 3.05743 2.43209 -60.17401 1020.70986
7455.0000 -64.16584 -59.71178 4.45406 2.41348 -60.34560 979.63686
7460.0000 -62.89096 -59.63336 3.25760 2.44443 -60.06021 1048.40925
7465.0000 -63.92577 -60.33778 3.58799 2.43543 -60.14320 1035.67897
7470.0000 -63.27865 -59.53166 3.74699 2.49794 -59.56678 1070.34344
7475.0000 -64.75823 -60.68146 4.07676 2.38106 -60.64454 970.68100
7480.0000 -63.21046 -59.49335 3.71711 2.40767 -60.39921 977.99657
7485.0000 -64.40183 -60.81241 3.58942 2.43571 -60.14063 1085.77205
7490.0000 -63.02208 -59.01283 4.00925 2.37480 -60.70228 960.02533
7495.0000 -64.31370 -60.42299 3.89072 2.48444 -59.69125 1054.60978
7500.0000 -64.36421 -59.87325 4.49096 2.45970 -59.91941 1063.10677
MELTING PROCESS: loop number 31 T-loop= 1034.0000000000000
main_MD> interactions number 31 at Temperature= 1034.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.40494 -6.53278 -0.63620
force_rgl> df(natom) -1.29546 0.63631 4.72749
7505.0000 -64.06586 -62.07573 1.99013 2.40159 -60.45526 1000.57072
7510.0000 -63.77740 -60.29583 3.48157 2.28355 -61.54367 845.85136
7515.0000 -64.14114 -59.39629 4.74485 2.41665 -60.31642 998.52713
7520.0000 -63.58568 -58.83590 4.74978 2.51562 -59.40383 1129.80900
7525.0000 -64.28536 -59.76217 4.52319 2.50774 -59.47643 1127.18952
7530.0000 -62.75404 -59.15165 3.60239 2.49395 -59.60364 1112.57681
7535.0000 -63.78908 -60.99848 2.79060 2.45081 -60.00141 1009.14459
7540.0000 -65.16076 -61.18107 3.97969 2.32287 -61.18107 870.86588
7545.0000 -63.94599 -59.66083 4.28517 2.37011 -60.74553 975.39994
7550.0000 -64.16729 -60.64885 3.51844 2.41593 -60.32302 1012.66525
7555.0000 -63.25373 -60.61670 2.63703 2.44049 -60.09655 1011.96606
7560.0000 -64.39730 -60.28276 4.11454 2.40705 -60.40490 1018.77940
7565.0000 -63.94522 -60.02854 3.91668 2.41931 -60.29184 998.48197
7570.0000 -63.33878 -59.58467 3.75411 2.48298 -59.70480 1080.17819
7575.0000 -63.18222 -59.04838 4.13385 2.49070 -59.63360 1098.32691
7580.0000 -63.03008 -60.43961 2.59048 2.45936 -59.92256 1060.82168
7585.0000 -63.26315 -58.52020 4.74295 2.49324 -59.61019 1041.52069
7590.0000 -62.71550 -58.81736 3.89814 2.58858 -58.73104 1151.73077
7595.0000 -62.85770 -58.80620 4.05151 2.61080 -58.52613 1198.00137
7600.0000 -64.82187 -61.20212 3.61975 2.48223 -59.71169 1071.37637
7605.0000 -63.99009 -61.34366 2.64642 2.27700 -61.60405 899.30535
7610.0000 -64.48945 -60.69337 3.79608 2.31878 -61.21887 932.09736
7615.0000 -63.75857 -60.75013 3.00844 2.37649 -60.68665 936.02234
7620.0000 -63.35053 -60.22777 3.12276 2.40564 -60.41787 960.25238
7625.0000 -62.48363 -58.84502 3.63861 2.46259 -59.89280 1016.55797
7630.0000 -64.54508 -61.03746 3.50762 2.45146 -59.99538 1012.66689
7635.0000 -64.20740 -60.12221 4.08519 2.42884 -60.20394 1027.36399
7640.0000 -63.80901 -60.20509 3.60392 2.39633 -60.50373 1011.49514
7645.0000 -62.97899 -59.84477 3.13422 2.48418 -59.69373 1052.97628
7650.0000 -63.88341 -61.20128 2.68214 2.43904 -60.10997 1046.81243
7655.0000 -64.55455 -60.81998 3.73457 2.35922 -60.84596 981.81231
7660.0000 -63.77152 -59.79735 3.97417 2.36701 -60.77411 948.90305
7665.0000 -64.57852 -60.57868 3.99983 2.37750 -60.67741 946.40370
7670.0000 -64.06532 -60.15486 3.91046 2.46213 -59.89705 1053.99803
7675.0000 -64.28282 -60.36593 3.91689 2.40805 -60.39564 998.99534
