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nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_94/melt.log

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main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_94.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 = 94 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 94 9400
main_MD> Size of nv and nvoiz: 94 9400
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 = 94
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> 4.2675636515163262E-002 -1.8316426822488643E-002 6.3955241261786519E-002 initial drift of cluster / NP1 for coalescence
init> 0.30113198501092009 0.31754086143692350 0.29768437540532339 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.7933485869970781E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.11702 2.19778 -0.32289
force_rgl> df(natom) -0.18946 1.65780 0.80558
preparo> THERMALIZATION PROCESS AT 278.44599813738427
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -239.71964073609129 3.4191841359067405 -243.13882487199803 3.8178112292922201E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
MELTING PROCESS: loop number 1 T-loop= 304.00000000000000
main_MD> interactions number 1 at Temperature= 304.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.34951 1.05553 0.98766
force_rgl> df(natom) 0.89773 1.39206 0.72811
5.0000 -243.54779 -239.64402 3.90377 1.81344 -239.80945 302.03373
10.0000 -243.62778 -239.55454 4.07325 1.80914 -239.89825 299.32915
15.0000 -243.67934 -239.89107 3.78827 1.81995 -239.67487 308.01636
20.0000 -243.59153 -239.39557 4.19596 1.83089 -239.44865 315.78110
25.0000 -242.67807 -238.65271 4.02536 1.86562 -238.73078 341.32029
30.0000 -243.72110 -239.75006 3.97104 1.84484 -239.16027 328.69910
35.0000 -243.35151 -239.62396 3.72755 1.81789 -239.71738 306.77840
40.0000 -243.28901 -239.80376 3.48526 1.81790 -239.71729 307.96784
45.0000 -243.46670 -239.92605 3.54065 1.80446 -239.99520 295.79992
50.0000 -242.92903 -238.99021 3.93883 1.83976 -239.26525 321.71828
55.0000 -243.35820 -239.24099 4.11721 1.83574 -239.34849 319.11552
60.0000 -242.80441 -239.62179 3.18262 1.83085 -239.44953 318.51497
65.0000 -243.30439 -239.41514 3.88925 1.82236 -239.62508 313.93877
70.0000 -243.30188 -239.86097 3.44091 1.81633 -239.74977 307.76390
75.0000 -243.18994 -239.71576 3.47419 1.81954 -239.68330 311.77584
80.0000 -243.52305 -240.02193 3.50112 1.81857 -239.70331 309.62659
85.0000 -243.63443 -240.06110 3.57333 1.82296 -239.61259 310.19740
90.0000 -243.93276 -239.81228 4.12048 1.80243 -240.03715 295.09478
95.0000 -244.03458 -240.74063 3.29395 1.80288 -240.02780 293.25453
100.0000 -243.09965 -239.63928 3.46036 1.80969 -239.88692 302.74160
105.0000 -242.96096 -239.46315 3.49781 1.83995 -239.26144 327.32131
110.0000 -244.23929 -240.20781 4.03149 1.81500 -239.77730 305.46546
115.0000 -243.70536 -240.19336 3.51200 1.80443 -239.99574 295.31679
120.0000 -243.59833 -240.26333 3.33500 1.78223 -240.45471 277.27979
125.0000 -243.87054 -240.39814 3.47240 1.79474 -240.19601 288.05552
130.0000 -243.21122 -240.20464 3.00658 1.78027 -240.49520 278.86678
135.0000 -243.60462 -239.98990 3.61472 1.82952 -239.47702 317.69365
140.0000 -243.33218 -239.41183 3.92035 1.81332 -239.81193 304.07643
145.0000 -243.34486 -239.51747 3.82739 1.83451 -239.37392 320.60626
150.0000 -243.75972 -240.35498 3.40474 1.80061 -240.07471 293.59754
155.0000 -243.17005 -239.76904 3.40102 1.80688 -239.94514 299.20953
160.0000 -243.97638 -240.26355 3.71283 1.80051 -240.07669 295.89536
165.0000 -243.22945 -239.32849 3.90096 1.80490 -239.98595 299.38014
170.0000 -244.11874 -239.81671 4.30204 1.81797 -239.71573 307.89754
175.0000 -244.31126 -241.13863 3.17263 1.79889 -240.11019 295.11037
180.0000 -243.99574 -239.95795 4.03779 1.78787 -240.33804 285.88489
185.0000 -243.77275 -240.56864 3.20411 1.80514 -239.98104 299.14136
190.0000 -244.30996 -241.14530 3.16465 1.77950 -240.51104 279.35300
195.0000 -244.21499 -241.09066 3.12433 1.76671 -240.77552 268.37295
200.0000 -243.86598 -240.48790 3.37808 1.75687 -240.97902 258.50791
205.0000 -243.90567 -240.11151 3.79417 1.78303 -240.43805 280.10495
210.0000 -243.97371 -240.74645 3.22726 1.79892 -240.10954 293.41605
215.0000 -243.64945 -239.80551 3.84394 1.80618 -239.95956 300.11216
220.0000 -243.01142 -239.36322 3.64820 1.82725 -239.52401 315.74301
225.0000 -243.58394 -240.22623 3.35771 1.81018 -239.87684 302.94107
230.0000 -243.41539 -239.72258 3.69281 1.81151 -239.84937 301.52786
235.0000 -243.95370 -240.38777 3.56592 1.79131 -240.26702 286.59476
240.0000 -243.41438 -240.49257 2.92181 1.78962 -240.30196 285.59540
245.0000 -243.65793 -239.96864 3.68930 1.79722 -240.14471 288.52184
250.0000 -243.34962 -239.52627 3.82335 1.82651 -239.53925 308.54807
MELTING PROCESS: loop number 2 T-loop= 329.00000000000000
main_MD> interactions number 2 at Temperature= 329.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.12669 0.92154 -1.80561
force_rgl> df(natom) -1.68099 -1.05899 -0.97156
255.0000 -243.36963 -239.18655 4.18308 1.84604 -239.13546 330.28299
260.0000 -242.87122 -238.74624 4.12498 1.85002 -239.05311 336.05157
265.0000 -243.59863 -239.81777 3.78086 1.82183 -239.63593 313.70897
270.0000 -243.13172 -239.20587 3.92585 1.82151 -239.64253 310.13356
275.0000 -242.76845 -238.95009 3.81837 1.85461 -238.95823 338.33764
280.0000 -242.56497 -238.73710 3.82787 1.84640 -239.12803 331.69874
285.0000 -242.84116 -238.46238 4.37878 1.88525 -238.32479 360.10640
290.0000 -242.34268 -238.01652 4.32616 1.90934 -237.82683 376.74689
295.0000 -243.25645 -239.36633 3.89012 1.87292 -238.57976 352.46974
300.0000 -243.10635 -238.97802 4.12833 1.83617 -239.33961 319.73998
305.0000 -242.95573 -238.81842 4.13732 1.85934 -238.86053 335.59353
310.0000 -242.82107 -238.88395 3.93712 1.86418 -238.76048 344.24286
315.0000 -242.92161 -239.29069 3.63093 1.84880 -239.07842 333.69629
320.0000 -242.65321 -239.25324 3.39997 1.85793 -238.88976 337.95850
325.0000 -242.54938 -238.58776 3.96162 1.85393 -238.97246 335.92322
330.0000 -243.89050 -239.94654 3.94396 1.83168 -239.43232 313.97307
335.0000 -243.10094 -239.28720 3.81374 1.82761 -239.51652 314.35626
340.0000 -243.33317 -239.35755 3.97562 1.83633 -239.33630 318.84594
345.0000 -242.99990 -238.89981 4.10009 1.84553 -239.14602 329.05366
350.0000 -242.81647 -238.94172 3.87475 1.85453 -238.95990 338.94027
355.0000 -243.78909 -239.58643 4.20267 1.84559 -239.14478 330.83924
360.0000 -243.40736 -239.40621 4.00115 1.84054 -239.24917 326.14762
365.0000 -242.79957 -238.55949 4.24008 1.84617 -239.13288 331.56978
370.0000 -242.89266 -239.46427 3.42839 1.85461 -238.95836 335.93371
375.0000 -243.94710 -240.08303 3.86407 1.82790 -239.51050 316.04615
380.0000 -243.49692 -239.81368 3.68324 1.80590 -239.96526 298.67882
385.0000 -243.20532 -239.44454 3.76079 1.82932 -239.48115 317.58801
390.0000 -242.72147 -239.02943 3.69204 1.83437 -239.37683 321.72465
395.0000 -243.22650 -239.29833 3.92816 1.84217 -239.21558 329.10892
400.0000 -243.00447 -238.99250 4.01197 1.85115 -239.02995 336.68996
405.0000 -243.41957 -239.43755 3.98202 1.83275 -239.41020 318.98319
410.0000 -243.57780 -238.47231 5.10548 1.86295 -238.78584 341.79475
415.0000 -243.38502 -239.41563 3.96939 1.85524 -238.94523 336.64971
420.0000 -243.17201 -238.74842 4.42359 1.83590 -239.34502 319.01724
425.0000 -243.46185 -239.35455 4.10729 1.86181 -238.80938 338.39664
430.0000 -243.18156 -239.09052 4.09104 1.83846 -239.29222 321.50495
435.0000 -243.56860 -239.84143 3.72717 1.82455 -239.57977 310.89704
440.0000 -243.31901 -239.43081 3.88819 1.83126 -239.44109 313.43069
445.0000 -243.06629 -238.86769 4.19860 1.85043 -239.04467 330.18411
450.0000 -242.94640 -239.48098 3.46543 1.85062 -239.04082 332.68191
455.0000 -243.19066 -239.54435 3.64632 1.82935 -239.48051 314.33072
460.0000 -243.46618 -239.82595 3.64023 1.83024 -239.46208 316.82713
465.0000 -243.25765 -239.48410 3.77355 1.82735 -239.52199 313.91490
470.0000 -243.28062 -239.29528 3.98534 1.84779 -239.09936 327.02804
475.0000 -242.88872 -239.04562 3.84310 1.83577 -239.34771 320.42947
480.0000 -242.71989 -238.71639 4.00350 1.85947 -238.85791 340.12435
485.0000 -242.85131 -238.72859 4.12272 1.86961 -238.64825 346.76428
490.0000 -243.41547 -238.87514 4.54032 1.85489 -238.95249 333.46246
495.0000 -242.77531 -238.49603 4.27927 1.88323 -238.36657 359.29637
500.0000 -242.79179 -238.45830 4.33350 1.84991 -239.05542 331.32047
MELTING PROCESS: loop number 3 T-loop= 354.00000000000000
main_MD> interactions number 3 at Temperature= 354.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.95673 0.14183 -3.22099
force_rgl> df(natom) -3.52002 -0.68240 1.48947
505.0000 -242.36027 -238.43374 3.92652 1.89236 -238.17791 365.31641
510.0000 -242.63681 -238.48503 4.15178 1.87666 -238.50246 355.38837
515.0000 -242.70250 -238.79233 3.91017 1.88152 -238.40205 357.19254
520.0000 -242.84853 -238.19533 4.65320 1.88594 -238.31056 363.97646
525.0000 -242.94159 -238.93436 4.00722 1.86926 -238.65540 348.55172
530.0000 -243.02974 -238.65867 4.37107 1.86438 -238.75625 343.18867
535.0000 -242.05765 -237.17844 4.87921 1.88776 -238.27293 360.62184
540.0000 -242.49700 -237.56494 4.93205 1.92720 -237.45751 390.59116
545.0000 -243.13449 -238.57547 4.55902 1.90144 -237.99010 368.70822
550.0000 -243.14958 -238.24604 4.90354 1.88110 -238.41060 355.55348
555.0000 -242.60263 -238.28404 4.31859 1.89144 -238.19685 361.65421
560.0000 -242.76966 -238.09073 4.67894 1.90341 -237.94946 373.91067
565.0000 -243.00949 -237.76973 5.23976 1.90082 -238.00289 375.29049
570.0000 -242.47865 -237.75024 4.72840 1.93928 -237.20793 404.11841
575.0000 -243.17768 -238.97482 4.20286 1.87515 -238.53368 354.83154
580.0000 -243.17839 -238.66966 4.50873 1.87419 -238.55361 350.44970
585.0000 -242.66482 -239.03737 3.62746 1.85156 -239.02139 334.42583
590.0000 -242.86666 -238.80208 4.06457 1.85853 -238.87724 338.94509
595.0000 -243.03102 -238.62582 4.40520 1.84833 -239.08814 332.42703
600.0000 -242.93358 -238.48784 4.44574 1.88160 -238.40034 360.80734
605.0000 -242.86908 -238.08862 4.78046 1.88301 -238.37123 361.08426
610.0000 -242.58218 -238.26207 4.32011 1.89171 -238.19132 368.80533
615.0000 -243.81391 -239.67244 4.14147 1.84036 -239.25284 324.61831
620.0000 -242.89449 -238.15138 4.74311 1.84392 -239.17931 327.28040
625.0000 -242.90359 -237.87748 5.02611 1.88828 -238.26214 361.56167
630.0000 -241.83136 -237.33281 4.49856 1.95838 -236.81300 413.95220
635.0000 -242.59559 -237.73641 4.85918 1.90648 -237.88588 369.69522
640.0000 -242.84755 -238.69332 4.15423 1.89360 -238.15225 367.16134
645.0000 -242.96450 -238.61285 4.35165 1.90872 -237.83973 381.66809
650.0000 -242.68597 -238.14634 4.53962 1.87564 -238.52345 357.73009
655.0000 -243.00971 -237.86076 5.14895 1.89405 -238.14296 377.89520
660.0000 -242.53802 -237.87967 4.65835 1.90053 -238.00897 381.76768
665.0000 -242.80569 -238.31287 4.49283 1.90512 -237.91406 381.36604
670.0000 -242.77322 -238.19885 4.57436 1.90678 -237.87977 382.62419
675.0000 -243.21848 -239.00890 4.20957 1.86022 -238.84230 354.97359
680.0000 -243.01741 -238.81717 4.20024 1.86398 -238.76462 353.97606
685.0000 -243.04390 -238.84255 4.20135 1.85732 -238.90236 347.52069
690.0000 -243.37896 -239.23234 4.14662 1.84356 -239.18674 338.27910
695.0000 -242.90455 -238.86188 4.04267 1.85691 -238.91078 346.33143
700.0000 -242.54472 -238.17342 4.37130 1.87189 -238.60105 355.93143
705.0000 -243.12070 -238.89338 4.22731 1.89078 -238.21053 374.58906
710.0000 -242.62910 -238.69441 3.93469 1.85960 -238.85514 349.65757
715.0000 -243.07525 -238.69070 4.38455 1.87090 -238.62161 358.11102
720.0000 -243.06908 -239.19093 3.87816 1.86302 -238.78446 356.00873
725.0000 -243.56385 -239.38748 4.17637 1.82359 -239.59964 322.70467
730.0000 -243.36783 -240.00501 3.36282 1.81065 -239.86707 310.25542
735.0000 -242.88820 -238.99049 3.89771 1.82609 -239.54787 320.80223
740.0000 -242.73365 -238.87247 3.86119 1.85004 -239.05276 336.98346
745.0000 -243.05117 -238.86471 4.18646 1.88078 -238.41732 361.16529
750.0000 -242.97188 -238.41097 4.56091 1.87137 -238.61192 353.37062
MELTING PROCESS: loop number 4 T-loop= 379.00000000000000
main_MD> interactions number 4 at Temperature= 379.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.76160 2.70112 0.49060
force_rgl> df(natom) -0.11315 -1.07825 0.87030
755.0000 -243.02382 -238.17830 4.84551 1.89006 -238.22533 369.47632
760.0000 -243.12732 -238.68349 4.44383 1.88479 -238.33432 362.36429
765.0000 -242.70494 -239.03527 3.66967 1.85904 -238.86679 345.89370
770.0000 -242.88940 -238.83364 4.05577 1.84683 -239.11921 338.83612
775.0000 -242.88039 -238.42417 4.45622 1.87556 -238.52515 360.24846
780.0000 -243.50436 -239.20989 4.29447 1.87288 -238.58063 359.62571
785.0000 -243.52194 -239.71106 3.81088 1.83342 -239.39639 324.41503
790.0000 -243.10253 -238.76476 4.33777 1.82891 -239.48953 323.65140
795.0000 -242.28987 -238.26607 4.02380 1.88550 -238.31973 362.17551
800.0000 -242.94166 -238.31013 4.63153 1.88758 -238.27664 371.26163
805.0000 -242.68239 -238.08654 4.59585 1.90949 -237.82367 386.55411
810.0000 -243.15942 -238.21694 4.94248 1.90518 -237.91291 384.53982
815.0000 -242.46483 -238.03212 4.43271 1.89284 -238.16791 369.82170
820.0000 -243.53945 -239.76443 3.77502 1.88365 -238.35794 362.37630
825.0000 -243.57838 -239.66206 3.91632 1.84038 -239.25252 330.90171
830.0000 -242.66795 -238.62256 4.04539 1.84184 -239.22229 334.87665
835.0000 -242.44321 -237.79883 4.64438 1.88159 -238.40052 363.21741
840.0000 -242.28057 -237.38736 4.89321 1.92268 -237.55097 396.96661
845.0000 -242.60545 -238.35556 4.24989 1.91018 -237.80941 381.30925
850.0000 -242.59611 -238.67316 3.92296 1.86893 -238.66217 349.68236
855.0000 -243.37524 -238.97522 4.40002 1.88364 -238.35823 367.81458
860.0000 -242.95038 -237.69008 5.26030 1.91906 -237.62583 392.34348
865.0000 -242.44769 -237.60119 4.84650 1.92009 -237.60465 391.85867
870.0000 -241.37850 -236.49688 4.88162 1.94094 -237.17358 410.70871
875.0000 -243.05350 -237.62212 5.43138 1.96299 -236.71762 427.26344
880.0000 -243.11446 -238.92999 4.18447 1.90012 -238.01754 375.66707
885.0000 -243.36522 -238.53941 4.82580 1.87277 -238.58284 356.70103
890.0000 -243.40400 -238.50444 4.89956 1.87325 -238.57294 359.64157
895.0000 -242.25063 -238.17801 4.07262 1.88340 -238.36319 364.11286