7680.0000 -65.22533 -61.15063 4.07470 2.44197 -60.08290 999.05277
7685.0000 -64.26204 -61.16397 3.09807 2.28360 -61.54318 929.33186
7690.0000 -62.58246 -59.11682 3.46564 2.39511 -60.51496 930.64916
7695.0000 -63.03559 -59.44044 3.59515 2.54862 -59.09953 1118.92496
7700.0000 -64.00393 -59.82774 4.17619 2.47972 -59.73480 1049.18757
7705.0000 -64.25340 -59.62396 4.62944 2.46028 -59.91408 1022.65958
7710.0000 -61.99636 -58.82782 3.16854 2.52258 -59.33963 1130.32569
7715.0000 -64.17117 -60.84345 3.32773 2.44259 -60.07714 1001.28010
7720.0000 -62.95983 -58.91006 4.04977 2.56061 -58.98896 1140.43633
7725.0000 -63.74700 -59.75845 3.98855 2.48238 -59.71026 1054.51926
7730.0000 -63.48312 -59.74172 3.74140 2.49984 -59.54932 1110.47815
7735.0000 -63.79996 -59.80030 3.99966 2.52615 -59.30666 1091.80713
7740.0000 -64.30541 -60.88314 3.42227 2.40379 -60.43498 996.93258
7745.0000 -64.72036 -60.56695 4.15341 2.34244 -61.00061 978.55157
7750.0000 -64.47940 -61.02023 3.45917 2.33691 -61.05168 961.99941
MELTING PROCESS: loop number 32 T-loop= 1059.0000000000000
main_MD> interactions number 32 at Temperature= 1059.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.48533 0.25880 -1.37178
force_rgl> df(natom) 0.87310 2.43763 3.41817
7755.0000 -64.59449 -60.92618 3.66830 2.37994 -60.65489 988.50163
7760.0000 -64.61679 -60.22592 4.39087 2.34784 -60.95090 988.02626
7765.0000 -63.96515 -59.40376 4.56139 2.48727 -59.66517 1104.43720
7770.0000 -63.75639 -59.46602 4.29036 2.49191 -59.62237 1105.99888
7775.0000 -62.50225 -58.64127 3.86097 2.57863 -58.82274 1110.72953
7780.0000 -64.14456 -59.84891 4.29565 2.53243 -59.24879 1121.66530
7785.0000 -64.38066 -60.41778 3.96287 2.42404 -60.24827 1087.89946
7790.0000 -64.85217 -61.00145 3.85072 2.42169 -60.26995 1079.45071
7795.0000 -64.38360 -61.21026 3.17334 2.40874 -60.38934 1035.34506
7800.0000 -62.93737 -58.50632 4.43106 2.51413 -59.41749 1139.86029
7805.0000 -62.12700 -58.38530 3.74170 2.58786 -58.73765 1123.10892
7810.0000 -62.97805 -59.54994 3.42811 2.56845 -58.91667 1069.22748
7815.0000 -63.93639 -59.79437 4.14202 2.49492 -59.59462 1030.72131
7820.0000 -62.96796 -59.07190 3.89607 2.57262 -58.87817 1176.92845
7825.0000 -63.02849 -59.15408 3.87441 2.51854 -59.37684 1111.33071
7830.0000 -62.65819 -58.56222 4.09598 2.51910 -59.37173 1096.53524
7835.0000 -62.35101 -58.01355 4.33746 2.70688 -57.64020 1289.41199
7840.0000 -62.68368 -58.68346 4.00022 2.59893 -58.63562 1142.93079
7845.0000 -63.59304 -59.31517 4.27787 2.51951 -59.36788 1106.08530
7850.0000 -64.21506 -60.62189 3.59317 2.45460 -59.96644 1114.07249
7855.0000 -64.81035 -60.65244 4.15791 2.36733 -60.77117 977.20391
7860.0000 -64.51924 -60.27132 4.24793 2.42376 -60.25086 1036.40010
7865.0000 -64.21422 -60.71110 3.50312 2.40199 -60.45157 979.40136
7870.0000 -64.23908 -60.59327 3.64581 2.41276 -60.35229 1020.93160
7875.0000 -63.83437 -58.89951 4.93486 2.42767 -60.21473 1065.72582
7880.0000 -63.00321 -59.26177 3.74144 2.63008 -58.34838 1183.55138
7885.0000 -63.95566 -59.42820 4.52746 2.54441 -59.13832 1143.42121
7890.0000 -62.96000 -58.58850 4.37150 2.53678 -59.20870 1130.76651
7895.0000 -63.70759 -59.90126 3.80633 2.53649 -59.21139 1151.61221
7900.0000 -62.37208 -58.24037 4.13172 2.62242 -58.41900 1189.72165
7905.0000 -63.18105 -59.31759 3.86346 2.55463 -59.04412 1143.42235
7910.0000 -63.50876 -59.77795 3.73081 2.54013 -59.17775 1100.75232
7915.0000 -64.08083 -60.01559 4.06524 2.41091 -60.36933 1029.32334
7920.0000 -63.81779 -60.18354 3.63426 2.53578 -59.21786 1102.61637
7925.0000 -64.55310 -61.35979 3.19331 2.33250 -61.09232 971.74034
7930.0000 -63.32994 -59.96107 3.36887 2.41155 -60.36338 1025.07863
7935.0000 -63.57994 -60.23793 3.34201 2.44064 -60.09517 1035.91388
7940.0000 -64.04301 -61.21423 2.82878 2.42231 -60.26421 1009.64185
7945.0000 -64.42470 -60.37969 4.04501 2.39852 -60.48360 964.13801
7950.0000 -63.43585 -60.21559 3.22027 2.38441 -60.61364 992.86699
7955.0000 -63.31207 -59.40017 3.91190 2.45101 -59.99957 1023.98285
7960.0000 -63.25840 -59.20850 4.04990 2.48008 -59.73152 1055.04540
7965.0000 -63.99767 -60.23816 3.75951 2.55377 -59.05199 1181.72011
7970.0000 -64.36896 -60.96740 3.40156 2.42030 -60.28274 960.93256
7975.0000 -64.23975 -60.09426 4.14549 2.35273 -60.90582 968.14876
7980.0000 -64.20661 -59.47427 4.73233 2.46889 -59.83468 1045.25230
7985.0000 -63.76079 -59.75144 4.00935 2.46453 -59.87486 1038.01407
7990.0000 -64.40036 -61.08420 3.31616 2.38248 -60.63147 998.00084
7995.0000 -64.81485 -61.31665 3.49819 2.36964 -60.74989 956.71383
8000.0000 -61.95206 -57.72574 4.22632 2.38706 -60.58925 979.06067
MELTING PROCESS: loop number 33 T-loop= 1084.0000000000000
main_MD> interactions number 33 at Temperature= 1084.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.49495 -2.40191 -6.15137
force_rgl> df(natom) 1.44670 1.68336 -3.17489
8005.0000 -62.33137 -58.99287 3.33850 2.62112 -58.43097 1181.25393
8010.0000 -63.74805 -60.80720 2.94084 2.48658 -59.67157 1010.89636
8015.0000 -62.70479 -59.05484 3.64995 2.50290 -59.52108 1113.25396
8020.0000 -63.57618 -59.86327 3.71291 2.47482 -59.78004 1069.58751
8025.0000 -63.01954 -59.20786 3.81168 2.55969 -58.99739 1134.76325
8030.0000 -62.99296 -59.15975 3.83321 2.56013 -58.99341 1168.40976
8035.0000 -62.75129 -59.90286 2.84844 2.47987 -59.73347 1052.02074
8040.0000 -63.75899 -61.26141 2.49758 2.46392 -59.88051 1036.85549
8045.0000 -64.44825 -61.12888 3.31937 2.32286 -61.18118 915.92858
8050.0000 -63.84101 -59.81901 4.02200 2.39462 -60.51948 1030.31305
8055.0000 -64.00762 -60.04352 3.96409 2.51275 -59.43023 1133.68895
8060.0000 -62.76843 -59.50250 3.26593 2.46374 -59.88221 1068.57262
8065.0000 -64.97337 -60.94444 4.02893 2.43934 -60.10719 1012.14368
8070.0000 -64.30090 -60.38927 3.91162 2.42691 -60.22173 1002.36301
8075.0000 -64.34691 -61.06787 3.27903 2.38088 -60.64622 969.65039
8080.0000 -64.01805 -60.55912 3.45893 2.33714 -61.04949 921.67612
8085.0000 -63.83027 -60.40169 3.42858 2.48913 -59.64808 1111.25889
8090.0000 -63.40461 -59.69174 3.71287 2.43776 -60.12173 1099.04771
8095.0000 -63.27736 -59.30891 3.96845 2.47435 -59.78433 1047.32394
8100.0000 -63.98381 -59.59800 4.38581 2.50600 -59.49249 1091.77195
8105.0000 -63.66794 -59.76334 3.90460 2.50382 -59.51258 1074.37984
8110.0000 -63.65627 -59.86648 3.78979 2.44652 -60.04094 1015.34160
8115.0000 -64.24874 -60.17675 4.07199 2.50262 -59.52366 1048.74470
8120.0000 -64.72647 -60.67797 4.04850 2.41501 -60.33154 1039.88582
8125.0000 -64.06198 -59.43578 4.62621 2.35743 -60.86247 976.07293