900.0000 -241.61099 -237.09290 4.51809 1.92047 -237.59680 395.86676
905.0000 -242.75366 -238.32935 4.42431 1.92262 -237.55235 395.86267
910.0000 -243.28626 -238.76712 4.51914 1.87938 -238.44633 355.43064
915.0000 -242.63178 -238.09683 4.53495 1.87272 -238.58401 356.80794
920.0000 -242.12988 -237.84645 4.28342 1.91167 -237.77865 386.09697
925.0000 -243.84642 -239.57063 4.27579 1.87270 -238.58425 360.06322
930.0000 -242.79368 -238.20003 4.59365 1.85911 -238.86531 345.59016
935.0000 -243.38509 -238.05679 5.32830 1.89815 -238.05817 379.22518
940.0000 -243.26069 -239.24447 4.01622 1.84978 -239.05809 336.13848
945.0000 -243.29072 -238.68888 4.60184 1.87090 -238.62153 356.67629
950.0000 -242.94839 -238.25205 4.69634 1.88869 -238.25374 369.52271
955.0000 -243.01553 -237.99539 5.02015 1.89964 -238.02745 382.37196
960.0000 -242.33432 -237.86591 4.46841 1.91824 -237.64280 399.99129
965.0000 -242.92951 -238.15852 4.77099 1.89581 -238.10653 382.92128
970.0000 -243.26364 -238.61776 4.64587 1.86620 -238.71868 356.37080
975.0000 -242.76059 -238.47798 4.28262 1.87205 -238.59784 361.41886
980.0000 -242.53508 -237.67038 4.86471 1.89120 -238.20194 373.84399
985.0000 -242.57616 -237.88305 4.69311 1.90760 -237.86274 388.69345
990.0000 -242.58836 -237.50573 5.08263 1.92915 -237.41726 402.45314
995.0000 -242.15458 -237.72351 4.43107 1.89367 -238.15074 377.23881
1000.0000 -242.08155 -237.00354 5.07800 1.93928 -237.20778 410.40487
MELTING PROCESS: loop number 5 T-loop= 404.00000000000000
main_MD> interactions number 5 at Temperature= 404.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40775 -0.46801 0.00597
force_rgl> df(natom) -1.72367 1.47830 0.39741
1005.0000 -242.56068 -237.98494 4.57573 1.91534 -237.70278 392.01921
1010.0000 -242.81592 -237.95847 4.85746 1.91597 -237.68968 393.28438
1015.0000 -242.09469 -237.38348 4.71121 1.92717 -237.45830 399.32550
1020.0000 -242.32837 -238.41949 3.90888 1.90356 -237.94634 383.38432
1025.0000 -242.78025 -237.35393 5.42632 1.90651 -237.88532 389.51558
1030.0000 -241.55864 -236.78194 4.77670 1.95165 -236.95214 418.01334
1035.0000 -242.08572 -236.66986 5.41587 1.95453 -236.89257 431.98474
1040.0000 -242.11626 -236.82264 5.29362 1.94917 -237.00350 427.23777
1045.0000 -241.71648 -237.70241 4.01407 1.94915 -237.00376 424.04495
1050.0000 -241.71552 -237.55404 4.16149 1.91494 -237.71107 396.25327
1055.0000 -242.86106 -238.33320 4.52786 1.90328 -237.95213 390.28421
1060.0000 -242.42965 -237.69247 4.73718 1.89828 -238.05544 388.36462
1065.0000 -242.64193 -238.55336 4.08857 1.90659 -237.88370 392.81016
1070.0000 -242.53450 -237.84684 4.68766 1.89600 -238.10262 387.79717
1075.0000 -241.94837 -237.69123 4.25714 1.91750 -237.65809 401.30443
1080.0000 -242.55978 -238.59855 3.96123 1.89935 -238.03338 381.87863
1085.0000 -242.58617 -238.14338 4.44279 1.89148 -238.19610 382.66072
1090.0000 -242.49097 -238.24995 4.24102 1.89908 -238.03897 383.21658
1095.0000 -242.53135 -237.93094 4.60041 1.89672 -238.08774 383.56845
1100.0000 -242.53412 -238.10842 4.42570 1.90598 -237.89634 389.40189
1105.0000 -242.66237 -238.24669 4.41568 1.90181 -237.98243 390.40418
1110.0000 -242.73609 -238.21058 4.52551 1.89850 -238.05100 384.63355
1115.0000 -242.63709 -238.28192 4.35517 1.89767 -238.06814 376.19410
1120.0000 -242.79041 -237.94684 4.84358 1.88492 -238.33162 372.29202
1125.0000 -242.62430 -238.03800 4.58630 1.90553 -237.90571 383.91577
1130.0000 -241.51143 -237.05174 4.45969 1.91358 -237.73917 388.93738
1135.0000 -242.26154 -237.32960 4.93194 1.96715 -236.63166 431.13880
1140.0000 -242.55356 -237.29607 5.25748 1.92126 -237.58044 399.11397
1145.0000 -242.91080 -238.41720 4.49360 1.89667 -238.08871 382.58078
1150.0000 -242.02553 -237.14896 4.87658 1.91023 -237.80840 397.24200
1155.0000 -242.25567 -237.25660 4.99907 1.94469 -237.09605 419.36032
1160.0000 -242.33948 -237.77463 4.56485 1.91474 -237.71514 393.19278
1165.0000 -242.49318 -237.47970 5.01349 1.92534 -237.49598 407.51998
1170.0000 -242.00217 -236.61000 5.39217 1.95314 -236.92126 422.51980
1175.0000 -241.10859 -235.89131 5.21728 1.97104 -236.55134 419.15276
1180.0000 -242.59246 -236.80829 5.78417 1.98519 -236.25880 448.89893
1185.0000 -242.53152 -238.22908 4.30244 1.91749 -237.65831 403.81919
1190.0000 -242.48465 -237.09153 5.39312 1.89463 -238.13097 385.11630
1195.0000 -242.44924 -237.60799 4.84125 1.93274 -237.34303 411.67865
1200.0000 -243.12459 -238.21650 4.90810 1.89534 -238.11630 386.27045
1205.0000 -242.61971 -237.24882 5.37089 1.92332 -237.53783 408.92201
1210.0000 -242.59398 -237.99607 4.59791 1.91733 -237.66174 397.58464
1215.0000 -242.55239 -237.44529 5.10710 1.92278 -237.54896 403.96916
1220.0000 -242.31281 -237.10972 5.20309 1.94564 -237.07646 420.26093
1225.0000 -242.50993 -238.21811 4.29182 1.91047 -237.80352 397.22323
1230.0000 -241.52091 -237.30734 4.21358 1.91935 -237.61985 402.93704
1235.0000 -241.98513 -237.52038 4.46475 1.92346 -237.53487 405.26184
1240.0000 -242.15264 -237.28735 4.86529 1.93536 -237.28888 415.45878
1245.0000 -242.95339 -238.06187 4.89151 1.93094 -237.38036 407.88494
1250.0000 -243.23258 -238.68934 4.54324 1.87981 -238.43730 377.36032
MELTING PROCESS: loop number 6 T-loop= 429.00000000000000
main_MD> interactions number 6 at Temperature= 429.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70950 -0.93232 -2.22398
force_rgl> df(natom) -3.13721 0.45825 -1.80890
1255.0000 -242.94653 -237.82364 5.12289 1.87947 -238.44433 376.99056
1260.0000 -242.29709 -237.42637 4.87072 1.90337 -237.95037 391.03473
1265.0000 -241.48851 -237.34528 4.14323 1.92863 -237.42799 400.71897
1270.0000 -241.54165 -236.08491 5.45674 1.96526 -236.67080 432.17035
1275.0000 -242.15071 -236.82718 5.32352 1.98198 -236.32519 440.58969
1280.0000 -241.38090 -235.59787 5.78303 1.98171 -236.33077 444.65020
1285.0000 -240.90678 -235.44191 5.46487 2.02637 -235.40741 471.21836
1290.0000 -241.23667 -235.29284 5.94384 2.01166 -235.71153 459.91517
1295.0000 -241.16167 -235.83282 5.32885 2.01473 -235.64813 465.06177
1300.0000 -241.26024 -236.84788 4.41237 1.96507 -236.67461 418.94962
1305.0000 -242.35028 -237.48096 4.86932 1.96972 -236.57860 434.31149
1310.0000 -241.07822 -236.61513 4.46308 1.95328 -236.91849 412.60891
1315.0000 -241.98099 -237.32926 4.65173 1.93615 -237.27252 402.71157
1320.0000 -242.46004 -237.50468 4.95536 1.93512 -237.29380 401.78808
1325.0000 -241.96169 -236.79747 5.16422 1.94339 -237.12293 412.65382
1330.0000 -242.26843 -237.16934 5.09909 1.96818 -236.61043 432.05127
1335.0000 -241.61407 -236.81408 4.79999 1.95585 -236.86528 414.67116
1340.0000 -242.40593 -237.47765 4.92828 1.95711 -236.83930 409.43224
1345.0000 -241.21747 -235.76123 5.45625 1.98499 -236.26296 417.29489
1350.0000 -242.10766 -237.19659 4.91107 1.97567 -236.45550 420.93668
1355.0000 -241.23767 -236.76176 4.47590 1.95398 -236.90401 419.45276
1360.0000 -241.56843 -235.11797 6.45046 2.00812 -235.78461 464.49311
1365.0000 -241.68398 -235.42578 6.25820 2.05772 -234.75923 493.36033
1370.0000 -241.04746 -236.02869 5.01877 1.98993 -236.16076 445.56394
1375.0000 -241.53832 -236.40436 5.13396 1.98795 -236.20166 441.25547
1380.0000 -241.19743 -235.80464 5.39279 1.96818 -236.61045 432.23307
1385.0000 -241.63623 -235.93145 5.70478 2.01212 -235.70190 455.89378
1390.0000 -241.90355 -236.85219 5.05136 1.97411 -236.48779 435.38203
1395.0000 -241.68460 -236.69041 4.99419 1.95647 -236.85256 414.41080
1400.0000 -242.32536 -237.20095 5.12441 1.98618 -236.23832 432.54666
1405.0000 -241.47335 -236.64234 4.83101 1.96150 -236.74841 420.78415
1410.0000 -242.30290 -237.57603 4.72687 1.94439 -237.10225 413.21288
1415.0000 -241.52354 -237.05177 4.47177 1.93592 -237.27737 402.56758
1420.0000 -242.21401 -237.09103 5.12299 1.95494 -236.88409 418.70330
1425.0000 -242.37619 -237.86923 4.50696 1.94162 -237.15958 405.41198
1430.0000 -241.85153 -237.26458 4.58696 1.92361 -237.53188 393.73317
1435.0000 -241.99119 -236.56127 5.42992 1.97050 -236.56242 433.28331
1440.0000 -242.21703 -237.24279 4.97424 1.95002 -236.98587 412.99974
1445.0000 -241.24673 -236.43094 4.81580 1.95579 -236.86656 418.78986
1450.0000 -242.19991 -236.62343 5.57648 1.97612 -236.44621 430.62709
1455.0000 -242.64629 -237.69677 4.94951 1.95014 -236.98330 415.52838
1460.0000 -241.59738 -236.67966 4.91772 1.94541 -237.08107 410.01168
1465.0000 -241.89069 -236.71780 5.17289 1.95259 -236.93273 414.57661
1470.0000 -241.09587 -236.15608 4.93979 1.98176 -236.32966 438.87562
1475.0000 -241.67492 -235.92455 5.75037 1.99158 -236.12664 442.61011
1480.0000 -240.44585 -236.14678 4.29908 1.98933 -236.17313 444.92159
1485.0000 -241.80311 -235.95174 5.85137 1.98683 -236.22486 436.21800
1490.0000 -242.60519 -237.51366 5.09153 1.94851 -237.01700 414.12009
1495.0000 -242.57243 -236.71919 5.85324 1.94324 -237.12606 413.02105
1500.0000 -240.85307 -235.64196 5.21111 1.98985 -236.16247 440.84919
MELTING PROCESS: loop number 7 T-loop= 454.00000000000000
main_MD> interactions number 7 at Temperature= 454.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.83809 -1.92427 -1.81708
force_rgl> df(natom) 0.21698 -2.28646 1.08822
1505.0000 -240.88765 -235.38700 5.50065 2.00772 -235.79298 452.82715
1510.0000 -240.99765 -235.44699 5.55066 2.04601 -235.00144 487.70076
1515.0000 -241.30401 -235.38080 5.92321 2.02776 -235.37876 476.52542
1520.0000 -241.28794 -235.64125 5.64669 2.03154 -235.30049 472.72142
1525.0000 -242.31451 -236.29235 6.02216 2.00304 -235.88968 453.89536
1530.0000 -241.67981 -235.82453 5.85528 2.00106 -235.93056 458.13001
1535.0000 -240.44785 -234.25009 6.19775 2.03618 -235.20469 481.17041
1540.0000 -240.49851 -234.60813 5.89038 2.04839 -234.95221 480.22894
1545.0000 -241.13419 -235.82244 5.31175 2.01342 -235.67509 456.28832
1550.0000 -241.41993 -235.63127 5.78866 2.00602 -235.82812 455.86231
1555.0000 -240.80410 -234.73439 6.06972 2.05649 -234.78467 490.57190
1560.0000 -242.02614 -236.03113 5.99501 2.01982 -235.54285 468.17847
1565.0000 -241.14097 -235.53146 5.60951 2.02281 -235.48110 471.87001
1570.0000 -241.08021 -236.06467 5.01554 1.99949 -235.96313 449.69717
1575.0000 -241.96072 -236.80192 5.15880 1.98288 -236.30649 434.88419
1580.0000 -241.31581 -235.99742 5.31839 1.97983 -236.36948 440.26086
1585.0000 -241.41355 -235.95191 5.46164 1.98109 -236.34349 436.63201
1590.0000 -241.59834 -236.59922 4.99912 1.98830 -236.19450 443.59468
1595.0000 -242.64631 -237.17433 5.47198 1.98855 -236.18935 448.48345
1600.0000 -241.85921 -236.07687 5.78234 1.97727 -236.42240 450.23165
1605.0000 -241.47276 -235.49252 5.98024 2.02651 -235.40444 488.16979
1610.0000 -242.18285 -236.95019 5.23265 1.97890 -236.38880 449.03345
1615.0000 -241.37494 -236.30530 5.06964 1.98556 -236.25111 454.73607
1620.0000 -241.32716 -237.10856 4.21860 1.96971 -236.57879 442.75246
1625.0000 -242.24243 -237.58723 4.65520 1.92695 -237.46278 409.97319
1630.0000 -242.45243 -237.13837 5.31406 1.93141 -237.37052 418.62028
1635.0000 -241.08717 -235.28631 5.80086 1.98866 -236.18705 457.76804
1640.0000 -240.93691 -235.48319 5.45373 2.01916 -235.55655 482.54871
1645.0000 -241.07316 -235.47294 5.60023 2.03838 -235.15907 493.66363
1650.0000 -240.97677 -235.53284 5.44393 2.03235 -235.28372 472.30236
1655.0000 -241.45547 -235.83592 5.61954 1.99894 -235.97456 450.30517
1660.0000 -241.56655 -236.57972 4.98683 1.99426 -236.07114 445.72507
1665.0000 -240.94065 -234.74007 6.20058 2.01948 -235.54982 471.15916
1670.0000 -241.98060 -236.26109 5.71951 2.02924 -235.34802 483.51546
1675.0000 -241.65871 -235.94243 5.71628 1.99925 -235.96808 465.83715
1680.0000 -241.50108 -235.49191 6.00917 2.02318 -235.47328 485.09551
1685.0000 -240.82484 -235.67682 5.14802 2.02212 -235.49524 481.62214
1690.0000 -242.14900 -236.97406 5.17494 2.00018 -235.94876 461.82455
1695.0000 -241.42328 -236.06360 5.35968 1.96928 -236.58775 429.88532
1700.0000 -241.80961 -237.02069 4.78891 1.95409 -236.90162 415.67796
1705.0000 -240.91682 -235.46850 5.44832 2.02356 -235.46540 468.24359
1710.0000 -241.54125 -235.80108 5.74017 2.01481 -235.64643 465.14631
1715.0000 -241.19187 -236.03523 5.15665 2.00136 -235.92453 446.29920
1720.0000 -241.90311 -236.34151 5.56160 1.98342 -236.29524 437.96946
1725.0000 -241.73743 -236.07255 5.66488 2.01090 -235.72731 453.58424
1730.0000 -241.95826 -236.51399 5.44427 1.98919 -236.17613 450.77146
1735.0000 -241.63719 -236.78226 4.85493 1.97026 -236.56742 428.98751
1740.0000 -242.65433 -237.02608 5.62824 1.96522 -236.67154 425.05934
1745.0000 -241.31141 -236.74997 4.56144 1.94737 -237.04061 407.87576
1750.0000 -242.18968 -236.85033 5.33936 1.94790 -237.02973 413.13066
MELTING PROCESS: loop number 8 T-loop= 479.00000000000000
main_MD> interactions number 8 at Temperature= 479.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.28405 -0.58872 1.06678
force_rgl> df(natom) -2.96056 1.22777 1.02667
1755.0000 -242.19374 -236.16753 6.02621 1.97364 -236.49751 435.64215
1760.0000 -241.33395 -234.57290 6.76106 2.02360 -235.46470 482.61267
1765.0000 -240.61494 -234.40289 6.21205 2.05800 -234.75350 479.81522
1770.0000 -240.19630 -233.58716 6.60913 2.09757 -233.93547 504.21024
1775.0000 -240.44090 -234.18734 6.25356 2.10440 -233.79415 501.43768
1780.0000 -240.15079 -233.85289 6.29789 2.08331 -234.23019 503.50601
1785.0000 -241.21338 -235.92420 5.28918 2.03310 -235.26821 471.65602
1790.0000 -241.40886 -235.90690 5.50196 2.01207 -235.70297 455.70130
1795.0000 -240.50950 -234.23824 6.27126 2.03537 -235.22131 474.76637
1800.0000 -240.50271 -234.27799 6.22471 2.08329 -234.23060 512.03100
1805.0000 -240.61809 -233.95395 6.66414 2.10497 -233.78252 512.85435
1810.0000 -240.59464 -234.39587 6.19877 2.06343 -234.64133 482.29329
1815.0000 -240.09600 -232.61849 7.47751 2.11453 -233.58483 507.02976
1820.0000 -240.10577 -234.11989 5.98588 2.14604 -232.93332 530.76248
1825.0000 -240.73218 -235.44369 5.28849 2.02686 -235.39720 464.14098
1830.0000 -240.25904 -234.72356 5.53548 2.03708 -235.18594 462.77144
1835.0000 -239.96433 -234.56107 5.40326 2.06849 -234.53655 486.22668
1840.0000 -240.83627 -235.56464 5.27163 2.04562 -235.00950 472.66697
1845.0000 -241.30503 -235.45058 5.85444 2.02086 -235.52122 463.95677
1850.0000 -239.98545 -234.47611 5.50935 2.03081 -235.31568 461.34254
1855.0000 -240.36079 -234.12746 6.23333 2.08249 -234.24710 494.16515
1860.0000 -239.81193 -233.98012 5.83182 2.09008 -234.09028 530.93238