8130.0000 -63.93502 -59.40685 4.52817 2.55684 -59.02375 1145.20195
8135.0000 -62.67926 -58.46006 4.21920 2.57487 -58.85744 1180.19051
8140.0000 -62.46834 -57.43091 5.03744 2.68007 -57.88742 1260.02989
8145.0000 -62.09862 -58.46392 3.63470 2.64906 -58.17335 1255.49791
8150.0000 -63.28131 -59.77656 3.50474 2.56337 -58.96348 1096.34467
8155.0000 -62.74630 -58.53933 4.20697 2.54177 -59.16268 1123.83639
8160.0000 -62.40488 -58.92684 3.47804 2.60411 -58.58780 1180.19420
8165.0000 -61.53724 -57.04950 4.48773 2.68997 -57.79617 1237.65604
8170.0000 -61.34626 -56.55499 4.79128 2.74954 -57.24688 1318.06295
8175.0000 -62.78215 -58.44593 4.33623 2.67937 -57.89384 1251.84454
8180.0000 -63.00904 -58.82707 4.18197 2.53004 -59.27078 1146.57597
8185.0000 -63.65332 -59.92245 3.73087 2.43598 -60.13818 1021.92033
8190.0000 -62.42864 -58.66857 3.76008 2.53768 -59.20037 1068.70395
8195.0000 -63.47200 -59.37641 4.09559 2.50459 -59.50549 1090.17811
8200.0000 -63.93184 -60.01956 3.91228 2.44989 -60.00988 1030.33388
8205.0000 -62.73998 -59.07114 3.66884 2.58509 -58.76324 1179.88881
8210.0000 -62.96628 -58.59177 4.37451 2.56542 -58.94456 1170.68728
8215.0000 -62.76449 -59.10949 3.65500 2.64270 -58.23199 1195.52113
8220.0000 -63.58640 -58.75216 4.83424 2.51061 -59.44994 1108.97237
8225.0000 -64.90054 -60.55044 4.35010 2.47052 -59.81966 1106.18816
8230.0000 -62.01430 -57.61886 4.39545 2.60304 -58.59766 1244.77866
8235.0000 -63.36648 -58.17027 5.19621 2.63053 -58.34418 1129.91420
8240.0000 -62.82979 -58.55674 4.27305 2.60277 -58.60017 1202.34074
8245.0000 -63.55716 -58.71896 4.83820 2.60724 -58.55896 1213.43641
8250.0000 -64.59099 -60.87250 3.71850 2.50404 -59.51053 1075.08961
MELTING PROCESS: loop number 34 T-loop= 1109.0000000000000
main_MD> interactions number 34 at Temperature= 1109.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.35359 2.51938 0.38173
force_rgl> df(natom) 0.34938 -2.43268 0.79096
8255.0000 -64.23661 -61.46350 2.77311 2.28192 -61.55866 867.81084
8260.0000 -65.09013 -61.70852 3.38161 2.23813 -61.96244 861.72698
8265.0000 -63.72602 -59.73533 3.99069 2.35352 -60.89845 983.95674
8270.0000 -63.17441 -59.20029 3.97411 2.44162 -60.08614 1074.03643
8275.0000 -64.62119 -60.33975 4.28143 2.44319 -60.07168 1068.52894
8280.0000 -63.87155 -59.99605 3.87550 2.42966 -60.19641 1030.25988
8285.0000 -64.09419 -60.30153 3.79266 2.45003 -60.00857 1075.45235
8290.0000 -64.85414 -60.87874 3.97541 2.42630 -60.22737 1022.07879
8295.0000 -64.18672 -60.51208 3.67464 2.37196 -60.72848 966.95379
8300.0000 -63.79833 -59.01796 4.78036 2.46366 -59.88293 1070.88719
8305.0000 -63.96368 -59.84175 4.12193 2.46147 -59.90310 1054.88839
8310.0000 -63.58341 -59.93567 3.64774 2.46230 -59.89540 1108.44304
8315.0000 -62.21718 -58.23723 3.97994 2.65685 -58.10149 1238.00301
8320.0000 -62.45517 -57.89199 4.56319 2.73659 -57.36628 1355.19631
8325.0000 -61.95107 -57.45476 4.49631 2.71033 -57.60841 1316.49337
8330.0000 -62.69340 -58.81650 3.87690 2.63332 -58.31846 1182.61574
8335.0000 -63.40317 -58.78676 4.61642 2.57646 -58.84282 1160.59155
8340.0000 -62.96494 -59.81525 3.14969 2.52437 -59.32312 1149.85959
8345.0000 -64.05855 -60.75384 3.30471 2.44640 -60.04202 1036.80127
8350.0000 -63.63366 -60.43779 3.19587 2.42633 -60.22709 1019.94848
8355.0000 -63.43327 -59.82687 3.60640 2.50197 -59.52965 1066.65997
8360.0000 -62.39274 -58.05036 4.34237 2.51561 -59.40385 1037.81676
8365.0000 -62.33723 -59.30296 3.03427 2.55276 -59.06129 1078.85881
8370.0000 -62.10347 -58.29256 3.81091 2.52388 -59.32766 1047.75640
8375.0000 -63.40561 -59.92406 3.48155 2.55191 -59.06915 1066.46190
8380.0000 -61.41040 -58.50622 2.90418 2.55568 -59.03441 1142.46887
8385.0000 -63.83010 -59.73389 4.09621 2.58483 -58.76558 1118.75641
8390.0000 -63.84044 -59.29892 4.54152 2.55173 -59.07087 1175.86762
8395.0000 -63.91128 -59.34640 4.56488 2.50093 -59.53925 1016.64401
8400.0000 -63.44094 -59.67006 3.77088 2.54922 -59.09392 1118.92706
8405.0000 -64.37694 -60.04293 4.33401 2.44048 -60.09665 1014.89456
8410.0000 -63.79253 -60.37856 3.41397 2.41860 -60.29835 1024.80493
8415.0000 -64.92309 -60.90075 4.02233 2.37804 -60.67240 1007.18756
8420.0000 -64.47949 -59.86497 4.61452 2.39911 -60.47809 997.78390
8425.0000 -63.11234 -59.92801 3.18433 2.44864 -60.02144 1072.89111
8430.0000 -63.66589 -59.76580 3.90009 2.59204 -58.69917 1109.86193
8435.0000 -63.84510 -60.29612 3.54898 2.46993 -59.82506 1053.12192
8440.0000 -64.97431 -60.94350 4.03081 2.38924 -60.56914 1025.42272
8445.0000 -63.92091 -60.64199 3.27892 2.37234 -60.72491 1003.24077
8450.0000 -64.40607 -61.73849 2.66758 2.34826 -60.94700 960.25373
8455.0000 -63.31075 -59.18877 4.12199 2.36950 -60.75114 942.81552
8460.0000 -64.16532 -59.79683 4.36849 2.44984 -60.01035 1066.97504
8465.0000 -63.40056 -60.44978 2.95078 2.42015 -60.28413 993.95605
8470.0000 -64.50225 -60.16682 4.33543 2.44911 -60.01710 1040.08936
8475.0000 -63.22916 -58.59958 4.62958 2.57347 -58.87039 1131.55291
8480.0000 -63.37743 -58.57534 4.80209 2.56236 -58.97276 1149.57034
8485.0000 -62.30755 -58.69484 3.61271 2.63379 -58.31411 1202.52999
8490.0000 -61.39917 -57.75189 3.64728 2.53027 -59.26869 1113.91773
8495.0000 -63.41338 -57.68269 5.73069 2.74221 -57.31445 1319.21653
8500.0000 -63.10546 -58.54314 4.56232 2.53371 -59.23696 1190.59442
MELTING PROCESS: loop number 35 T-loop= 1134.0000000000000
main_MD> interactions number 35 at Temperature= 1134.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.00942 1.79681 3.94162
force_rgl> df(natom) -3.90754 -0.08022 0.86581
8505.0000 -63.99070 -59.86924 4.12146 2.51641 -59.39651 1120.72969
8510.0000 -62.00835 -58.44429 3.56406 2.49781 -59.56803 1091.22086
8515.0000 -62.46514 -58.24227 4.22287 2.59070 -58.71153 1183.66311
8520.0000 -62.63959 -58.76868 3.87091 2.56474 -58.95086 1157.03756
8525.0000 -62.68976 -58.25847 4.43129 2.62602 -58.38579 1220.77712
8530.0000 -64.11887 -59.20752 4.91134 2.58104 -58.80060 1109.95636
8535.0000 -63.62860 -59.76221 3.86639 2.49901 -59.55699 1068.99471
8540.0000 -63.35571 -57.78876 5.56695 2.54695 -59.11487 1079.76591
8545.0000 -64.10836 -58.89831 5.21004 2.60781 -58.55374 1171.72790
8550.0000 -63.86000 -59.54328 4.31672 2.47733 -59.75689 1040.25720
8555.0000 -62.43210 -58.86102 3.57109 2.54413 -59.14095 1094.77761
8560.0000 -63.56599 -59.44249 4.12351 2.57339 -58.87113 1128.00827
8565.0000 -61.55294 -58.13129 3.42165 2.56608 -58.93854 1143.49232
8570.0000 -63.37445 -59.11916 4.25528 2.63439 -58.30862 1205.64811