1865.0000 -240.42778 -234.40159 6.02619 2.08407 -234.21461 519.14851
1870.0000 -241.07678 -234.49163 6.58514 2.06462 -234.61658 499.59268
1875.0000 -240.33356 -233.76714 6.56642 2.05976 -234.71711 489.76974
1880.0000 -239.08312 -233.66872 5.41441 2.11734 -233.52675 531.85152
1885.0000 -241.57514 -235.23096 6.34418 2.10084 -233.86779 522.57328
1890.0000 -240.22676 -234.13251 6.09425 2.06332 -234.64352 484.50925
1895.0000 -241.15920 -235.66505 5.49415 2.02016 -235.53587 457.12335
1900.0000 -240.15936 -233.74051 6.41885 2.06224 -234.66586 493.28135
1905.0000 -240.13535 -234.54514 5.59021 2.09030 -234.08579 520.37102
1910.0000 -241.21378 -235.22910 5.98468 2.02576 -235.42008 474.86523
1915.0000 -240.44827 -234.90394 5.54433 2.05024 -234.91385 481.16694
1920.0000 -241.35157 -235.65311 5.69847 2.04689 -234.98318 483.25491
1925.0000 -240.55158 -234.45124 6.10034 2.05773 -234.75913 498.77390
1930.0000 -241.29820 -235.45512 5.84307 2.03268 -235.27690 473.92529
1935.0000 -240.79249 -235.44794 5.34455 2.01575 -235.62686 462.93511
1940.0000 -241.50479 -235.70377 5.80101 2.00460 -235.85749 454.01696
1945.0000 -240.92275 -234.86289 6.05986 2.01285 -235.68694 461.76282
1950.0000 -241.17673 -235.99005 5.18668 2.03695 -235.18871 479.77592
1955.0000 -241.30870 -235.23100 6.07770 2.02370 -235.46253 473.15777
1960.0000 -241.53611 -235.65082 5.88529 2.01608 -235.62015 466.51308
1965.0000 -240.85477 -235.06078 5.79399 2.02145 -235.50907 472.42926
1970.0000 -240.98038 -235.37719 5.60320 2.04264 -235.07103 476.75720
1975.0000 -240.97003 -235.33219 5.63784 2.01486 -235.64538 454.77571
1980.0000 -240.99184 -235.08217 5.90967 2.04074 -235.11033 474.05268
1985.0000 -241.48073 -236.06534 5.41539 2.01033 -235.73893 461.84344
1990.0000 -241.30457 -235.25805 6.04652 2.00340 -235.88238 445.74757
1995.0000 -241.48999 -235.39655 6.09344 2.02233 -235.49101 465.83069
2000.0000 -241.14730 -234.72974 6.41756 2.02465 -235.44306 472.86246
MELTING PROCESS: loop number 9 T-loop= 504.00000000000000
main_MD> interactions number 9 at Temperature= 504.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.27249 -1.99238 -0.75769
force_rgl> df(natom) 1.75682 1.31761 2.04837
2005.0000 -240.96659 -233.77297 7.19362 2.09570 -233.97415 528.36626
2010.0000 -240.18861 -233.80775 6.38086 2.09105 -234.07031 510.07057
2015.0000 -240.22248 -233.66550 6.55698 2.11526 -233.56963 535.61009
2020.0000 -239.65033 -233.74754 5.90279 2.10250 -233.83360 510.79531
2025.0000 -239.50500 -233.38497 6.12002 2.14556 -232.94336 540.97279
2030.0000 -240.59463 -234.73811 5.85652 2.09110 -234.06914 505.45992
2035.0000 -240.90449 -234.39720 6.50729 2.05280 -234.86102 494.13272
2040.0000 -240.20609 -233.62520 6.58090 2.08680 -234.15805 511.22519
2045.0000 -240.63319 -233.62954 7.00365 2.12781 -233.31031 534.43867
2050.0000 -239.95398 -233.97825 5.97573 2.08438 -234.20806 508.65144
2055.0000 -239.70501 -233.57279 6.13222 2.09373 -234.01489 506.57418
2060.0000 -240.45595 -233.67040 6.78554 2.13772 -233.10539 532.29648
2065.0000 -240.37587 -233.97131 6.40456 2.08625 -234.16945 498.08288
2070.0000 -239.35031 -233.64650 5.70381 2.09061 -234.07936 502.01541
2075.0000 -241.12082 -235.15617 5.96464 2.07037 -234.49774 490.28444
2080.0000 -240.35750 -233.84202 6.51549 2.07698 -234.36110 496.80446
2085.0000 -241.54430 -235.76024 5.78406 2.07762 -234.34788 506.61766
2090.0000 -240.67598 -235.51217 5.16380 1.99597 -236.03582 442.40620
2095.0000 -240.77006 -234.65590 6.11416 2.03767 -235.17377 477.18521
2100.0000 -240.18275 -233.56711 6.61564 2.08296 -234.23747 504.16182
2105.0000 -239.30049 -233.12073 6.17976 2.12855 -233.29503 533.71323
2110.0000 -239.46566 -233.32363 6.14202 2.12549 -233.35812 530.97850
2115.0000 -240.74165 -234.81763 5.92403 2.11076 -233.66278 517.93474
2120.0000 -240.89084 -234.95744 5.93340 2.05660 -234.78236 475.00765
2125.0000 -239.86080 -233.56084 6.29996 2.06957 -234.51420 487.92642
2130.0000 -240.88404 -234.87193 6.01211 2.06462 -234.61659 493.99833
2135.0000 -241.04402 -235.34843 5.69559 2.04603 -235.00090 479.60097
2140.0000 -240.21861 -233.95303 6.26559 2.07149 -234.47457 489.36243
2145.0000 -240.45908 -233.46986 6.98922 2.10079 -233.86877 512.04215
2150.0000 -240.87266 -234.32098 6.55168 2.08580 -234.17871 505.88035
2155.0000 -239.80503 -233.99055 5.81449 2.11398 -233.59625 522.41054
2160.0000 -240.38007 -233.92640 6.45366 2.07230 -234.45787 493.43229
2165.0000 -240.28840 -234.08768 6.20072 2.11114 -233.65492 526.56917
2170.0000 -240.60596 -234.07623 6.52973 2.09642 -233.95915 511.67246
2175.0000 -239.84182 -233.97342 5.86839 2.11063 -233.66549 524.45867
2180.0000 -240.72621 -233.57486 7.15136 2.08694 -234.15515 510.40392
2185.0000 -241.14141 -233.77079 7.37062 2.10489 -233.78407 520.26098
2190.0000 -240.22942 -234.06491 6.16450 2.09693 -233.94865 502.97400
2195.0000 -241.90480 -235.00086 6.90394 2.05157 -234.88641 482.31745
2200.0000 -240.21252 -234.85661 5.35591 2.07576 -234.38640 501.01695
2205.0000 -240.84592 -234.66103 6.18490 2.06629 -234.58202 498.41342
2210.0000 -240.71541 -234.74551 5.96990 2.05635 -234.78758 484.69170
2215.0000 -240.13983 -233.15864 6.98119 2.08613 -234.17189 508.98052
2220.0000 -240.30806 -234.74955 5.55851 2.10844 -233.71063 517.56914
2225.0000 -240.50329 -235.41512 5.08817 2.04903 -234.93889 473.59917
2230.0000 -240.32131 -235.23902 5.08229 2.04260 -235.07191 471.72119
2235.0000 -238.97809 -233.12108 5.85700 2.07819 -234.33607 485.04799
2240.0000 -240.03139 -233.46917 6.56222 2.11573 -233.56003 517.27953
2245.0000 -238.66625 -232.13481 6.53144 2.13097 -233.24500 523.67314
2250.0000 -239.43994 -233.42812 6.01182 2.15885 -232.66845 548.48273
MELTING PROCESS: loop number 10 T-loop= 529.00000000000000
main_MD> interactions number 10 at Temperature= 529.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.40360 -1.53946 1.57946
force_rgl> df(natom) -0.40704 -1.78378 1.66565
2255.0000 -239.82313 -233.12380 6.69933 2.12774 -233.31176 530.87741
2260.0000 -240.33989 -233.24811 7.09177 2.13174 -233.22907 535.32995
2265.0000 -238.73654 -232.72606 6.01048 2.17299 -232.37629 557.99173
2270.0000 -239.71498 -231.91024 7.80474 2.14841 -232.88439 544.97300
2275.0000 -238.74437 -232.61309 6.13128 2.14430 -232.96925 530.83892
2280.0000 -239.78684 -232.93005 6.85680 2.17174 -232.40206 549.29358
2285.0000 -239.40742 -232.67885 6.72857 2.16093 -232.62562 558.18733
2290.0000 -239.46898 -232.16287 7.30611 2.19087 -232.00659 559.86545
2295.0000 -237.99486 -231.04191 6.95295 2.18790 -232.06806 566.33669
2300.0000 -238.33104 -232.25761 6.07343 2.19162 -231.99106 565.36796
2305.0000 -238.41070 -232.14594 6.26476 2.18516 -232.12460 545.97192
2310.0000 -238.10892 -232.01936 6.08956 2.16948 -232.44876 505.81443
2315.0000 -239.53734 -233.30206 6.23528 2.16045 -232.63547 503.76239
2320.0000 -238.76515 -232.60938 6.15577 2.12426 -233.38370 494.24629
2325.0000 -238.70159 -232.33596 6.36563 2.15314 -232.78670 513.82482
2330.0000 -240.27708 -233.76476 6.51231 2.14548 -232.94504 498.61929
2335.0000 -238.38546 -232.01671 6.36875 2.14003 -233.05759 507.14894
2340.0000 -236.85438 -230.39949 6.45489 2.23756 -231.04122 543.40206
2345.0000 -237.34311 -230.59047 6.75264 2.26459 -230.48251 553.26195
2350.0000 -237.25785 -229.23134 8.02651 2.27775 -230.21037 562.75847
2355.0000 -236.96629 -229.96465 7.00164 2.30311 -229.68611 573.85815
2360.0000 -238.75958 -231.99393 6.76566 2.22550 -231.29074 562.10509
2365.0000 -238.42283 -231.27015 7.15267 2.21321 -231.54477 545.66949
2370.0000 -239.02043 -233.99685 5.02359 2.16991 -232.43988 522.11478
2375.0000 -238.65551 -232.97067 5.68485 2.10876 -233.70404 473.61526
2380.0000 -238.76053 -232.96229 5.79823 2.12463 -233.37591 484.32938
2385.0000 -238.52272 -231.31004 7.21268 2.18928 -232.03935 547.03930
2390.0000 -238.56164 -231.58064 6.98100 2.21895 -231.42597 588.47332
2395.0000 -239.10054 -231.99876 7.10178 2.22805 -231.23801 581.92330
2400.0000 -237.55902 -230.58552 6.97350 2.22283 -231.34577 561.63735
2405.0000 -238.22856 -231.51412 6.71444 2.24738 -230.83825 575.93054
2410.0000 -239.40686 -231.38489 8.02197 2.20587 -231.69645 546.02114
2415.0000 -237.79553 -231.92551 5.87002 2.19461 -231.92928 548.83220
2420.0000 -239.84412 -232.91765 6.92647 2.17143 -232.40851 554.61044
2425.0000 -237.81278 -231.25459 6.55818 2.21160 -231.57801 538.04745
2430.0000 -238.92761 -232.76123 6.16638 2.18987 -232.02727 547.17158
2435.0000 -238.90181 -233.32807 5.57373 2.12181 -233.43422 482.42337
2440.0000 -238.79417 -232.74120 6.05297 2.15455 -232.75736 504.63134
2445.0000 -238.25730 -231.82326 6.43405 2.20032 -231.81115 540.51355
2450.0000 -238.24335 -232.42112 5.82223 2.19008 -232.02286 520.97356
2455.0000 -237.87447 -232.32257 5.55190 2.17193 -232.39812 500.24539
2460.0000 -238.01737 -232.84839 5.16899 2.14159 -233.02541 495.26091
2465.0000 -239.17387 -233.61772 5.55615 2.13790 -233.10157 499.31900
2470.0000 -239.04649 -232.09040 6.95609 2.16166 -232.61056 515.82144
2475.0000 -238.38155 -231.92460 6.45696 2.21250 -231.55948 544.60985
2480.0000 -237.70507 -231.07040 6.63467 2.23233 -231.14942 552.45053
2485.0000 -238.79060 -231.88634 6.90426 2.21605 -231.48610 540.23802
2490.0000 -238.63612 -232.42866 6.20746 2.18145 -232.20134 546.18422
2495.0000 -239.59393 -232.74154 6.85238 2.16658 -232.50865 530.28734
2500.0000 -238.53696 -231.52518 7.01178 2.21262 -231.55701 536.03299
MELTING PROCESS: loop number 11 T-loop= 554.00000000000000
main_MD> interactions number 11 at Temperature= 554.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.79793 -0.67572 -2.41300
force_rgl> df(natom) 0.39457 0.69917 -0.77817
2505.0000 -238.65487 -231.81521 6.83966 2.21124 -231.58545 551.82515
2510.0000 -237.69443 -231.52688 6.16755 2.22024 -231.39947 549.71205
2515.0000 -237.72256 -232.56381 5.15875 2.18728 -232.08073 510.54291
2520.0000 -237.92245 -232.03804 5.88440 2.16845 -232.47016 515.29193
2525.0000 -238.69574 -231.16613 7.52961 2.21322 -231.54450 563.60645
2530.0000 -237.24324 -231.32887 5.91437 2.22331 -231.33598 547.09721
2535.0000 -237.92409 -230.82205 7.10203 2.19928 -231.83271 507.15488
2540.0000 -237.16720 -230.47152 6.69568 2.25919 -230.59419 547.67776
2545.0000 -236.68063 -230.78653 5.89410 2.28027 -230.15833 565.03034
2550.0000 -237.48013 -231.08671 6.39342 2.27916 -230.18121 566.26243
2555.0000 -236.77879 -230.23590 6.54289 2.26219 -230.53215 543.06878
2560.0000 -238.51811 -232.40456 6.11355 2.23259 -231.14407 543.32225
2565.0000 -239.00259 -232.51913 6.48346 2.19526 -231.91579 537.06908
2570.0000 -238.90344 -232.11514 6.78830 2.17257 -232.38482 514.03749
2575.0000 -238.27330 -231.63931 6.63399 2.21253 -231.55873 541.25922
2580.0000 -237.70578 -230.23227 7.47350 2.27215 -230.32618 580.16734
2585.0000 -237.90284 -232.00340 5.89945 2.23097 -231.17758 551.28977
2590.0000 -237.67003 -231.61977 6.05026 2.18187 -232.19273 530.44002
2595.0000 -238.28721 -232.21040 6.07681 2.21654 -231.47595 541.43629
2600.0000 -239.25183 -232.88923 6.36260 2.15302 -232.78916 497.38890
2605.0000 -238.54226 -232.12341 6.41885 2.13220 -233.21953 494.60990
2610.0000 -238.52779 -230.99350 7.53429 2.21998 -231.40474 557.58132
2615.0000 -237.57451 -230.35871 7.21580 2.25000 -230.78422 582.82993
2620.0000 -238.50277 -231.71746 6.78531 2.27968 -230.17050 576.75581
2625.0000 -238.89493 -231.27549 7.61944 2.21628 -231.48127 545.44817
2630.0000 -236.94113 -230.37133 6.56980 2.22839 -231.23098 537.33976
2635.0000 -237.87243 -231.08934 6.78309 2.23603 -231.07295 555.62232
2640.0000 -237.42801 -230.96940 6.45861 2.24043 -230.98196 546.10687
2645.0000 -236.43019 -229.09237 7.33781 2.28011 -230.16160 573.69335
2650.0000 -237.27138 -230.02916 7.24222 2.28630 -230.03363 581.45472
2655.0000 -237.75796 -231.24960 6.50836 2.28247 -230.11281 581.49632
2660.0000 -236.99257 -229.97528 7.01728 2.23742 -231.04416 558.24953
2665.0000 -237.79203 -230.66994 7.12209 2.29858 -229.77981 587.14147
2670.0000 -238.10108 -231.35738 6.74370 2.23671 -231.05896 574.87899
2675.0000 -238.51132 -232.13626 6.37506 2.22931 -231.21190 565.23593
2680.0000 -238.45693 -230.66894 7.78798 2.22141 -231.37511 547.83552
2685.0000 -236.82746 -231.32115 5.50631 2.26031 -230.57101 565.27577
2690.0000 -237.61738 -231.44828 6.16910 2.25029 -230.77818 548.29183
2695.0000 -237.89680 -231.58716 6.30965 2.20267 -231.76259 498.83381
2700.0000 -238.39036 -232.36583 6.02453 2.19261 -231.97066 512.19497
2705.0000 -237.42413 -230.21723 7.20690 2.23776 -231.03726 546.30674
2710.0000 -237.31198 -230.43530 6.87668 2.28236 -230.11516 574.99319
2715.0000 -236.43557 -229.77916 6.65641 2.26757 -230.42080 587.55448
2720.0000 -238.83474 -232.92122 5.91352 2.23916 -231.00821 577.90287
2725.0000 -237.46415 -230.61901 6.84514 2.20325 -231.75054 541.86559
2730.0000 -237.92363 -230.91468 7.00894 2.23956 -230.99999 562.69476
2735.0000 -239.00155 -231.29982 7.70173 2.22974 -231.20308 563.40726
2740.0000 -239.08090 -232.19410 6.88679 2.22143 -231.37488 564.06104
2745.0000 -238.54114 -231.53146 7.00968 2.18434 -232.14150 538.59505
2750.0000 -239.64062 -231.38862 8.25200 2.20313 -231.75321 571.45757
MELTING PROCESS: loop number 12 T-loop= 579.00000000000000
main_MD> interactions number 12 at Temperature= 579.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.83001 -2.06954 1.17907
force_rgl> df(natom) -1.02842 -2.47908 -0.07604
2755.0000 -239.12155 -232.31564 6.80592 2.16873 -232.46426 546.38284
2760.0000 -238.54059 -231.85691 6.68368 2.18964 -232.03204 569.40702
2765.0000 -238.66495 -231.14508 7.51987 2.20769 -231.65875 570.88275
2770.0000 -238.37296 -232.12230 6.25066 2.19826 -231.85377 563.63344
2775.0000 -239.35245 -232.35188 7.00057 2.17696 -232.29413 548.36082
2780.0000 -238.30351 -231.61187 6.69164 2.19146 -231.99428 563.88403
2785.0000 -239.66930 -233.09372 6.57559 2.20754 -231.66196 572.02169
2790.0000 -239.84470 -233.40245 6.44225 2.15717 -232.70334 552.75353
2795.0000 -239.60085 -232.89927 6.70158 2.13881 -233.08281 522.89436
2800.0000 -238.15270 -231.03681 7.11589 2.18874 -232.05051 548.85596
2805.0000 -238.39903 -231.11712 7.28191 2.24498 -230.88786 566.64350
2810.0000 -236.70881 -229.33036 7.37845 2.27639 -230.23853 585.72275
2815.0000 -237.54710 -230.50038 7.04672 2.27635 -230.23930 568.40528
2820.0000 -236.56219 -229.45756 7.10463 2.27120 -230.34593 570.17383
2825.0000 -237.41350 -229.11514 8.29837 2.31625 -229.41455 596.80773
2830.0000 -238.06316 -230.17181 7.89135 2.30799 -229.58533 608.77397
2835.0000 -237.57143 -230.62118 6.95025 2.27045 -230.36140 577.25031
2840.0000 -236.94548 -229.48762 7.45786 2.30988 -229.54618 604.52354
2845.0000 -237.08393 -230.21384 6.87009 2.30644 -229.61739 584.64743
2850.0000 -236.41332 -229.74388 6.66945 2.28058 -230.15197 555.05070
2855.0000 -236.28814 -227.85078 8.43736 2.34679 -228.78303 605.24269
2860.0000 -237.13563 -229.61950 7.51613 2.36146 -228.47981 623.75813
2865.0000 -236.99158 -230.00413 6.98745 2.28556 -230.04888 580.20847
2870.0000 -236.78401 -229.43899 7.34502 2.31456 -229.44944 630.56183
2875.0000 -237.78427 -230.83259 6.95168 2.25643 -230.65121 590.34542
2880.0000 -238.59144 -232.13448 6.45695 2.21191 -231.57170 561.98332
2885.0000 -238.14954 -231.37194 6.77760 2.20142 -231.78843 543.38392
2890.0000 -236.24370 -230.08018 6.16351 2.26685 -230.43581 577.44872
2895.0000 -238.13067 -229.67103 8.45964 2.31761 -229.38637 592.93490
2900.0000 -236.69031 -229.90741 6.78290 2.29085 -229.93969 567.48951
2905.0000 -236.14185 -229.32254 6.81931 2.30430 -229.66146 593.27549
2910.0000 -236.92027 -229.67446 7.24580 2.32455 -229.24298 577.47517
2915.0000 -235.60962 -227.68731 7.92231 2.32610 -229.21077 584.11081
2920.0000 -236.86912 -228.96110 7.90803 2.33562 -229.01401 591.08320
2925.0000 -237.93149 -229.88880 8.04269 2.31956 -229.34612 581.87419
2930.0000 -237.01957 -230.60141 6.41816 2.24278 -230.93335 530.09925
2935.0000 -235.87590 -228.01035 7.86555 2.32805 -229.17054 604.15386
2940.0000 -236.58780 -229.27236 7.31544 2.34725 -228.77360 609.49842
2945.0000 -236.47808 -229.67902 6.79906 2.32992 -229.13190 592.47880
2950.0000 -237.30039 -229.77351 7.52688 2.32541 -229.22522 596.32787
2955.0000 -235.24228 -228.28913 6.95314 2.34978 -228.72122 627.17072
2960.0000 -236.03015 -229.11391 6.91624 2.36893 -228.32532 617.55555
2965.0000 -237.12629 -230.42030 6.70599 2.32809 -229.16963 600.32971
2970.0000 -238.08556 -231.42328 6.66228 2.24710 -230.84415 566.33992
2975.0000 -237.58362 -230.20603 7.37759 2.27841 -230.19681 592.33788
2980.0000 -237.16155 -230.20046 6.96109 2.27148 -230.34008 570.47679
2985.0000 -237.78014 -229.37641 8.40373 2.28439 -230.07310 581.32568
2990.0000 -236.49034 -229.59267 6.89766 2.30861 -229.57236 605.67835
2995.0000 -237.61754 -230.62236 6.99518 2.25899 -230.59831 573.34504
3000.0000 -237.12180 -229.38493 7.73688 2.25792 -230.62043 577.52161
MELTING PROCESS: loop number 13 T-loop= 604.00000000000000
main_MD> interactions number 13 at Temperature= 604.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.53808 -3.04899 5.17765
force_rgl> df(natom) -0.58132 0.33872 -3.54597
3005.0000 -238.00804 -228.67566 9.33238 2.34224 -228.87720 610.70040
3010.0000 -238.22164 -231.07146 7.15018 2.29640 -229.82493 612.75732
3015.0000 -237.09569 -230.33048 6.76520 2.24194 -230.95073 567.87810
3020.0000 -237.46566 -229.80036 7.66530 2.29464 -229.86135 601.48955
3025.0000 -236.06932 -229.70628 6.36305 2.31666 -229.40609 603.47182
3030.0000 -236.20331 -228.75524 7.44807 2.32802 -229.17109 599.83233
3035.0000 -236.43788 -228.81058 7.62730 2.34555 -228.80878 603.58365
3040.0000 -235.60185 -227.06743 8.53442 2.36673 -228.37086 624.53104
3045.0000 -234.60211 -227.90708 6.69503 2.37116 -228.27940 620.40821
3050.0000 -236.20220 -227.61242 8.58977 2.38464 -228.00067 636.22461
3055.0000 -235.48537 -226.74806 8.73731 2.40612 -227.55649 632.92651
3060.0000 -235.90922 -227.61606 8.29315 2.40191 -227.64361 644.92489
3065.0000 -236.28425 -229.65844 6.62581 2.35094 -228.69725 619.46083
3070.0000 -234.87953 -226.98550 7.89403 2.39959 -227.69161 636.70981
3075.0000 -235.90888 -229.95434 5.95454 2.39912 -227.70126 641.51687
3080.0000 -235.58797 -228.61920 6.96877 2.32934 -229.14390 597.81862
3085.0000 -238.45663 -230.39545 8.06118 2.32323 -229.27022 615.91998
3090.0000 -236.99939 -229.53888 7.46052 2.25011 -230.78195 591.57111
3095.0000 -237.26992 -228.97693 8.29300 2.29757 -229.80070 606.70404
3100.0000 -237.73386 -229.86158 7.87228 2.30717 -229.60225 598.95771
3105.0000 -237.00997 -229.86722 7.14274 2.28322 -230.09735 583.64790
3110.0000 -236.58735 -229.91721 6.67015 2.30211 -229.70690 588.40770
3115.0000 -236.66689 -230.12225 6.54464 2.25953 -230.58721 574.93938
3120.0000 -236.90271 -229.68105 7.22166 2.30393 -229.66912 607.97020
3125.0000 -236.10446 -228.85910 7.24536 2.30954 -229.55326 584.15352
3130.0000 -236.57743 -229.49266 7.08477 2.32368 -229.26093 597.25753
3135.0000 -237.35381 -231.20612 6.14768 2.24731 -230.83985 546.08036
3140.0000 -237.80893 -231.40076 6.40818 2.25312 -230.71956 579.14702
3145.0000 -237.46024 -230.94976 6.51048 2.22336 -231.33487 549.24627
3150.0000 -237.05387 -230.13022 6.92365 2.27699 -230.22611 577.77427
3155.0000 -237.37156 -230.56072 6.81084 2.28420 -230.07700 581.22896
3160.0000 -237.70978 -230.03114 7.67864 2.29209 -229.91407 570.08913
3165.0000 -236.24207 -229.03999 7.20208 2.31317 -229.47810 588.98372
3170.0000 -236.18214 -229.32206 6.86009 2.29673 -229.81795 595.32261
3175.0000 -237.11338 -228.98523 8.12815 2.33034 -229.12319 608.01479
3180.0000 -236.70497 -228.78631 7.91866 2.30710 -229.60364 576.03544
3185.0000 -236.38002 -229.24843 7.13159 2.35244 -228.66624 606.90455
3190.0000 -236.04569 -228.73235 7.31334 2.33894 -228.94539 596.80123
3195.0000 -236.37330 -229.02944 7.34386 2.31720 -229.39488 581.17535
3200.0000 -236.36905 -228.96537 7.40369 2.36594 -228.38724 620.88467
3205.0000 -238.01465 -230.00254 8.01211 2.30021 -229.74619 586.89883
3210.0000 -236.91679 -229.50989 7.40689 2.30087 -229.73241 604.83868
3215.0000 -237.43279 -230.65431 6.77848 2.27128 -230.34418 565.76568
3220.0000 -237.32020 -230.63738 6.68282 2.27002 -230.37020 561.11803
3225.0000 -238.11546 -231.07058 7.04488 2.22123 -231.37898 528.95161
3230.0000 -237.55441 -229.80117 7.75324 2.25708 -230.63784 570.61487
3235.0000 -237.46992 -229.51570 7.95422 2.28360 -230.08943 591.30019
3240.0000 -236.24019 -230.32591 5.91428 2.29152 -229.92571 591.62267
3245.0000 -236.70470 -230.16358 6.54112 2.29125 -229.93132 579.90472
3250.0000 -236.69605 -230.66154 6.03451 2.25098 -230.76386 554.77659
MELTING PROCESS: loop number 14 T-loop= 629.00000000000000
main_MD> interactions number 14 at Temperature= 629.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.50348 0.05081 3.10648
force_rgl> df(natom) 1.74535 1.79434 -0.85983
3255.0000 -236.88310 -228.13701 8.74609 2.32372 -229.26015 589.18065
3260.0000 -236.28552 -228.53250 7.75301 2.34428 -228.83492 614.87525
3265.0000 -236.20915 -229.31739 6.89176 2.31570 -229.42577 600.60787
3270.0000 -236.04539 -227.27393 8.77146 2.36917 -228.32040 612.17252
3275.0000 -234.47806 -226.38736 8.09070 2.44747 -226.70176 671.16709
3280.0000 -234.99734 -227.18716 7.81018 2.42238 -227.22043 640.93012
3285.0000 -235.31770 -226.85092 8.46678 2.41838 -227.30303 639.83471
3290.0000 -235.82976 -228.25142 7.57834 2.39866 -227.71069 642.68367
3295.0000 -236.34819 -228.83887 7.50932 2.33701 -228.98528 605.82240
3300.0000 -235.95593 -228.29511 7.66082 2.33771 -228.97087 605.62121
3305.0000 -235.31037 -227.97314 7.33723 2.39498 -227.78693 641.68795
3310.0000 -235.59055 -227.73169 7.85887 2.39735 -227.73790 633.73808
3315.0000 -235.55463 -227.37046 8.18417 2.38515 -227.99009 638.37780
3320.0000 -237.11896 -229.57655 7.54240 2.37010 -228.30122 611.67991
3325.0000 -236.68895 -228.95274 7.73621 2.32759 -229.18004 604.64953
3330.0000 -235.46545 -227.60546 7.85998 2.35396 -228.63487 614.55390
3335.0000 -234.88304 -227.85583 7.02720 2.39902 -227.70338 642.95151
3340.0000 -237.18390 -228.42461 8.75929 2.39915 -227.70065 635.95131
3345.0000 -236.70020 -227.31887 9.38133 2.35199 -228.67561 624.18080
3350.0000 -236.02431 -229.14786 6.87645 2.36015 -228.50685 627.67305
3355.0000 -235.98097 -229.03316 6.94781 2.32662 -229.20008 599.68063
3360.0000 -236.84513 -229.41645 7.42869 2.32451 -229.24383 593.90135
3365.0000 -237.31517 -229.84357 7.47159 2.32860 -229.15914 584.25960
3370.0000 -236.89854 -229.26380 7.63473 2.31893 -229.35908 604.13396
3375.0000 -237.04315 -229.10869 7.93445 2.34824 -228.75305 624.96844
3380.0000 -235.61623 -228.22078 7.39546 2.35924 -228.52578 619.20649
3385.0000 -236.42358 -228.48827 7.93531 2.34410 -228.83882 607.89326
3390.0000 -235.59000 -229.17005 6.41994 2.34058 -228.91142 628.25379
3395.0000 -236.09828 -228.92406 7.17422 2.31098 -229.52338 598.01962
3400.0000 -237.35401 -229.10362 8.25039 2.32824 -229.16672 606.28436
3405.0000 -234.90028 -227.05690 7.84338 2.40458 -227.58835 677.90251
3410.0000 -234.94399 -226.53506 8.40893 2.42599 -227.14587 687.12162
3415.0000 -234.24987 -226.91390 7.33597 2.44443 -226.76448 672.97847
3420.0000 -235.75780 -226.45248 9.30532 2.45031 -226.64302 684.79737
3425.0000 -235.14660 -226.92892 8.21768 2.46416 -226.35667 686.17577
3430.0000 -237.55688 -229.59088 7.96600 2.36310 -228.44589 625.04546
3435.0000 -236.64005 -229.06198 7.57807 2.28903 -229.97723 571.30014
3440.0000 -235.88203 -228.48717 7.39485 2.34683 -228.78220 601.09550
3445.0000 -235.90680 -228.49181 7.41499 2.36867 -228.33088 632.62907
3450.0000 -235.21994 -227.19258 8.02736 2.35772 -228.55718 630.17578
3455.0000 -236.34968 -228.50151 7.84818 2.40360 -227.60871 647.16571
3460.0000 -237.01584 -228.38267 8.63317 2.36799 -228.34495 624.53583
3465.0000 -236.24367 -228.80361 7.44006 2.37435 -228.21340 643.39909
3470.0000 -236.66952 -228.30297 8.36654 2.37007 -228.30175 627.43931
3475.0000 -237.08448 -229.07226 8.01222 2.38886 -227.91332 635.29489
3480.0000 -236.90630 -229.03130 7.87500 2.33285 -229.07142 613.77972
3485.0000 -236.45003 -229.15118 7.29885 2.31003 -229.54318 598.47425
3490.0000 -236.42993 -229.46106 6.96887 2.33561 -229.01425 601.35065
3495.0000 -235.40085 -227.97682 7.42403 2.33003 -229.12956 599.29204
3500.0000 -235.45696 -227.51227 7.94469 2.39870 -227.71003 654.35763
MELTING PROCESS: loop number 15 T-loop= 654.00000000000000
main_MD> interactions number 15 at Temperature= 654.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.60881 1.92591 -1.11924
force_rgl> df(natom) 0.43572 -1.49990 -1.57325
3505.0000 -234.14020 -225.87480 8.26540 2.44999 -226.64954 675.79086
3510.0000 -234.53214 -227.09356 7.43858 2.44344 -226.78508 661.73221
3515.0000 -236.92590 -228.33462 8.59128 2.35406 -228.63292 621.18218
3520.0000 -235.56523 -229.08462 6.48061 2.35393 -228.63559 617.72296
3525.0000 -235.64963 -228.12573 7.52389 2.33966 -228.93044 602.61630
3530.0000 -235.08142 -227.09992 7.98150 2.39723 -227.74041 623.72150
3535.0000 -235.89175 -227.48830 8.40345 2.41249 -227.42490 651.27252
3540.0000 -233.92708 -226.75745 7.16963 2.43525 -226.95443 654.89925
3545.0000 -235.42031 -227.66061 7.75969 2.46241 -226.39284 690.30249
3550.0000 -235.30746 -226.96210 8.34536 2.42714 -227.12208 663.05020
3555.0000 -235.66812 -228.12367 7.54446 2.41287 -227.41700 668.10020
3560.0000 -235.05514 -228.30116 6.75398 2.35838 -228.54357 617.20323
3565.0000 -235.87535 -227.99468 7.88067 2.37636 -228.17184 625.98778
3570.0000 -235.95044 -228.43471 7.51573 2.35683 -228.57566 628.77071
3575.0000 -235.60544 -229.11618 6.48926 2.37254 -228.25074 653.63576
3580.0000 -235.93801 -227.40079 8.53722 2.40387 -227.60300 638.56616
3585.0000 -235.19922 -226.96361 8.23561 2.39240 -227.84019 625.56345
3590.0000 -235.97132 -227.73202 8.23930 2.41398 -227.39414 653.16816
3595.0000 -235.97139 -227.97038 8.00101 2.37133 -228.27575 626.33829
3600.0000 -233.55130 -225.54802 8.00328 2.45413 -226.56409 675.52379
3605.0000 -234.88117 -226.68151 8.19966 2.44781 -226.69467 680.57706
3610.0000 -235.55469 -226.82449 8.73020 2.46978 -226.24052 691.22606
3615.0000 -235.60961 -227.61197 7.99764 2.38327 -228.02899 641.12929
3620.0000 -236.73057 -228.14096 8.58960 2.40478 -227.58419 659.30212
3625.0000 -236.13302 -228.05829 8.07473 2.38299 -228.03474 655.48260
3630.0000 -234.91439 -227.00272 7.91167 2.39184 -227.85172 621.80853
3635.0000 -235.80199 -227.49556 8.30644 2.43740 -226.90998 663.01534
3640.0000 -232.99212 -224.74631 8.24581 2.43277 -227.00554 668.22106
3645.0000 -234.78262 -226.09715 8.68547 2.52070 -225.18770 707.68492
3650.0000 -235.39119 -227.60526 7.78593 2.45200 -226.60808 686.12048
3655.0000 -235.25230 -227.23095 8.02135 2.42259 -227.21612 646.94749
3660.0000 -236.34744 -228.53174 7.81570 2.39059 -227.87772 663.92152
3665.0000 -236.11237 -228.78814 7.32423 2.36827 -228.33902 638.77529
3670.0000 -234.61838 -227.39717 7.22122 2.37209 -228.26003 628.41848
3675.0000 -235.97575 -227.19324 8.78251 2.41139 -227.44767 658.76271
3680.0000 -234.97885 -227.23797 7.74088 2.39861 -227.71176 663.85839
3685.0000 -234.44047 -226.93589 7.50459 2.46080 -226.42617 658.95382
3690.0000 -236.02810 -228.53895 7.48915 2.36994 -228.30450 630.64034
3695.0000 -235.30942 -228.03379 7.27564 2.38084 -228.07913 629.95447
3700.0000 -235.52951 -228.24826 7.28125 2.34140 -228.89458 597.76683
3705.0000 -235.46861 -228.26952 7.19909 2.41352 -227.40355 647.20686
3710.0000 -235.69948 -227.63616 8.06332 2.39528 -227.78074 644.98707
3715.0000 -236.47240 -227.72890 8.74350 2.38806 -227.92992 647.83048
3720.0000 -235.82417 -227.53246 8.29171 2.38924 -227.90550 652.12332
3725.0000 -234.97361 -227.13534 7.83827 2.43702 -226.91774 663.23840
3730.0000 -234.89874 -228.07140 6.82734 2.36746 -228.35581 623.52063
3735.0000 -236.38227 -228.77077 7.61149 2.39359 -227.81551 650.35610
3740.0000 -236.13246 -228.61694 7.51552 2.38874 -227.91588 649.85500
3745.0000 -236.56693 -229.35201 7.21492 2.33429 -229.04147 603.98342
3750.0000 -235.94302 -228.51123 7.43178 2.34268 -228.86816 612.91630
MELTING PROCESS: loop number 16 T-loop= 679.00000000000000
main_MD> interactions number 16 at Temperature= 679.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.75830 1.36583 0.20180
force_rgl> df(natom) -1.71199 -1.37603 0.07387
3755.0000 -235.56338 -227.52101 8.04237 2.37322 -228.23668 651.23528
3760.0000 -233.98424 -225.46882 8.51541 2.47426 -226.14776 702.48372
3765.0000 -235.25029 -226.48762 8.76267 2.50286 -225.55657 712.24400
3770.0000 -233.27982 -224.65768 8.62214 2.49205 -225.78006 689.26075
3775.0000 -233.88675 -225.61020 8.27655 2.50144 -225.58589 717.94367
3780.0000 -234.89430 -226.99159 7.90271 2.47471 -226.13865 679.41596
3785.0000 -235.03344 -226.32121 8.71223 2.42910 -227.08150 652.45404