8575.0000 -63.35740 -58.31845 5.03895 2.55487 -59.04187 1138.89839
8580.0000 -63.57430 -58.97969 4.59461 2.52795 -59.29012 1145.39140
8585.0000 -63.39960 -59.52810 3.87150 2.62744 -58.37268 1210.84957
8590.0000 -63.81513 -59.64725 4.16788 2.46766 -59.84604 1087.19278
8595.0000 -62.54111 -58.69844 3.84267 2.56024 -58.99237 1172.27266
8600.0000 -63.38062 -59.70673 3.67389 2.55972 -58.99714 1114.31722
8605.0000 -62.88000 -58.37825 4.50175 2.47075 -59.81751 1051.58485
8610.0000 -63.62793 -59.06636 4.56158 2.58250 -58.78714 1198.02490
8615.0000 -64.21548 -59.46078 4.75470 2.55012 -59.08567 1177.74389
8620.0000 -64.28128 -59.88627 4.39501 2.49225 -59.61926 1096.70770
8625.0000 -63.52377 -60.16898 3.35479 2.46987 -59.82560 1133.52151
8630.0000 -65.33896 -61.25157 4.08739 2.32985 -61.11671 974.66847
8635.0000 -62.88017 -58.21030 4.66987 2.48329 -59.70192 1072.48247
8640.0000 -63.31893 -59.40007 3.91886 2.55027 -59.08426 1132.83777
8645.0000 -63.83017 -60.09664 3.73353 2.45968 -59.91959 1046.98622
8650.0000 -64.04912 -60.15030 3.89882 2.43805 -60.11903 1007.55887
8655.0000 -63.13686 -60.36118 2.77568 2.45637 -59.95010 1062.51872
8660.0000 -63.84067 -59.53915 4.30152 2.48832 -59.65553 1098.27796
8665.0000 -62.27419 -58.16076 4.11343 2.62911 -58.35735 1195.90783
8670.0000 -62.73186 -59.07556 3.65629 2.55868 -59.00678 1166.83742
8675.0000 -62.31262 -57.33443 4.97819 2.69764 -57.72539 1214.22785
8680.0000 -63.78249 -59.70259 4.07991 2.59033 -58.71489 1210.72929
8685.0000 -62.74605 -58.80153 3.94452 2.46941 -59.82991 1032.01472
8690.0000 -64.41295 -61.16044 3.25251 2.44027 -60.09856 1045.56730
8695.0000 -63.16335 -59.84317 3.32018 2.37439 -60.70602 997.80825
8700.0000 -63.08689 -59.33946 3.74743 2.46757 -59.84685 1022.13997
8705.0000 -63.53380 -59.93187 3.60193 2.53104 -59.26157 1127.22769
8710.0000 -63.23442 -60.06136 3.17307 2.43584 -60.13945 994.96227
8715.0000 -63.99947 -59.33457 4.66490 2.51986 -59.36471 1167.88607
8720.0000 -64.28844 -59.95902 4.32942 2.51777 -59.38393 1067.92832
8725.0000 -64.15446 -60.70570 3.44876 2.44276 -60.07566 1010.30643
8730.0000 -64.44296 -61.29004 3.15292 2.31579 -61.24643 879.19532
8735.0000 -63.82199 -60.49959 3.32239 2.38146 -60.64083 965.52049
8740.0000 -64.32426 -60.47740 3.84686 2.39729 -60.49492 941.45925
8745.0000 -62.75385 -59.52481 3.22904 2.50642 -59.48862 1043.90487
8750.0000 -63.07434 -59.25582 3.81852 2.46516 -59.86904 1106.36296
MELTING PROCESS: loop number 36 T-loop= 1159.0000000000000
main_MD> interactions number 36 at Temperature= 1159.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.94278 1.30076 1.63001
force_rgl> df(natom) 3.02187 -3.38828 -1.95154
8755.0000 -64.00872 -60.09860 3.91013 2.44509 -60.05412 1019.18445
8760.0000 -64.56426 -60.03411 4.53015 2.46366 -59.88293 1144.64016
8765.0000 -64.23336 -59.51214 4.72123 2.46443 -59.87579 1064.43057
8770.0000 -61.59481 -58.01908 3.57573 2.54824 -59.10297 1120.81266
8775.0000 -63.40298 -59.32829 4.07469 2.56832 -58.91784 1130.50523
8780.0000 -63.60680 -59.50627 4.10053 2.52697 -59.29911 1141.16380
8785.0000 -63.53993 -60.45751 3.08242 2.51128 -59.44384 1058.65757
8790.0000 -64.35292 -60.15800 4.19492 2.47915 -59.74007 1065.29778
8795.0000 -62.70704 -59.05683 3.65021 2.51704 -59.39069 1100.90195