3790.0000 -234.72438 -226.55963 8.16475 2.44388 -226.77594 685.09914
3795.0000 -236.27532 -227.57729 8.69803 2.39109 -227.86737 651.51896
3800.0000 -235.59953 -226.94554 8.65398 2.43843 -226.88851 699.29994
3805.0000 -235.42126 -226.94256 8.47870 2.43540 -226.95119 659.37926
3810.0000 -234.82684 -225.66331 9.16352 2.47800 -226.07045 668.96815
3815.0000 -234.75132 -226.65499 8.09633 2.46900 -226.25665 705.96573
3820.0000 -234.37904 -224.71688 9.66216 2.47821 -226.06612 691.38753
3825.0000 -234.80439 -226.05840 8.74599 2.50229 -225.56846 693.97075
3830.0000 -234.28439 -225.65345 8.63094 2.50054 -225.60455 704.30619
3835.0000 -235.23502 -227.09671 8.13831 2.49002 -225.82201 703.70439
3840.0000 -235.39425 -228.20868 7.18557 2.41978 -227.27412 643.80534
3845.0000 -236.83444 -227.76939 9.06504 2.41140 -227.44748 668.98280
3850.0000 -235.90059 -228.48408 7.41651 2.38628 -227.96665 638.89251
3855.0000 -233.86707 -226.20282 7.66425 2.41358 -227.40241 646.23632
3860.0000 -234.65099 -227.55986 7.09113 2.42665 -227.13207 662.93368
3865.0000 -236.16928 -227.67713 8.49215 2.39504 -227.78572 647.27048
3870.0000 -234.69802 -226.35940 8.33863 2.40206 -227.64045 656.04636
3875.0000 -234.25273 -225.37865 8.87408 2.47735 -226.08399 704.32518
3880.0000 -233.98593 -225.01866 8.96727 2.50359 -225.54159 715.15609
3885.0000 -234.84080 -227.15571 7.68510 2.49570 -225.70450 700.02124
3890.0000 -234.82990 -227.44679 7.38311 2.42841 -227.09582 660.00865
3895.0000 -235.07876 -226.17339 8.90537 2.43242 -227.01289 662.38364
3900.0000 -235.16953 -225.98679 9.18274 2.49206 -225.77986 719.73423
3905.0000 -234.64813 -225.32160 9.32653 2.47999 -226.02945 693.05474
3910.0000 -235.26444 -226.33148 8.93296 2.46060 -226.43035 691.44359
3915.0000 -235.21691 -226.51687 8.70003 2.48296 -225.96800 702.49740
3920.0000 -235.09672 -227.57814 7.51857 2.41378 -227.39813 661.63548
3925.0000 -235.44107 -225.74019 9.70088 2.47190 -226.19665 688.01953
3930.0000 -234.62937 -225.93393 8.69544 2.50626 -225.48624 715.88282
3935.0000 -234.65235 -225.62183 9.03053 2.51951 -225.21244 712.57143
3940.0000 -234.94083 -227.08806 7.85276 2.44705 -226.71036 655.52259
3945.0000 -235.89353 -228.37633 7.51721 2.39563 -227.77332 618.42115
3950.0000 -236.84008 -229.54629 7.29379 2.35042 -228.70817 624.90493
3955.0000 -235.36459 -227.32381 8.04079 2.37303 -228.24071 637.01644
3960.0000 -234.02435 -226.54378 7.48058 2.40948 -227.48705 655.62985
3965.0000 -234.51928 -225.01943 9.49985 2.53898 -224.80985 713.32926
3970.0000 -233.74061 -224.42774 9.31286 2.50902 -225.42924 710.48251
3975.0000 -234.23436 -226.34204 7.89232 2.49715 -225.67472 706.26280
3980.0000 -234.81983 -226.65563 8.16419 2.44458 -226.76146 683.30153
3985.0000 -237.34146 -228.24955 9.09191 2.42888 -227.08601 701.56597
3990.0000 -236.01082 -227.32974 8.68108 2.39285 -227.83090 663.68958
3995.0000 -235.60308 -228.43949 7.16359 2.40061 -227.67040 652.02310
4000.0000 -234.80780 -227.17013 7.63767 2.39067 -227.87587 652.14655
MELTING PROCESS: loop number 17 T-loop= 704.00000000000000
main_MD> interactions number 17 at Temperature= 704.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.74497 0.17324 1.13615
force_rgl> df(natom) -0.42795 2.30417 1.46774
4005.0000 -233.76893 -225.09671 8.67222 2.49213 -225.77836 714.00073
4010.0000 -233.03107 -223.74838 9.28269 2.55858 -224.40464 741.64606
4015.0000 -234.83373 -223.82017 11.01356 2.60233 -223.50012 774.08095
4020.0000 -234.50296 -226.26307 8.23989 2.50886 -225.43261 732.95571
4025.0000 -234.11790 -225.69825 8.41965 2.46709 -226.29609 693.09032
4030.0000 -233.27424 -225.20126 8.07298 2.48724 -225.87943 683.92590
4035.0000 -233.22356 -225.08402 8.13954 2.51072 -225.39406 713.53860
4040.0000 -234.64752 -225.76567 8.88185 2.49818 -225.65329 723.51566
4045.0000 -234.82075 -226.00239 8.81836 2.48129 -226.00249 705.91180
4050.0000 -234.13279 -225.35955 8.77324 2.48645 -225.89593 702.13987
4055.0000 -234.51119 -225.91193 8.59926 2.49187 -225.78378 695.56758
4060.0000 -236.06741 -228.18730 7.88012 2.41442 -227.38501 648.08977
4065.0000 -235.21685 -226.27715 8.93970 2.42131 -227.24252 691.06782
4070.0000 -233.66606 -225.68754 7.97852 2.48428 -225.94065 701.63413
4075.0000 -235.43750 -227.04148 8.39601 2.44359 -226.78199 677.28554
4080.0000 -236.37522 -227.58459 8.79062 2.42707 -227.12335 677.63173
4085.0000 -234.84265 -227.26905 7.57359 2.40888 -227.49942 662.12379
4090.0000 -233.89258 -225.78360 8.10898 2.43333 -226.99407 664.42633
4095.0000 -235.30756 -225.62567 9.68189 2.50642 -225.48300 709.87555
4100.0000 -234.18220 -225.67236 8.50985 2.50136 -225.58761 704.53776
4105.0000 -232.99858 -224.58863 8.40995 2.52060 -225.18993 700.98628
4110.0000 -235.32319 -227.85162 7.47157 2.49536 -225.71165 723.27811
4115.0000 -236.24768 -228.15924 8.08844 2.40080 -227.66648 642.67565
4120.0000 -235.30681 -226.44551 8.86131 2.41986 -227.27246 657.55844
4125.0000 -235.16071 -227.21589 7.94482 2.41423 -227.38896 652.28006
4130.0000 -234.92406 -227.49164 7.43242 2.41079 -227.46002 635.68821
4135.0000 -234.91760 -227.01549 7.90211 2.44354 -226.78288 671.50899
4140.0000 -235.18031 -227.26611 7.91420 2.40844 -227.50851 669.42576
4145.0000 -234.22691 -225.83746 8.38944 2.41968 -227.27618 677.72821
4150.0000 -233.72932 -225.96888 7.76044 2.46828 -226.27139 700.47008
4155.0000 -234.84032 -225.84153 8.99880 2.41530 -227.36667 657.41125
4160.0000 -234.41662 -225.86122 8.55540 2.48857 -225.85198 693.29340
4165.0000 -234.65864 -225.85814 8.80050 2.47942 -226.04117 681.12702
4170.0000 -233.18308 -224.20029 8.98279 2.53718 -224.84706 695.86880
4175.0000 -233.06108 -224.54682 8.51426 2.60642 -223.41564 740.71272
4180.0000 -233.98257 -223.92517 10.05740 2.55200 -224.54070 718.70821
4185.0000 -233.97669 -225.27571 8.70099 2.58175 -223.92558 750.06491
4190.0000 -233.03826 -223.19560 9.84266 2.54872 -224.60848 736.80691
4195.0000 -233.85305 -224.25815 9.59490 2.54663 -224.65169 731.70462
4200.0000 -233.90886 -224.90867 9.00019 2.51733 -225.25736 715.31650
4205.0000 -232.17514 -223.72910 8.44604 2.55530 -224.47243 731.82275
4210.0000 -234.58061 -225.47208 9.10853 2.56035 -224.36815 741.66967
4215.0000 -234.05048 -225.36125 8.68923 2.49217 -225.77751 708.91710
4220.0000 -233.61868 -224.57460 9.04408 2.46447 -226.35018 681.33030
4225.0000 -233.14420 -223.75369 9.39051 2.57365 -224.09317 740.41526
4230.0000 -233.91743 -226.12480 7.79263 2.51771 -225.24964 710.48270
4235.0000 -234.20756 -225.52888 8.67867 2.46483 -226.34288 682.77984
4240.0000 -233.39312 -223.69795 9.69517 2.54077 -224.77293 719.57276
4245.0000 -233.34521 -224.47811 8.86711 2.54814 -224.62039 748.42696
4250.0000 -233.88510 -224.32154 9.56356 2.54673 -224.64972 717.67517
MELTING PROCESS: loop number 18 T-loop= 729.00000000000000
main_MD> interactions number 18 at Temperature= 729.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.71179 -4.01092 2.07100
force_rgl> df(natom) 0.34704 -0.48648 -0.62622
4255.0000 -233.37471 -224.05754 9.31716 2.60404 -223.46484 777.65332
4260.0000 -231.82575 -223.94305 7.88269 2.57708 -224.02209 749.08122
4265.0000 -231.57584 -223.43135 8.14449 2.58935 -223.76852 763.86927
4270.0000 -233.06475 -224.70827 8.35649 2.57912 -223.98010 748.24517
4275.0000 -234.46158 -225.62844 8.83315 2.54062 -224.77590 747.79470
4280.0000 -234.51109 -226.24447 8.26662 2.52548 -225.08890 734.05081
4285.0000 -234.22675 -224.06156 10.16518 2.54650 -224.65433 725.91835
4290.0000 -233.56078 -225.18941 8.37137 2.52118 -225.17781 725.95445
4295.0000 -232.48218 -223.64822 8.83396 2.56644 -224.24213 748.42441
4300.0000 -233.47398 -224.11152 9.36246 2.56644 -224.24205 735.36800
4305.0000 -234.26433 -225.60990 8.65443 2.54791 -224.62514 713.61775
4310.0000 -232.80815 -224.90990 7.89825 2.51284 -225.35027 711.95346
4315.0000 -235.03322 -225.29398 9.73924 2.51426 -225.32090 696.93249
4320.0000 -233.19175 -224.33212 8.85963 2.54338 -224.71890 724.62493
4325.0000 -234.02953 -225.20921 8.82032 2.52936 -225.00877 722.87557
4330.0000 -232.78965 -222.96022 9.82943 2.57790 -224.00524 735.39458
4335.0000 -232.26078 -222.47483 9.78595 2.62581 -223.01465 771.29520
4340.0000 -233.80449 -224.23963 9.56486 2.62429 -223.04611 780.34145
4345.0000 -232.55152 -223.25893 9.29258 2.54772 -224.62923 740.64481
4350.0000 -233.22439 -223.33140 9.89298 2.60950 -223.35196 792.81768
4355.0000 -233.60182 -224.46684 9.13498 2.60018 -223.54460 768.70613
4360.0000 -233.16802 -224.68916 8.47885 2.54353 -224.71586 739.25797
4365.0000 -232.66306 -223.28375 9.37931 2.56300 -224.31332 736.76039
4370.0000 -232.92177 -224.37785 8.54391 2.56213 -224.33135 747.45274
4375.0000 -233.99171 -224.13696 9.85475 2.57238 -224.11937 734.55686
4380.0000 -232.76013 -224.39964 8.36050 2.57314 -224.10365 737.55452
4385.0000 -233.05789 -224.18335 8.87454 2.56512 -224.26936 732.20190
4390.0000 -233.72814 -225.28074 8.44740 2.53463 -224.89975 745.06176
4395.0000 -234.13652 -225.27200 8.86451 2.54837 -224.61572 731.02367
4400.0000 -235.32764 -226.53510 8.79254 2.50146 -225.58553 717.26787
4405.0000 -236.07753 -226.92890 9.14864 2.44015 -226.85301 674.58361
4410.0000 -234.42863 -225.68623 8.74240 2.47456 -226.14163 687.57935
4415.0000 -234.58754 -225.37265 9.21489 2.50664 -225.47846 709.32050
4420.0000 -233.34908 -225.41298 7.93609 2.51445 -225.31689 716.06645
4425.0000 -233.64779 -225.15505 8.49274 2.53012 -224.99292 720.63123
4430.0000 -234.58981 -225.47294 9.11687 2.48610 -225.90317 707.40128
4435.0000 -233.30352 -224.97729 8.32623 2.52005 -225.20112 707.88869
4440.0000 -233.74707 -224.34555 9.40152 2.54314 -224.72379 698.06411
4445.0000 -234.16856 -224.93659 9.23197 2.57866 -223.98961 765.59605
4450.0000 -231.31690 -223.97619 7.34071 2.57418 -224.08222 743.35302
4455.0000 -233.03658 -225.64157 7.39501 2.55833 -224.40973 732.67253
4460.0000 -232.65826 -224.93714 7.72113 2.52015 -225.19923 712.73275
4465.0000 -233.38522 -224.88774 8.49748 2.55141 -224.55280 704.03315
4470.0000 -233.56108 -224.43298 9.12810 2.56950 -224.17895 746.03388
4475.0000 -232.73526 -224.78947 7.94579 2.53304 -224.93263 706.25541
4480.0000 -234.68842 -225.95460 8.73382 2.47640 -226.10359 709.01431
4485.0000 -232.63516 -225.21277 7.42239 2.49562 -225.70617 682.86449
4490.0000 -233.84400 -224.49181 9.35220 2.53141 -224.96637 742.55713
4495.0000 -232.70609 -224.54532 8.16077 2.59396 -223.67314 749.22725
4500.0000 -235.67573 -226.77831 8.89741 2.48428 -225.94076 702.19548
MELTING PROCESS: loop number 19 T-loop= 754.00000000000000
main_MD> interactions number 19 at Temperature= 754.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.96394 1.32265 3.81364
force_rgl> df(natom) 0.15691 -2.72113 -0.23903
4505.0000 -233.86186 -224.55771 9.30416 2.48395 -225.94760 692.90550
4510.0000 -232.66486 -224.59436 8.07050 2.54625 -224.65946 738.87882
4515.0000 -232.52589 -223.35938 9.16651 2.58850 -223.78611 759.81889
4520.0000 -231.23860 -220.17910 11.05951 2.65457 -222.42015 777.70936
4525.0000 -232.03203 -222.35262 9.67941 2.72484 -220.96737 835.29609
4530.0000 -233.42487 -223.04816 10.37671 2.62978 -222.93273 795.27296
4535.0000 -230.61181 -220.97988 9.63193 2.67128 -222.07470 804.43183
4540.0000 -233.26211 -224.67509 8.58703 2.56147 -224.34490 752.83810
4545.0000 -230.85993 -222.52177 8.33816 2.59743 -223.60143 766.45658
4550.0000 -232.32610 -222.40896 9.91714 2.69778 -221.52688 822.30712
4555.0000 -233.50144 -225.02552 8.47591 2.60036 -223.54093 757.04619
4560.0000 -233.69627 -225.38256 8.31371 2.49695 -225.67882 705.64336
4565.0000 -232.89124 -224.11305 8.77819 2.56911 -224.18688 760.94449
4570.0000 -233.99426 -224.45266 9.54160 2.55562 -224.46590 746.41335
4575.0000 -233.30688 -224.16061 9.14628 2.58690 -223.81923 766.91183
4580.0000 -232.12671 -223.23895 8.88777 2.59206 -223.71246 759.26395
4585.0000 -232.89629 -224.66988 8.22641 2.59117 -223.73082 741.40061
4590.0000 -232.94757 -225.06284 7.88473 2.52621 -225.07392 734.00942
4595.0000 -234.51021 -225.95213 8.55807 2.53584 -224.87466 736.02808
4600.0000 -233.86258 -225.63703 8.22555 2.48187 -225.99060 676.98132
4605.0000 -234.47036 -225.26005 9.21031 2.50658 -225.47973 694.49400
4610.0000 -232.35531 -224.35391 8.00140 2.55608 -224.45629 755.63500
4615.0000 -232.59932 -224.41707 8.18225 2.60664 -223.41104 775.18639
4620.0000 -234.29186 -225.10897 9.18289 2.53929 -224.80343 721.42503
4625.0000 -235.38855 -225.20462 10.18393 2.53178 -224.95873 718.89525
4630.0000 -231.95212 -222.69880 9.25333 2.57199 -224.12731 741.10762
4635.0000 -232.92276 -223.38020 9.54256 2.59947 -223.55919 749.53417
4640.0000 -233.20978 -225.23899 7.97079 2.58220 -223.91628 775.95068
4645.0000 -233.58862 -224.21285 9.37576 2.54393 -224.70751 741.38699
4650.0000 -233.42225 -224.22669 9.19556 2.55494 -224.47984 747.99548
4655.0000 -231.79487 -221.27705 10.51783 2.59840 -223.58138 774.02951
4660.0000 -231.99453 -222.66106 9.33347 2.67862 -221.92302 820.41523
4665.0000 -233.75966 -224.23363 9.52603 2.62045 -223.12558 778.61165
4670.0000 -232.72728 -223.95813 8.76916 2.59510 -223.64969 738.00700
4675.0000 -232.67653 -223.69865 8.97788 2.62352 -223.06214 776.04872
4680.0000 -233.71379 -224.19886 9.51494 2.56771 -224.21579 744.63599
4685.0000 -235.88304 -225.55845 10.32459 2.55450 -224.48895 759.45084
4690.0000 -233.66406 -224.50979 9.15427 2.54132 -224.76154 747.84452
4695.0000 -234.86905 -226.17148 8.69756 2.53409 -224.91097 728.22323
4700.0000 -233.88059 -224.78474 9.09585 2.51719 -225.26035 739.02781
4705.0000 -232.38598 -222.87403 9.51195 2.61381 -223.26276 800.96966
4710.0000 -232.70545 -223.67134 9.03411 2.62970 -222.93429 788.84432
4715.0000 -233.37291 -224.34300 9.02991 2.56929 -224.18327 750.05949
4720.0000 -233.44545 -223.99571 9.44974 2.51843 -225.23460 697.71330
4725.0000 -232.31952 -222.75457 9.56495 2.60014 -223.54535 735.85045
4730.0000 -232.69058 -224.07025 8.62033 2.57827 -223.99753 745.24497
4735.0000 -232.97521 -222.67783 10.29737 2.58003 -223.96125 760.43176
4740.0000 -230.80876 -222.10697 8.70179 2.61587 -223.22017 773.62274
4745.0000 -233.66207 -224.20145 9.46062 2.66604 -222.18303 779.12067
4750.0000 -233.94153 -224.01137 9.93017 2.57126 -224.14248 743.75428
MELTING PROCESS: loop number 20 T-loop= 779.00000000000000
main_MD> interactions number 20 at Temperature= 779.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.53766 -0.82100 -0.89767
force_rgl> df(natom) -0.21676 -3.90584 -0.50597
4755.0000 -231.78312 -222.64058 9.14253 2.61525 -223.23305 775.62881
4760.0000 -232.21634 -222.70605 9.51029 2.66732 -222.15667 794.45952
4765.0000 -232.62557 -224.43740 8.18817 2.59673 -223.61599 760.52860
4770.0000 -231.53686 -223.59771 7.93915 2.59279 -223.69738 752.95580
4775.0000 -232.95630 -222.43964 10.51665 2.64948 -222.52545 788.12532
4780.0000 -232.29170 -222.15092 10.14078 2.67234 -222.05286 814.08433
4785.0000 -231.62936 -221.78606 9.84330 2.67186 -222.06276 811.41074
4790.0000 -231.38606 -221.75119 9.63486 2.73461 -220.76550 831.11152
4795.0000 -232.70637 -223.01160 9.69476 2.61642 -223.20890 773.99378
4800.0000 -233.12899 -223.45813 9.67086 2.60679 -223.40801 767.70371
4805.0000 -233.76591 -224.06309 9.70283 2.63625 -222.79900 787.93791
4810.0000 -232.45013 -223.25391 9.19622 2.59413 -223.66971 765.96555
4815.0000 -232.45879 -222.51712 9.94167 2.62864 -222.95629 789.75061
4820.0000 -234.41986 -225.71920 8.70066 2.58791 -223.79823 754.12249
4825.0000 -232.78085 -224.10379 8.67706 2.51128 -225.38260 720.94147
4830.0000 -233.98534 -224.40408 9.58126 2.55418 -224.49562 741.70946
4835.0000 -232.24098 -224.08473 8.15626 2.56544 -224.26286 745.45380
4840.0000 -233.24976 -223.63486 9.61490 2.56675 -224.23578 737.32107
4845.0000 -232.83970 -224.60537 8.23433 2.59015 -223.75193 752.10239
4850.0000 -232.22102 -223.16931 9.05171 2.59154 -223.72323 757.46960
4855.0000 -231.11063 -221.96872 9.14191 2.63722 -222.77895 781.36891
4860.0000 -231.63855 -222.50856 9.12999 2.69556 -221.57268 792.69475
4865.0000 -230.51072 -221.77857 8.73215 2.70398 -221.39874 821.28917
4870.0000 -232.59631 -221.49837 11.09794 2.66435 -222.21792 785.48985
4875.0000 -232.16966 -222.52072 9.64894 2.64874 -222.54062 775.95448
4880.0000 -232.64592 -222.99668 9.64924 2.62881 -222.95275 757.01224
4885.0000 -234.14164 -224.17726 9.96439 2.61544 -223.22915 770.48428
4890.0000 -233.28416 -224.93519 8.34897 2.54574 -224.67006 736.82414
4895.0000 -232.12447 -222.57362 9.55084 2.60284 -223.48967 751.96470
4900.0000 -232.57115 -222.09333 10.47782 2.64971 -222.52060 778.66753
4905.0000 -234.48644 -223.96421 10.52223 2.57668 -224.03041 759.90648
4910.0000 -233.46612 -224.04135 9.42477 2.56870 -224.19551 741.21895
4915.0000 -231.74590 -223.01611 8.72979 2.63763 -222.77041 782.04728
4920.0000 -233.81246 -224.73562 9.07684 2.60830 -223.37667 779.37234
4925.0000 -233.18963 -223.96992 9.21971 2.57813 -224.00056 759.83068
4930.0000 -231.67678 -222.62953 9.04725 2.62607 -223.00929 781.30979
4935.0000 -232.21728 -221.16780 11.04948 2.70425 -221.39307 829.64683
4940.0000 -231.56810 -220.87786 10.69024 2.76074 -220.22532 866.10690
4945.0000 -232.63080 -222.55724 10.07355 2.66871 -222.12782 803.14179
4950.0000 -233.84475 -225.29511 8.54963 2.56072 -224.36037 752.06068
4955.0000 -234.45259 -226.97098 7.48161 2.50264 -225.56114 719.83726
4960.0000 -234.55285 -226.06788 8.48497 2.48453 -225.93557 700.89752
4965.0000 -233.54688 -224.70858 8.83830 2.50496 -225.51312 706.10166
4970.0000 -232.73641 -223.74687 8.98954 2.59676 -223.61540 785.00456
4975.0000 -231.06062 -221.65117 9.40945 2.64871 -222.54128 793.58443
4980.0000 -231.78901 -221.59921 10.18980 2.67407 -222.01708 815.69208
4985.0000 -231.75256 -222.50889 9.24366 2.65433 -222.42504 799.80564
4990.0000 -231.56763 -223.31712 8.25052 2.64876 -222.54032 784.36490
4995.0000 -232.73366 -223.62560 9.10806 2.60787 -223.38572 790.23221
5000.0000 -232.30585 -221.84058 10.46527 2.64240 -222.67177 779.58994
MELTING PROCESS: loop number 21 T-loop= 804.00000000000000
main_MD> interactions number 21 at Temperature= 804.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.88386 6.24978 -5.55513
force_rgl> df(natom) -0.20929 3.92469 -0.85229
5005.0000 -234.01138 -225.68255 8.32882 2.56308 -224.31159 741.44540
5010.0000 -233.79704 -224.04335 9.75369 2.52490 -225.10085 718.45661
5015.0000 -233.20139 -223.92343 9.27796 2.60098 -223.52799 762.14757
5020.0000 -234.08727 -224.54095 9.54632 2.58081 -223.94504 743.73738
5025.0000 -233.36471 -224.64300 8.72171 2.54915 -224.59968 714.86961
5030.0000 -233.89519 -223.68112 10.21407 2.55609 -224.45614 731.65616
5035.0000 -234.60675 -224.37429 10.23246 2.53718 -224.84705 719.43402
5040.0000 -234.77409 -225.87060 8.90349 2.52057 -225.19040 720.48690
5045.0000 -232.40086 -222.89774 9.50312 2.57149 -224.13766 751.79983
5050.0000 -230.28775 -222.12351 8.16424 2.65965 -222.31512 803.79715
5055.0000 -231.13021 -220.39295 10.73726 2.72708 -220.92102 845.91359
5060.0000 -232.14891 -222.43846 9.71045 2.69942 -221.49300 834.68192
5065.0000 -232.24706 -221.98640 10.26066 2.64158 -222.68875 803.89633
5070.0000 -232.75647 -222.83925 9.91722 2.65384 -222.43528 798.68565
5075.0000 -233.09560 -224.57557 8.52003 2.57715 -224.02080 739.81193
5080.0000 -233.75353 -223.94407 9.80946 2.56787 -224.21259 728.29553
5085.0000 -232.23200 -223.68064 8.55136 2.61253 -223.28932 770.26682
5090.0000 -231.79460 -221.53567 10.25894 2.66602 -222.18340 807.27822
5095.0000 -233.24978 -222.52160 10.72818 2.69392 -221.60664 823.83795
5100.0000 -231.87673 -221.33949 10.53724 2.67377 -222.02331 813.31322
5105.0000 -232.46823 -221.94546 10.52277 2.67218 -222.05620 816.41495
5110.0000 -232.55581 -221.93657 10.61925 2.70460 -221.38577 831.34477
5115.0000 -232.10336 -221.02672 11.07664 2.68033 -221.88755 821.79318
5120.0000 -231.90196 -222.40488 9.49707 2.69049 -221.67754 835.59414
5125.0000 -231.22010 -221.62007 9.60004 2.63959 -222.72994 795.10170
5130.0000 -231.16988 -221.03191 10.13798 2.72247 -221.01642 833.79637
5135.0000 -231.79736 -223.02842 8.76894 2.67203 -222.05917 800.05858
5140.0000 -233.46820 -223.26546 10.20274 2.62300 -223.07285 792.97957
5145.0000 -232.05481 -222.51240 9.54241 2.64042 -222.71261 792.67110
5150.0000 -234.25069 -224.72518 9.52552 2.59972 -223.55421 773.79971
5155.0000 -232.93039 -223.74885 9.18154 2.56581 -224.25514 743.44209
5160.0000 -231.36439 -222.72910 8.63529 2.60897 -223.36285 762.40128
5165.0000 -231.87847 -222.59213 9.28634 2.60435 -223.45843 754.24901
5170.0000 -230.60936 -219.60525 11.00411 2.74098 -220.63384 817.28738
5175.0000 -231.53424 -221.93288 9.60136 2.76622 -220.11189 859.90624
5180.0000 -232.65984 -223.03742 9.62242 2.61923 -223.15080 767.61978
5185.0000 -232.67777 -224.20466 8.47312 2.63449 -222.83520 777.77042
5190.0000 -232.22578 -222.61232 9.61346 2.64461 -222.62601 796.64538
5195.0000 -232.87599 -222.28192 10.59407 2.64360 -222.64697 796.33600
5200.0000 -231.35709 -222.32647 9.03061 2.69221 -221.64207 819.57072
5205.0000 -232.65197 -224.16846 8.48351 2.62426 -223.04686 769.14019
5210.0000 -233.31059 -223.47022 9.84037 2.62591 -223.01278 794.57709
5215.0000 -233.11370 -223.45240 9.66130 2.60287 -223.48896 768.68787
5220.0000 -233.72537 -224.19313 9.53223 2.58534 -223.85132 752.24931
5225.0000 -231.71360 -221.51433 10.19928 2.68365 -221.81890 835.82641
5230.0000 -230.70723 -220.93176 9.77547 2.72695 -220.92375 835.72490
5235.0000 -229.43962 -220.18191 9.25771 2.76434 -220.15083 864.90436
5240.0000 -232.60574 -224.74240 7.86334 2.65585 -222.39364 805.14093
5245.0000 -232.54127 -222.74381 9.79745 2.62110 -223.11205 778.72118
5250.0000 -231.99334 -221.98961 10.00374 2.65159 -222.48182 801.75491
MELTING PROCESS: loop number 22 T-loop= 829.00000000000000
main_MD> interactions number 22 at Temperature= 829.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32990 6.24196 -2.03652
force_rgl> df(natom) -1.29431 1.79585 -1.53593
5255.0000 -233.18514 -224.59589 8.58925 2.63991 -222.72322 775.91120
5260.0000 -230.98966 -221.62231 9.36734 2.62750 -222.97990 778.91865
5265.0000 -230.76002 -220.75622 10.00379 2.74959 -220.45581 853.61842
5270.0000 -232.81040 -223.01480 9.79560 2.64668 -222.58332 788.96680
5275.0000 -232.37202 -222.27095 10.10107 2.63023 -222.92342 777.12134
5280.0000 -232.04540 -222.74693 9.29847 2.66157 -222.27545 787.49631
5285.0000 -231.97670 -221.56257 10.41413 2.69582 -221.56746 804.37598
5290.0000 -232.36789 -222.44437 9.92351 2.62787 -222.97222 783.35691
5295.0000 -231.49826 -222.93433 8.56393 2.65836 -222.34186 815.68304
5300.0000 -231.95965 -220.01013 11.94952 2.66566 -222.19097 774.66961
5305.0000 -231.66830 -222.74206 8.92624 2.71861 -221.09631 830.48408
5310.0000 -232.32621 -222.60964 9.71658 2.69280 -221.62984 823.67772
5315.0000 -230.43928 -220.35976 10.07952 2.69364 -221.61243 815.88590
5320.0000 -231.68514 -220.28263 11.40251 2.74257 -220.60097 834.56420
5325.0000 -231.40416 -220.98661 10.41754 2.77017 -220.03025 853.51713
5330.0000 -231.72956 -221.60368 10.12588 2.67485 -222.00100 785.30019
5335.0000 -230.13315 -219.92113 10.21202 2.76093 -220.22123 842.93632
5340.0000 -230.17749 -218.06205 12.11544 2.74616 -220.52659 838.38687
5345.0000 -231.80949 -220.89841 10.91108 2.76064 -220.22740 856.97777
5350.0000 -231.21356 -219.90274 11.31083 2.77278 -219.97623 871.82357
5355.0000 -230.20896 -218.19537 12.01359 2.83608 -218.66771 897.47949
5360.0000 -230.28461 -219.37963 10.90499 2.85072 -218.36502 909.35690
5365.0000 -231.68949 -222.63343 9.05605 2.68913 -221.70576 827.11734
5370.0000 -230.40966 -219.46908 10.94058 2.77941 -219.83934 870.60375
5375.0000 -232.45882 -222.82550 9.63332 2.72204 -221.02531 821.21535
5380.0000 -233.21638 -220.97302 12.24336 2.68083 -221.87720 819.12041
5385.0000 -231.93280 -219.98986 11.94294 2.73326 -220.79336 855.97862
5390.0000 -231.19740 -220.80113 10.39627 2.72828 -220.89640 862.26426
5395.0000 -230.83096 -220.80035 10.03061 2.74680 -220.51340 892.79475
5400.0000 -231.53742 -219.66247 11.87495 2.75703 -220.30204 860.46636
5405.0000 -229.60907 -220.29323 9.31585 2.75702 -220.30222 852.44202
5410.0000 -229.60417 -219.28694 10.31723 2.79390 -219.53971 878.43746
5415.0000 -230.81307 -220.95208 9.86099 2.78066 -219.81343 850.19557
5420.0000 -230.24051 -220.98036 9.26015 2.74582 -220.53364 837.43752
5425.0000 -230.91997 -219.67761 11.24236 2.70848 -221.30560 821.72483
5430.0000 -231.84805 -222.07393 9.77412 2.70973 -221.27980 842.15197
5435.0000 -232.32810 -222.87895 9.44915 2.64676 -222.58171 783.21245
5440.0000 -232.40065 -223.27244 9.12821 2.60510 -223.44296 779.01801
5445.0000 -231.20381 -220.99141 10.21240 2.65270 -222.45880 798.11922
5450.0000 -230.62051 -220.66248 9.95804 2.72060 -221.05503 829.99417
5455.0000 -231.49038 -221.10968 10.38071 2.72294 -221.00661 841.32011
5460.0000 -230.09862 -219.13833 10.96029 2.74326 -220.58658 875.37968
5465.0000 -230.01997 -221.60324 8.41673 2.75943 -220.25232 852.06623
5470.0000 -231.71976 -222.63745 9.08231 2.66900 -222.12180 807.78032
5475.0000 -232.09551 -222.40147 9.69404 2.63315 -222.86299 780.44107
5480.0000 -230.98583 -222.13337 8.85246 2.63599 -222.80435 757.15640
5485.0000 -233.15293 -222.99218 10.16075 2.65610 -222.38845 790.97583
5490.0000 -231.83412 -222.12523 9.70889 2.63493 -222.82628 786.83134
5495.0000 -231.26760 -221.74501 9.52258 2.68001 -221.89427 828.54344
5500.0000 -234.06122 -221.51177 12.54946 2.63641 -222.79556 802.54275
MELTING PROCESS: loop number 23 T-loop= 854.00000000000000
main_MD> interactions number 23 at Temperature= 854.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.68572 -2.14209 -4.03495
force_rgl> df(natom) -0.26713 1.96237 0.74013
5505.0000 -232.12366 -221.52090 10.60276 2.69566 -221.57072 837.15334
5510.0000 -232.15705 -221.18922 10.96783 2.68942 -221.69967 824.35820
5515.0000 -231.66447 -222.02093 9.64354 2.73874 -220.67997 852.36718
5520.0000 -233.46405 -223.38407 10.07999 2.65565 -222.39776 800.21262
5525.0000 -230.39283 -219.24166 11.15117 2.71630 -221.14393 841.22608
5530.0000 -231.19773 -222.28317 8.91456 2.73596 -220.73752 848.89939
5535.0000 -231.06532 -221.02729 10.03803 2.66718 -222.15950 803.00573
5540.0000 -232.08756 -221.41237 10.67519 2.74183 -220.61617 832.22107
5545.0000 -231.31782 -220.02205 11.29577 2.73151 -220.82963 854.12615
5550.0000 -232.55153 -221.19868 11.35286 2.69977 -221.48580 834.78673
5555.0000 -230.82617 -221.82285 9.00332 2.68996 -221.68849 824.77378
5560.0000 -230.93358 -219.49276 11.44082 2.73724 -220.71099 845.98959
5565.0000 -228.23524 -217.31442 10.92082 2.81201 -219.16529 896.72663
5570.0000 -230.87147 -219.54795 11.32352 2.81071 -219.19219 867.58739
5575.0000 -232.31659 -221.58957 10.72702 2.76898 -220.05492 876.96662
5580.0000 -233.51315 -222.14036 11.37280 2.71418 -221.18777 831.12141
5585.0000 -231.52776 -221.51494 10.01282 2.64929 -222.52941 797.33730
5590.0000 -229.72365 -219.54709 10.17656 2.76565 -220.12380 850.03884
5595.0000 -230.98688 -221.62646 9.36043 2.73024 -220.85582 836.32069
5600.0000 -229.91846 -220.67864 9.23983 2.72398 -220.98517 824.55638
5605.0000 -231.36229 -221.37086 9.99143 2.74322 -220.58754 842.49477
5610.0000 -231.11200 -221.38637 9.72564 2.68849 -221.71896 816.15356
5615.0000 -230.40246 -220.11414 10.28833 2.76109 -220.21810 856.81902
5620.0000 -229.91241 -219.96457 9.94783 2.78631 -219.69660 875.78445
5625.0000 -230.11533 -219.28403 10.83130 2.75711 -220.30028 850.82197
5630.0000 -231.97051 -221.09043 10.88008 2.80686 -219.27175 896.10645
5635.0000 -230.94807 -221.02339 9.92468 2.74977 -220.45205 832.75028
5640.0000 -229.81441 -220.07429 9.74013 2.75568 -220.32989 842.93023
5645.0000 -232.02252 -222.09449 9.92803 2.71267 -221.21902 828.88179
5650.0000 -229.65875 -219.02649 10.63226 2.74419 -220.56734 825.45659
5655.0000 -230.38513 -220.20279 10.18234 2.79600 -219.49619 891.37679
5660.0000 -231.45005 -220.85591 10.59414 2.76373 -220.16333 873.88615
5665.0000 -231.25127 -219.95462 11.29664 2.74115 -220.63019 859.39432
5670.0000 -229.66911 -218.80041 10.86870 2.79636 -219.48876 895.10839
5675.0000 -229.03464 -218.58360 10.45103 2.82323 -218.93328 883.10219
5680.0000 -230.55261 -219.80727 10.74534 2.80189 -219.37458 887.55220
5685.0000 -231.57982 -221.91060 9.66923 2.70317 -221.41543 814.05121
5690.0000 -229.34842 -219.89507 9.45334 2.70176 -221.44449 829.66288
5695.0000 -231.48289 -221.24059 10.24230 2.68760 -221.73731 824.33593
5700.0000 -232.27590 -222.29760 9.97831 2.67240 -222.05162 815.96782
5705.0000 -231.89504 -221.93840 9.95665 2.63918 -222.73834 787.41449
5710.0000 -231.32617 -220.86610 10.46007 2.71514 -221.16788 797.70362
5715.0000 -230.94632 -221.58978 9.35654 2.74044 -220.64499 848.90053
5720.0000 -232.68026 -220.42327 12.25698 2.73620 -220.73256 822.97700