8800.0000 -63.85489 -60.04115 3.81374 2.48423 -59.69320 1081.46081
8805.0000 -64.80702 -60.07812 4.72890 2.43567 -60.14104 1034.35697
8810.0000 -63.03511 -59.14908 3.88603 2.47861 -59.74505 1102.89388
8815.0000 -63.73917 -59.63532 4.10385 2.59714 -58.65212 1152.88752
8820.0000 -61.03888 -56.06008 4.97880 2.69673 -57.73378 1240.72650
8825.0000 -62.37199 -58.00690 4.36509 2.81740 -56.62108 1415.62139
8830.0000 -61.80655 -56.64229 5.16427 2.67440 -57.93972 1263.43457
8835.0000 -62.88295 -58.63742 4.24554 2.68896 -57.80546 1243.18510
8840.0000 -63.23544 -59.35034 3.88509 2.64708 -58.19161 1195.45049
8845.0000 -62.49834 -58.34298 4.15536 2.55227 -59.06588 1131.78034
8850.0000 -63.84058 -60.09993 3.74065 2.61480 -58.48930 1283.48703
8855.0000 -63.41518 -59.50015 3.91503 2.48304 -59.70419 1076.78606
8860.0000 -63.50800 -59.72467 3.78333 2.49828 -59.56364 1048.56645
8865.0000 -64.74450 -60.47802 4.26648 2.44274 -60.07580 1087.07916
8870.0000 -63.98082 -59.14863 4.83219 2.52267 -59.33881 1129.20095
8875.0000 -62.86553 -57.78677 5.07877 2.60193 -58.60793 1251.09889
8880.0000 -63.72055 -58.60602 5.11453 2.58051 -58.80545 1180.85900
8885.0000 -62.38304 -58.73555 3.64748 2.55730 -59.01944 1127.87750
8890.0000 -63.38662 -59.02962 4.35700 2.58375 -58.77553 1134.34861
8895.0000 -64.22041 -60.34327 3.87714 2.50985 -59.45697 1170.55559
8900.0000 -63.62007 -59.33729 4.28278 2.48959 -59.64385 1105.34820
8905.0000 -63.74454 -59.46772 4.27682 2.54656 -59.11845 1127.39002
8910.0000 -63.58303 -60.32296 3.26008 2.44486 -60.05622 1049.63030
8915.0000 -64.47385 -60.59158 3.88227 2.37044 -60.74248 986.63439
8920.0000 -64.94065 -61.85485 3.08580 2.30556 -61.34076 841.02966
8925.0000 -63.51665 -59.43536 4.08130 2.41331 -60.34714 980.90781
8930.0000 -63.17903 -59.44955 3.72947 2.49381 -59.60490 1070.64266
8935.0000 -64.11838 -60.10025 4.01813 2.48890 -59.65021 1090.12506
8940.0000 -63.89322 -59.68873 4.20449 2.49256 -59.61646 1075.34436
8945.0000 -62.54719 -57.13126 5.41593 2.61697 -58.46922 1177.34492
8950.0000 -60.90419 -55.57765 5.32654 2.82693 -56.53325 1427.48655
8955.0000 -63.18606 -58.26453 4.92153 2.75182 -57.22586 1360.45602
8960.0000 -63.52325 -58.65984 4.86341 2.54115 -59.16840 1143.90079
8965.0000 -63.45473 -60.34583 3.10890 2.49804 -59.56585 1086.54119
8970.0000 -64.86196 -61.88866 2.97330 2.26515 -61.71337 862.37857
8975.0000 -63.58684 -59.26550 4.32134 2.36523 -60.79051 986.40897
8980.0000 -62.52196 -58.25381 4.26815 2.54670 -59.11725 1183.24971
8985.0000 -63.74924 -59.42563 4.32361 2.53376 -59.23653 1062.08500
8990.0000 -62.89552 -57.54110 5.35442 2.61849 -58.45527 1153.84568
8995.0000 -61.29482 -57.08289 4.21193 2.69466 -57.75288 1270.56572
9000.0000 -63.93131 -58.80296 5.12835 2.63014 -58.34785 1200.90830
MELTING PROCESS: loop number 37 T-loop= 1184.0000000000000
main_MD> interactions number 37 at Temperature= 1184.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.78487 -3.98941 -1.42879
force_rgl> df(natom) -1.59852 -0.42833 -1.06282
9005.0000 -62.83171 -59.07838 3.75333 2.50712 -59.48215 1091.77388
9010.0000 -63.82060 -59.84573 3.97487 2.49317 -59.61080 1070.85182
9015.0000 -64.20426 -60.66213 3.54212 2.48973 -59.64255 1083.26695
9020.0000 -64.60808 -60.27339 4.33469 2.35089 -60.92277 964.94951