5725.0000 -231.96104 -221.04865 10.91239 2.73406 -220.77673 846.24820
5730.0000 -230.26620 -219.71740 10.54880 2.75454 -220.35347 861.87760
5735.0000 -232.53369 -222.65457 9.87912 2.72152 -221.03613 850.29137
5740.0000 -231.52122 -220.99465 10.52656 2.65435 -222.42467 813.82050
5745.0000 -230.28484 -218.44525 11.83959 2.74789 -220.49082 851.87709
5750.0000 -231.06970 -221.80029 9.26942 2.79549 -219.50692 893.69595
MELTING PROCESS: loop number 24 T-loop= 879.00000000000000
main_MD> interactions number 24 at Temperature= 879.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.14679 -6.03860 1.88316
force_rgl> df(natom) -0.74570 1.12619 -0.08298
5755.0000 -230.83574 -221.25479 9.58095 2.73120 -220.83595 834.39352
5760.0000 -230.98416 -221.43898 9.54518 2.66250 -222.25621 800.40618
5765.0000 -229.20038 -219.01291 10.18747 2.71645 -221.14084 842.77687
5770.0000 -230.60772 -220.81610 9.79161 2.79975 -219.41868 895.91283
5775.0000 -229.11649 -218.22555 10.89094 2.78688 -219.68490 871.70463
5780.0000 -230.51934 -220.10433 10.41501 2.80915 -219.22446 910.01374
5785.0000 -230.26281 -219.05256 11.21024 2.81272 -219.15068 895.68448
5790.0000 -232.00068 -220.62914 11.37154 2.80486 -219.31307 870.97150
5795.0000 -229.61995 -220.41714 9.20280 2.81499 -219.10368 891.37944
5800.0000 -231.06164 -222.28783 8.77381 2.74302 -220.59166 860.28437
5805.0000 -229.06218 -218.14546 10.91672 2.75629 -220.31724 862.72778
5810.0000 -228.95976 -216.09559 12.86418 2.90302 -217.28388 943.09589
5815.0000 -228.77292 -217.02133 11.75160 2.94322 -216.45275 987.91971
5820.0000 -228.89231 -218.50511 10.38719 2.84918 -218.39679 898.66865
5825.0000 -229.38811 -219.77608 9.61203 2.76774 -220.08054 867.27213
5830.0000 -229.87705 -220.02998 9.84707 2.76257 -220.18731 834.12728
5835.0000 -227.96786 -218.01083 9.95703 2.82816 -218.83145 878.25104
5840.0000 -230.33563 -218.91282 11.42281 2.93352 -216.65316 972.43437
5845.0000 -231.82409 -218.88493 12.93916 2.82732 -218.84881 904.17442
5850.0000 -228.31135 -217.19998 11.11138 2.88847 -217.58458 946.27483
5855.0000 -228.49541 -215.91794 12.57747 2.91170 -217.10438 959.97411
5860.0000 -229.09297 -217.14397 11.94900 2.95295 -216.25153 936.17628
5865.0000 -230.31334 -218.36947 11.94386 2.84595 -218.46373 882.75830
5870.0000 -231.90611 -221.51663 10.38948 2.79338 -219.55042 883.01966
5875.0000 -231.51261 -222.55182 8.96079 2.68745 -221.74045 822.34621
5880.0000 -230.54206 -220.78408 9.75798 2.73223 -220.81471 868.03449
5885.0000 -229.19806 -218.33915 10.85892 2.77513 -219.92771 856.76475
5890.0000 -229.26944 -218.56479 10.70465 2.82000 -219.00014 914.45894
5895.0000 -229.03897 -218.50178 10.53718 2.85137 -218.35151 904.32460
5900.0000 -229.07076 -217.06553 12.00523 2.83924 -218.60246 935.42581
5905.0000 -230.09731 -220.03885 10.05846 2.84793 -218.42270 918.35419
5910.0000 -231.88642 -222.23221 9.65420 2.72060 -221.05510 849.84433
5915.0000 -232.33519 -222.55986 9.77533 2.63881 -222.74591 781.56676
5920.0000 -231.51137 -220.72918 10.78219 2.71895 -221.08924 820.74257
5925.0000 -230.64895 -218.55836 12.09059 2.74048 -220.64405 863.19272
5930.0000 -229.80257 -220.60618 9.19640 2.80445 -219.32162 879.57342
5935.0000 -228.82728 -219.34915 9.47813 2.81631 -219.07638 882.72328
5940.0000 -230.88838 -221.99372 8.89467 2.78244 -219.77663 863.22160
5945.0000 -230.72987 -219.50067 11.22919 2.73786 -220.69822 849.46862
5950.0000 -231.32034 -222.09194 9.22841 2.71532 -221.16418 846.23388
5955.0000 -231.74032 -220.96124 10.77908 2.71026 -221.26883 856.12377
5960.0000 -230.25125 -220.76323 9.48803 2.70168 -221.44618 833.97109
5965.0000 -231.62888 -221.42003 10.20885 2.73290 -220.80088 855.99992
5970.0000 -232.13422 -222.06866 10.06555 2.70013 -221.47819 823.56588
5975.0000 -231.05309 -219.60082 11.45226 2.76224 -220.19417 858.19156
5980.0000 -230.21543 -219.58206 10.63337 2.77234 -219.98535 872.28314
5985.0000 -232.48293 -222.84201 9.64093 2.73198 -220.81991 847.58664
5990.0000 -231.63592 -221.72054 9.91538 2.60986 -223.34448 763.83472
5995.0000 -231.29719 -219.94771 11.34948 2.75013 -220.44464 842.15694
6000.0000 -230.93057 -220.95163 9.97894 2.75016 -220.44405 848.79499
MELTING PROCESS: loop number 25 T-loop= 904.00000000000000
main_MD> interactions number 25 at Temperature= 904.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.31661 0.34129 -1.02271
force_rgl> df(natom) -2.22585 -0.32513 1.85843
6005.0000 -231.05375 -219.88681 11.16693 2.74930 -220.46169 848.67271
6010.0000 -229.55564 -219.40091 10.15473 2.77909 -219.84588 873.67899
6015.0000 -229.54368 -219.03395 10.50973 2.77042 -220.02503 851.84493
6020.0000 -232.55907 -220.73737 11.82170 2.79431 -219.53115 878.74817
6025.0000 -230.11727 -218.64944 11.46783 2.76534 -220.13017 875.30430
6030.0000 -229.30074 -217.46751 11.83324 2.82996 -218.79416 895.12117
6035.0000 -227.42830 -216.47851 10.94979 2.94747 -216.36481 978.32714
6040.0000 -229.27242 -217.32578 11.94664 2.85751 -218.22467 886.47499
6045.0000 -229.56805 -217.54167 12.02638 2.86684 -218.03184 915.38507
6050.0000 -229.61859 -218.53075 11.08784 2.90399 -217.26369 931.52520
6055.0000 -229.21184 -217.84508 11.36676 2.84455 -218.49258 911.43795
6060.0000 -229.69057 -219.13789 10.55268 2.81590 -219.08486 906.06739
6065.0000 -229.53783 -218.86239 10.67544 2.78199 -219.78597 882.48106
6070.0000 -227.83874 -218.00774 9.83100 2.85860 -218.20217 901.77599
6075.0000 -229.64650 -218.21164 11.43486 2.87539 -217.85507 922.10878
6080.0000 -229.51608 -217.97540 11.54067 2.91266 -217.08446 959.58811
6085.0000 -230.07614 -217.40711 12.66903 2.85879 -218.19816 921.25582
6090.0000 -230.30568 -218.77029 11.53538 2.83733 -218.64175 913.20652
6095.0000 -228.01966 -216.50268 11.51699 2.89114 -217.52949 944.09778
6100.0000 -229.37206 -217.27560 12.09646 2.89069 -217.53859 947.78929
6105.0000 -230.51474 -219.93140 10.58335 2.80310 -219.34954 879.57469
6110.0000 -230.74232 -219.62951 11.11281 2.78087 -219.80918 905.88507
6115.0000 -230.73667 -219.90292 10.83374 2.79074 -219.60509 904.78146
6120.0000 -230.31091 -218.84454 11.46637 2.77804 -219.86752 867.52221
6125.0000 -230.80238 -220.42553 10.37685 2.80589 -219.29191 903.28293
6130.0000 -230.15563 -218.74567 11.40995 2.80612 -219.28717 889.04684
6135.0000 -229.97495 -218.86940 11.10555 2.82112 -218.97698 893.67148
6140.0000 -228.80022 -218.22716 10.57307 2.88858 -217.58225 949.63473
6145.0000 -229.77543 -219.00394 10.77148 2.88032 -217.75299 928.70345
6150.0000 -231.37761 -220.59806 10.77955 2.75864 -220.26859 856.02976
6155.0000 -230.40869 -218.42407 11.98461 2.80495 -219.31126 863.19227
6160.0000 -228.74825 -218.19312 10.55513 2.87971 -217.76562 917.62092
6165.0000 -229.44530 -219.42244 10.02286 2.84808 -218.41950 929.60375
6170.0000 -231.85803 -220.06528 11.79275 2.78408 -219.74282 877.35686
6175.0000 -229.41638 -218.12256 11.29382 2.83022 -218.78885 906.77445
6180.0000 -228.33748 -217.88078 10.45669 2.84238 -218.53737 919.60929
6185.0000 -229.61105 -219.93880 9.67225 2.84223 -218.54060 904.97049
6190.0000 -231.22122 -219.07449 12.14673 2.79707 -219.47415 881.56904
6195.0000 -228.42237 -215.72732 12.69505 2.87034 -217.95948 918.57339
6200.0000 -230.72419 -220.03011 10.69408 2.88889 -217.57592 945.51576
6205.0000 -230.11745 -219.09204 11.02541 2.75958 -220.24932 853.20603
6210.0000 -230.05479 -219.50237 10.55242 2.82720 -218.85125 885.74176
6215.0000 -229.57096 -219.21878 10.35218 2.82937 -218.80636 929.96115
6220.0000 -231.51376 -220.90374 10.61002 2.72527 -220.95856 844.10422
6225.0000 -229.20556 -219.67709 9.52847 2.78342 -219.75640 883.85078
6230.0000 -230.62117 -220.76001 9.86115 2.77209 -219.99053 863.16168
6235.0000 -228.72470 -217.97524 10.74946 2.79941 -219.42589 886.03863
6240.0000 -232.59535 -221.72604 10.86930 2.71882 -221.09188 832.18650
6245.0000 -231.44689 -221.13510 10.31179 2.69908 -221.50004 838.59309
6250.0000 -231.06948 -221.27219 9.79728 2.75470 -220.35008 842.22229
MELTING PROCESS: loop number 26 T-loop= 929.00000000000000
main_MD> interactions number 26 at Temperature= 929.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.18053 3.97141 -2.64111
force_rgl> df(natom) -0.34259 -1.21668 -2.78197
6255.0000 -229.59302 -220.28086 9.31216 2.74659 -220.51771 848.29219
6260.0000 -228.66401 -217.18591 11.47810 2.85145 -218.35001 922.41624
6265.0000 -226.63706 -215.76179 10.87527 2.94887 -216.33588 970.10610
6270.0000 -227.15521 -216.97866 10.17655 2.97617 -215.77143 970.44450
6275.0000 -228.31978 -217.02333 11.29646 2.96373 -216.02867 968.02743
6280.0000 -230.34900 -218.25877 12.09024 2.93118 -216.70158 964.76368
6285.0000 -228.21284 -218.18983 10.02301 2.86710 -218.02637 940.80197
6290.0000 -229.14703 -216.27597 12.87106 2.95372 -216.23554 975.80435
6295.0000 -228.59716 -217.80068 10.79648 2.89123 -217.52743 921.37632
6300.0000 -228.46496 -217.79839 10.66658 2.86573 -218.05469 919.07031
6305.0000 -230.28936 -220.24863 10.04073 2.81399 -219.12433 880.31422
6310.0000 -227.54570 -216.50731 11.03838 2.83761 -218.63606 892.50728
6315.0000 -228.88624 -217.03105 11.85519 2.96755 -215.94969 997.55437
6320.0000 -227.19668 -215.40753 11.78914 2.94763 -216.36149 969.60747
6325.0000 -228.47681 -214.71253 13.76428 2.99242 -215.43561 996.46561
6330.0000 -226.94974 -217.06141 9.88833 2.95968 -216.11241 961.40563
6335.0000 -229.03487 -216.26560 12.76927 3.00634 -215.14778 991.55417
6340.0000 -227.28388 -215.43896 11.84491 2.95836 -216.13966 948.04665
6345.0000 -229.46738 -216.30889 13.15849 2.94162 -216.48581 967.53489
6350.0000 -228.70797 -217.63927 11.06870 2.87626 -217.83696 960.62027
6355.0000 -228.91405 -217.09178 11.82228 2.90222 -217.30031 944.34696
6360.0000 -229.05719 -219.13715 9.92003 2.88139 -217.73088 930.64714
6365.0000 -228.98656 -217.64076 11.34580 2.84670 -218.44812 900.54343
6370.0000 -228.44582 -216.68008 11.76574 2.89617 -217.42538 956.76349
6375.0000 -228.92382 -218.03951 10.88432 2.88406 -217.67585 927.60687
6380.0000 -228.03931 -216.55638 11.48293 2.86036 -218.16567 930.98703
6385.0000 -228.70397 -217.35061 11.35336 2.96321 -216.03937 982.26410
6390.0000 -228.90290 -216.80332 12.09958 2.90372 -217.26925 932.10202
6395.0000 -226.87541 -215.29099 11.58442 2.93140 -216.69703 956.62409
6400.0000 -227.73586 -215.70365 12.03220 2.99318 -215.41989 1001.97565
6405.0000 -228.94333 -217.74925 11.19408 2.91761 -216.98212 946.83203
6410.0000 -227.77683 -215.94808 11.82875 2.93185 -216.68769 953.73353
6415.0000 -229.35127 -218.94660 10.40468 2.93059 -216.71374 962.05456
6420.0000 -230.57352 -218.44915 12.12437 2.87132 -217.93922 944.94371
6425.0000 -229.47759 -219.26824 10.20935 2.82447 -218.90777 912.99536
6430.0000 -229.70824 -217.45466 12.25358 2.87670 -217.82797 949.77237
6435.0000 -227.96861 -216.69602 11.27259 2.92335 -216.86353 959.92347
6440.0000 -230.46952 -217.45773 13.01179 2.91792 -216.97566 961.23529
6445.0000 -225.82517 -214.84093 10.98424 2.97665 -215.76155 991.37682
6450.0000 -229.29769 -216.69888 12.59881 2.99696 -215.34170 1001.77334
6455.0000 -226.61498 -213.53114 13.08384 2.98691 -215.54946 1004.68336
6460.0000 -227.84542 -217.62547 10.21995 2.97946 -215.70346 967.65653
6465.0000 -229.25807 -216.97241 12.28566 2.92915 -216.74354 933.71477
6470.0000 -229.92582 -217.34679 12.57903 2.89819 -217.38360 959.77178
6475.0000 -227.49593 -217.01357 10.48236 2.90972 -217.14535 948.96042
6480.0000 -229.95397 -216.31911 13.63487 2.85958 -218.18179 917.91957
6485.0000 -231.44402 -218.69049 12.75352 2.88243 -217.70944 956.39132
6490.0000 -229.43722 -217.89542 11.54181 2.89402 -217.46983 931.22884
6495.0000 -229.39843 -218.30138 11.09705 2.89657 -217.41721 946.19152
6500.0000 -228.54167 -218.87903 9.66264 2.80349 -219.34147 866.10287
MELTING PROCESS: loop number 27 T-loop= 954.00000000000000
main_MD> interactions number 27 at Temperature= 954.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.86126 0.52394 -6.98205
force_rgl> df(natom) 2.00350 -0.29362 4.89777
6505.0000 -230.88969 -219.29640 11.59329 2.85534 -218.26947 925.48166
6510.0000 -229.98896 -216.97056 13.01840 2.88723 -217.61031 946.86815
6515.0000 -226.41374 -215.61710 10.79663 2.90965 -217.14666 957.76954
6520.0000 -228.14598 -217.22558 10.92040 2.93928 -216.53415 951.68011
6525.0000 -230.51271 -218.65610 11.85661 2.88793 -217.59569 953.12598
6530.0000 -229.93891 -219.37553 10.56337 2.84839 -218.41311 905.39429
6535.0000 -228.66309 -216.47154 12.19155 2.86422 -218.08594 913.92703
6540.0000 -230.42505 -217.49539 12.92967 2.92103 -216.91142 975.37958
6545.0000 -228.42654 -217.87207 10.55447 2.85189 -218.34088 933.86610
6550.0000 -227.81242 -216.73554 11.07688 2.91592 -217.01709 949.95555
6555.0000 -227.77050 -215.80586 11.96465 2.95873 -216.13199 999.37903
6560.0000 -228.25063 -217.35159 10.89904 2.93492 -216.62435 964.25097
6565.0000 -228.11387 -217.55406 10.55981 2.89305 -217.48992 937.24901
6570.0000 -229.04532 -218.65404 10.39128 2.85342 -218.30921 906.61492
6575.0000 -227.61499 -216.37037 11.24462 2.85174 -218.34394 905.77831
6580.0000 -228.61411 -216.68143 11.93268 2.91541 -217.02768 953.43398
6585.0000 -229.35670 -217.25839 12.09830 2.90914 -217.15726 943.31226
6590.0000 -227.90165 -215.21931 12.68234 2.90865 -217.16747 950.90959
6595.0000 -227.10162 -214.94364 12.15799 3.00248 -215.22758 995.32594
6600.0000 -226.74538 -215.19518 11.55020 3.04944 -214.25667 1021.35533
6605.0000 -229.06901 -215.15723 13.91178 3.02703 -214.72013 1038.80901
6610.0000 -228.34872 -215.68180 12.66692 2.93296 -216.66472 961.91709
6615.0000 -228.72289 -219.05654 9.66636 2.88131 -217.73270 952.22917
6620.0000 -231.66536 -219.94406 11.72130 2.78005 -219.82613 889.03946
6625.0000 -227.90093 -215.46361 12.43732 2.93330 -216.65778 959.47106
6630.0000 -227.40423 -217.09151 10.31272 2.94797 -216.35440 971.68137
6635.0000 -230.78920 -218.29629 12.49291 2.88731 -217.60852 939.98217
6640.0000 -229.35733 -217.50746 11.84987 2.90951 -217.14956 962.64056
6645.0000 -231.39974 -221.77386 9.62588 2.79631 -219.48997 883.23115
6650.0000 -230.10472 -217.03245 13.07227 2.81984 -219.00334 884.84688
6655.0000 -228.10700 -217.43065 10.67635 2.87648 -217.83238 938.64758
6660.0000 -229.25784 -218.99684 10.26100 2.84861 -218.40855 904.10888
6665.0000 -229.72526 -217.27506 12.45020 2.85363 -218.30496 905.92876
6670.0000 -227.99951 -216.13704 11.86247 2.91097 -217.11951 936.99418