9025.0000 -63.58960 -59.74416 3.84543 2.40057 -60.46461 992.30634
9030.0000 -64.68361 -59.52637 5.15724 2.47180 -59.80789 1063.41869
9035.0000 -62.02032 -58.28415 3.73618 2.50527 -59.49926 1079.99193
9040.0000 -63.21017 -58.83718 4.37298 2.56021 -58.99265 1146.59108
9045.0000 -62.44105 -57.82458 4.61647 2.71015 -57.61004 1271.44140
9050.0000 -63.55649 -58.34644 5.21005 2.61021 -58.53155 1204.54244
9055.0000 -62.66317 -58.35505 4.30812 2.69980 -57.70548 1258.79259
9060.0000 -62.77496 -57.91803 4.85693 2.70812 -57.62873 1280.51366
9065.0000 -62.73305 -58.41627 4.31679 2.71183 -57.59459 1291.02317
9070.0000 -63.07902 -58.67957 4.39945 2.53709 -59.20577 1057.02488
9075.0000 -61.18635 -57.40461 3.78173 2.64625 -58.19925 1202.99019
9080.0000 -62.84262 -57.09663 5.74599 2.74963 -57.24601 1270.83864
9085.0000 -62.31967 -58.58050 3.73917 2.70999 -57.61153 1285.62494
9090.0000 -63.13790 -57.64114 5.49676 2.67615 -57.92358 1263.15613
9095.0000 -63.21047 -59.44394 3.76652 2.58171 -58.79434 1204.34965
9100.0000 -64.12045 -59.14284 4.97762 2.64331 -58.22637 1293.00042
9105.0000 -63.49344 -60.16860 3.32484 2.58943 -58.72318 1180.50039
9110.0000 -61.52893 -57.88581 3.64313 2.47139 -59.81162 993.90274
9115.0000 -62.89667 -56.97892 5.91775 2.66916 -57.98798 1143.89233
9120.0000 -61.47713 -56.39995 5.07718 2.74189 -57.31737 1254.47538
9125.0000 -62.56495 -58.24479 4.32016 2.69804 -57.72168 1251.87302
9130.0000 -62.79293 -58.62947 4.16346 2.63083 -58.34143 1277.10123
9135.0000 -62.80273 -58.39778 4.40495 2.54831 -59.10232 1203.89262
9140.0000 -63.66397 -58.66784 4.99614 2.65374 -58.13021 1201.59752
9145.0000 -64.36900 -59.41734 4.95165 2.59623 -58.66048 1153.35447
9150.0000 -63.66553 -59.72262 3.94291 2.49985 -59.54921 1083.76125
9155.0000 -63.41673 -58.99924 4.41749 2.56680 -58.93187 1110.85926
9160.0000 -63.41660 -58.88306 4.53354 2.52600 -59.30811 1096.32943
9165.0000 -63.46088 -59.60919 3.85170 2.54484 -59.13434 1114.77708
9170.0000 -62.10258 -57.92429 4.17828 2.58341 -58.77868 1201.28761
9175.0000 -61.39536 -56.80852 4.58684 2.74080 -57.32743 1308.44011
9180.0000 -62.23533 -58.48370 3.75163 2.71628 -57.55354 1198.02020
9185.0000 -62.78619 -58.06762 4.71857 2.60967 -58.53660 1144.41413
9190.0000 -61.52827 -57.37223 4.15605 2.66344 -58.04073 1227.85058
9195.0000 -61.99495 -56.41365 5.58130 2.80908 -56.69787 1387.97332
9200.0000 -61.34923 -57.07312 4.27612 2.82703 -56.53233 1358.42121
9205.0000 -61.88708 -56.30163 5.58545 2.83583 -56.45117 1406.28846
9210.0000 -61.61541 -58.10665 3.50876 2.72124 -57.50776 1305.22058
9215.0000 -62.28804 -58.54346 3.74458 2.66935 -57.98628 1194.31859
9220.0000 -63.61838 -58.54448 5.07390 2.56077 -58.98743 1153.73088
9225.0000 -64.16625 -59.49720 4.66905 2.62372 -58.40697 1224.60281
9230.0000 -62.78768 -58.67027 4.11740 2.62574 -58.38836 1228.26466
9235.0000 -62.15151 -57.09281 5.05870 2.62905 -58.35789 1190.01880
9240.0000 -61.99212 -58.13895 3.85317 2.73800 -57.35328 1363.12832
9245.0000 -63.63032 -59.35418 4.27614 2.63573 -58.29627 1236.81247
9250.0000 -63.14711 -59.21977 3.92734 2.52286 -59.33702 1060.39036
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 5 [min], 26.3767608 [s].
main_MD> Deallocating global variables
Reference in New Issue View Git Blame Copy Permalink