6675.0000 -228.79455 -217.16390 11.63065 2.95297 -216.25105 926.39958
6680.0000 -228.60777 -218.16420 10.44357 2.90993 -217.14101 928.16944
6685.0000 -229.93894 -218.28109 11.65786 2.87124 -217.94086 916.67597
6690.0000 -228.50383 -216.34865 12.15518 2.89327 -217.48545 912.18183
6695.0000 -227.22460 -214.32481 12.89978 3.01324 -215.00522 1022.31072
6700.0000 -228.11977 -213.57616 14.54361 3.11159 -212.97181 1060.64807
6705.0000 -226.60622 -213.26785 13.33836 3.10051 -213.20095 1074.54467
6710.0000 -228.78655 -215.20526 13.58129 3.05937 -214.05152 1057.85431
6715.0000 -227.48649 -215.90864 11.57785 3.03025 -214.65355 1027.35557
6720.0000 -228.99144 -217.57840 11.41304 2.94516 -216.41258 955.26089
6725.0000 -230.03737 -218.01163 12.02574 2.84786 -218.42420 900.08806
6730.0000 -230.82908 -219.52698 11.30210 2.81889 -219.02304 895.57894
6735.0000 -229.66882 -218.96998 10.69884 2.84219 -218.54146 904.90589
6740.0000 -231.39745 -220.59047 10.80698 2.78845 -219.65229 878.33897
6745.0000 -230.15407 -217.25797 12.89610 2.79096 -219.60058 865.58927
6750.0000 -228.20040 -216.67324 11.52716 2.88870 -217.57975 937.02618
MELTING PROCESS: loop number 28 T-loop= 979.00000000000000
main_MD> interactions number 28 at Temperature= 979.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.71113 -0.97395 -0.55552
force_rgl> df(natom) -5.05943 2.25700 -3.16463
6755.0000 -227.61622 -214.25690 13.35932 3.01419 -214.98549 1018.55170
6760.0000 -227.65169 -216.86648 10.78520 2.95729 -216.16180 976.97173
6765.0000 -228.19232 -216.58962 11.60270 2.92637 -216.80099 961.30644
6770.0000 -229.09670 -219.01277 10.08393 2.88103 -217.73842 933.34185
6775.0000 -229.86019 -219.84557 10.01462 2.80534 -219.30326 887.41411
6780.0000 -229.45889 -217.82526 11.63363 2.82973 -218.79895 895.34028
6785.0000 -230.16637 -219.38541 10.78096 2.84593 -218.46405 897.95933
6790.0000 -229.64334 -218.30772 11.33562 2.82018 -218.99639 902.97033
6795.0000 -230.52649 -217.95923 12.56726 2.88489 -217.65855 923.68307
6800.0000 -226.35325 -216.07517 10.27808 2.85341 -218.30950 892.73600
6805.0000 -226.07168 -213.89683 12.17485 2.89179 -217.51599 906.65728
6810.0000 -228.89427 -215.85065 13.04362 2.98754 -215.53635 1002.09062
6815.0000 -230.33411 -219.50330 10.83081 2.86634 -218.04202 931.30573
6820.0000 -229.42686 -217.27513 12.15173 2.86407 -218.08894 932.17105
6825.0000 -227.99118 -215.92269 12.06848 2.94660 -216.38286 970.90888
6830.0000 -226.97068 -215.17177 11.79892 3.02000 -214.86548 1020.91339
6835.0000 -226.68437 -213.17811 13.50626 3.06708 -213.89202 1040.07519
6840.0000 -226.15601 -214.03781 12.11820 3.03847 -214.48346 1033.12964
6845.0000 -227.04287 -215.61360 11.42927 3.01815 -214.90365 1001.01990
6850.0000 -227.65340 -215.42787 12.22553 3.01388 -214.99187 1002.51984
6855.0000 -227.57144 -216.52686 11.04458 2.98738 -215.53976 975.01088
6860.0000 -228.54015 -217.29846 11.24170 2.96735 -215.95376 984.51069
6865.0000 -227.42549 -215.40925 12.01624 2.91587 -217.01811 964.27875
6870.0000 -229.17087 -218.77926 10.39161 2.91466 -217.04323 944.76651
6875.0000 -227.20286 -215.71660 11.48626 2.87736 -217.81421 927.88581
6880.0000 -227.16812 -214.70483 12.46330 2.99906 -215.29820 1002.87799
6885.0000 -228.25912 -216.22838 12.03073 2.93383 -216.64676 935.77440
6890.0000 -228.31622 -217.06229 11.25394 2.92973 -216.73150 959.86565
6895.0000 -228.26591 -216.18127 12.08464 2.88735 -217.60770 936.50199
6900.0000 -227.13534 -215.18012 11.95522 2.99191 -215.44604 986.05344
6905.0000 -228.48957 -215.80656 12.68300 2.98356 -215.61875 1012.37997
6910.0000 -229.82173 -219.20397 10.61776 2.89917 -217.36346 957.47464
6915.0000 -229.68655 -215.93960 13.74695 2.88382 -217.68070 942.55400
6920.0000 -227.18118 -214.96124 12.21993 2.97426 -215.81104 1004.74605
6925.0000 -227.76209 -215.33504 12.42705 3.07297 -213.77021 1019.32241
6930.0000 -228.04544 -215.31363 12.73181 3.01700 -214.92744 970.81656
6935.0000 -228.41212 -218.06885 10.34327 2.95145 -216.28250 975.47155
6940.0000 -228.51329 -218.23137 10.28191 2.93402 -216.64286 973.61520
6945.0000 -227.65340 -214.62692 13.02648 2.93943 -216.53116 996.93824
6950.0000 -228.31077 -216.19126 12.11950 2.95368 -216.23636 1001.55417
6955.0000 -227.46909 -215.11656 12.35253 3.04083 -214.43472 1030.27610
6960.0000 -226.82160 -214.14259 12.67901 3.03428 -214.57021 1047.17591
6965.0000 -228.22356 -216.60602 11.61754 3.01448 -214.97947 1012.07691
6970.0000 -226.90109 -215.71298 11.18811 2.94867 -216.34007 973.35978
6975.0000 -228.66215 -217.92620 10.73595 2.90651 -217.21172 955.16028
6980.0000 -229.12844 -215.07282 14.05561 2.86545 -218.06047 927.39288
6985.0000 -228.15838 -214.46468 13.69369 3.05386 -214.16527 1063.69901
6990.0000 -228.28342 -215.68867 12.59475 2.94617 -216.39162 977.99171
6995.0000 -227.51345 -217.10153 10.41192 2.96269 -216.05015 989.52947
7000.0000 -226.59197 -214.24455 12.34742 3.00898 -215.09312 983.87013
MELTING PROCESS: loop number 29 T-loop= 1004.0000000000000
main_MD> interactions number 29 at Temperature= 1004.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -5.78356 2.95183 -0.84659
force_rgl> df(natom) -0.08054 1.85939 0.51224
7005.0000 -227.91181 -214.70782 13.20399 3.02328 -214.79761 1015.45284
7010.0000 -227.45910 -215.66846 11.79065 2.96943 -215.91080 966.68588
7015.0000 -227.42005 -214.66104 12.75901 2.98822 -215.52245 1002.21905
7020.0000 -227.39606 -215.95479 11.44128 3.03919 -214.46857 1025.26205
7025.0000 -227.93882 -216.36894 11.56988 2.93936 -216.53253 934.57225
7030.0000 -227.89080 -214.59339 13.29742 2.96168 -216.07110 974.52455
7035.0000 -228.25951 -214.19804 14.06147 3.03106 -214.63682 1033.02939
7040.0000 -228.13796 -217.28628 10.85168 2.96549 -215.99227 997.37709
7045.0000 -228.26721 -215.93252 12.33469 2.94948 -216.32323 981.58049
7050.0000 -228.01929 -215.21507 12.80422 3.01276 -215.01514 1024.58790
7055.0000 -224.50409 -213.45394 11.05015 3.07967 -213.63176 1060.47118
7060.0000 -227.11820 -214.71378 12.40443 3.01431 -214.98297 1009.85034
7065.0000 -225.88154 -213.23958 12.64196 3.08367 -213.54906 1045.04540
7070.0000 -225.79424 -212.91927 12.87497 3.07642 -213.69906 1070.91314
7075.0000 -229.14970 -219.32737 9.82233 2.93404 -216.64257 965.34320
7080.0000 -229.50464 -219.49981 10.00482 2.81368 -219.13073 879.95966
7085.0000 -229.36416 -218.13586 11.22830 2.85962 -218.18092 944.56557
7090.0000 -229.02249 -218.47568 10.54681 2.84735 -218.43472 917.24369
7095.0000 -228.61836 -216.99622 11.62214 2.88801 -217.59418 974.65420
7100.0000 -226.94220 -214.29941 12.64280 3.01665 -214.93456 988.49261
7105.0000 -226.38223 -213.65709 12.72514 3.07149 -213.80084 1068.85513
7110.0000 -227.91082 -214.36795 13.54287 3.03673 -214.51946 1018.37957
7115.0000 -228.19902 -217.03971 11.15931 2.98504 -215.58803 1005.13093
7120.0000 -226.93104 -214.92128 12.00976 2.98224 -215.64604 980.74378
7125.0000 -226.90931 -214.61685 12.29247 3.02121 -214.84046 1021.23279
7130.0000 -227.88202 -215.04739 12.83463 2.99655 -215.35025 1022.34025
7135.0000 -229.69013 -218.29416 11.39598 2.89935 -217.35968 944.55903
7140.0000 -228.12947 -216.74965 11.37982 2.93480 -216.62669 980.77696
7145.0000 -228.72681 -217.64762 11.07919 2.87053 -217.95551 942.74894
7150.0000 -228.40587 -216.20301 12.20286 2.87991 -217.76156 951.98651
7155.0000 -228.45955 -217.53408 10.92548 2.96688 -215.96352 978.15571
7160.0000 -228.30617 -214.57790 13.72828 2.94701 -216.37426 1009.21753
7165.0000 -228.34427 -215.74072 12.60354 3.00723 -215.12934 1021.33755
7170.0000 -227.23899 -213.75888 13.48010 3.01037 -215.06442 1017.37855
7175.0000 -227.61662 -216.60398 11.01263 2.89151 -217.52180 954.85940
7180.0000 -229.82520 -217.02229 12.80291 2.92149 -216.90198 971.90439
7185.0000 -226.40426 -215.50508 10.89918 2.95358 -216.23857 955.37216
7190.0000 -224.29643 -212.86362 11.43281 3.05054 -214.23406 1003.63503
7195.0000 -225.63273 -212.84937 12.78336 3.09028 -213.41241 1070.14684
7200.0000 -228.29469 -215.64463 12.65006 3.01588 -214.95060 1012.03798
7205.0000 -228.49774 -217.07377 11.42397 2.99219 -215.44038 995.29779
7210.0000 -228.41988 -216.18330 12.23657 2.93962 -216.52709 979.15886
7215.0000 -227.01569 -215.34568 11.67001 2.96139 -216.07710 972.90774
7220.0000 -227.67692 -216.00794 11.66898 2.96542 -215.99373 964.73967
7225.0000 -228.02914 -215.09810 12.93104 2.99259 -215.43194 985.89471
7230.0000 -226.27013 -213.35929 12.91085 3.02941 -214.67079 1039.31034
7235.0000 -227.65584 -215.76123 11.89461 3.05021 -214.24091 1058.32369
7240.0000 -226.32118 -215.28400 11.03718 3.02528 -214.75626 1022.52818
7245.0000 -225.65353 -212.95534 12.69819 3.08647 -213.49126 1054.79606
7250.0000 -225.67426 -213.15288 12.52138 3.08197 -213.58417 1045.16038
MELTING PROCESS: loop number 30 T-loop= 1029.0000000000000
main_MD> interactions number 30 at Temperature= 1029.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.70518 -4.38585 -1.81733
force_rgl> df(natom) 0.25711 -1.05148 5.58910
7255.0000 -227.14959 -215.45294 11.69665 2.99181 -215.44827 1002.82192
7260.0000 -225.55177 -213.78467 11.76710 3.04600 -214.32785 1066.55050
7265.0000 -226.59218 -215.01990 11.57228 3.06557 -213.92337 1043.52465
7270.0000 -226.88837 -214.62706 12.26131 3.01007 -215.07060 995.64663
7275.0000 -224.46340 -213.32248 11.14093 3.06272 -213.98224 1049.43028
7280.0000 -224.71514 -211.97907 12.73607 3.09310 -213.35414 1080.44198
7285.0000 -225.33060 -211.76002 13.57058 3.19266 -211.29584 1133.30554
7290.0000 -227.71859 -214.62757 13.09103 3.07234 -213.78325 1034.19120
7295.0000 -228.69734 -216.01156 12.68578 2.97800 -215.73366 975.68480
7300.0000 -227.97662 -216.74251 11.23411 2.97726 -215.74905 985.12412
7305.0000 -228.25160 -215.64080 12.61079 2.98963 -215.49330 997.26643
7310.0000 -226.41079 -215.96595 10.44484 2.93970 -216.52545 969.50703
7315.0000 -227.20216 -213.97037 13.23179 2.99225 -215.43901 1003.22645
7320.0000 -228.26263 -214.02564 14.23699 3.04834 -214.27945 1031.62381
7325.0000 -225.33532 -212.30128 13.03404 3.07124 -213.80603 1027.91871
7330.0000 -226.62478 -213.43644 13.18834 3.11877 -212.82344 1090.04817
7335.0000 -227.21343 -214.96460 12.24883 3.00497 -215.17612 1020.11491
7340.0000 -228.06297 -215.65514 12.40783 2.95058 -216.30045 967.78439
7345.0000 -225.72443 -213.40638 12.31805 3.03881 -214.47642 1040.45526
7350.0000 -225.65532 -212.96863 12.68669 3.09173 -213.38251 1060.21448
7355.0000 -226.41089 -214.77580 11.63510 3.07472 -213.73416 1068.93556
7360.0000 -226.41961 -214.03983 12.37978 3.00451 -215.18570 993.60003
7365.0000 -226.37624 -215.18737 11.18888 3.08744 -213.47123 1056.97721
7370.0000 -228.23174 -216.34459 11.88714 3.02014 -214.86258 1020.87598
7375.0000 -228.33800 -215.57083 12.76717 2.97957 -215.70111 979.92242
7380.0000 -225.22719 -213.89477 11.33242 3.02015 -214.86224 1029.46590
7385.0000 -226.03986 -213.82527 12.21459 3.09607 -213.29264 1059.39375
7390.0000 -227.52709 -212.90028 14.62681 3.04279 -214.39427 1015.47598
7395.0000 -229.23033 -215.56586 13.66447 3.09619 -213.29022 1072.76040
7400.0000 -226.00821 -213.63645 12.37177 3.03268 -214.60314 1033.97919
7405.0000 -227.57267 -214.08846 13.48420 3.05503 -214.14110 1007.42251
7410.0000 -227.18739 -216.84049 10.34690 2.98988 -215.48809 999.16265
7415.0000 -228.89490 -216.51876 12.37613 2.98007 -215.69094 979.73742
7420.0000 -226.97518 -216.06540 10.90978 2.89269 -217.49724 945.50601
7425.0000 -229.63688 -216.80166 12.83522 2.90759 -217.18938 944.00963
7430.0000 -228.62340 -216.32940 12.29401 2.96988 -215.90152 981.27606
7435.0000 -227.10485 -215.34388 11.76097 2.97724 -215.74948 938.44233
7440.0000 -226.84518 -213.38484 13.46034 3.09377 -213.34030 1064.38774
7445.0000 -227.54147 -214.17154 13.36993 3.07818 -213.66251 1033.50691
7450.0000 -226.24541 -212.46748 13.77793 3.12669 -212.65976 1065.33661
7455.0000 -226.17283 -213.52988 12.64295 3.11162 -212.97130 1081.68804
7460.0000 -226.07905 -215.03979 11.03926 3.03600 -214.53453 1036.46838
7465.0000 -228.94953 -216.65842 12.29110 2.97268 -215.84360 988.82656
7470.0000 -227.80606 -216.04598 11.76008 2.93111 -216.70303 972.00421
7475.0000 -227.44911 -215.46760 11.98150 2.99649 -215.35138 997.56391
7480.0000 -228.75750 -217.42918 11.32832 2.92594 -216.80992 964.76897
7485.0000 -227.43116 -214.37446 13.05670 2.94492 -216.41762 990.46423
7490.0000 -226.77410 -214.19355 12.58055 3.09716 -213.27025 1081.39825
7495.0000 -226.75519 -214.56631 12.18888 2.96461 -216.01050 988.41208
7500.0000 -228.43735 -216.98544 11.45190 2.96190 -216.06662 963.10240
MELTING PROCESS: loop number 31 T-loop= 1054.0000000000000
main_MD> interactions number 31 at Temperature= 1054.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.33844 0.46403 3.99929
force_rgl> df(natom) -1.54131 -0.92220 1.17626
7505.0000 -227.12735 -215.65733 11.47002 2.97884 -215.71622 1031.41003
7510.0000 -226.78588 -214.95168 11.83420 3.00041 -215.27043 1036.76288
7515.0000 -229.14479 -216.79357 12.35122 3.00468 -215.18206 1015.48115
7520.0000 -226.03498 -212.82402 13.21095 3.02354 -214.79218 1014.66607
7525.0000 -227.53103 -215.05672 12.47431 3.07276 -213.77466 1027.29116
7530.0000 -227.58347 -213.32137 14.26210 3.09249 -213.36671 1079.56338
7535.0000 -228.67109 -214.58334 14.08775 3.08097 -213.60491 1105.88428
7540.0000 -222.60529 -209.42797 13.17731 3.17463 -211.66860 1112.75041
7545.0000 -225.74645 -213.06816 12.67829 3.25429 -210.02165 1161.59735
7550.0000 -226.45656 -213.08402 13.37254 3.11717 -212.85655 1075.07243
7555.0000 -227.93584 -215.33112 12.60472 3.08710 -213.47810 1057.03708
7560.0000 -228.28175 -216.34939 11.93237 2.98733 -215.54076 993.03651
7565.0000 -229.10822 -216.82453 12.28368 2.91769 -216.98056 967.96176
7570.0000 -230.66396 -218.36518 12.29877 2.91475 -217.04129 947.07097
7575.0000 -225.18822 -214.77617 10.41205 2.92615 -216.80550 963.28305
7580.0000 -229.28531 -214.87511 14.41019 3.01654 -214.93695 997.23649
7585.0000 -227.09989 -212.29204 14.80785 3.09148 -213.38756 1052.78653
7590.0000 -227.87872 -215.92474 11.95398 3.07949 -213.63554 1055.54450
7595.0000 -226.55255 -214.09525 12.45730 3.04535 -214.34130 1043.12087
7600.0000 -225.79570 -213.41253 12.38317 3.10927 -213.01989 1059.03237
7605.0000 -227.45290 -216.42829 11.02461 3.04112 -214.42882 1023.74543
7610.0000 -228.03229 -215.06817 12.96412 2.98053 -215.68138 1005.73999
7615.0000 -227.21783 -215.62846 11.58936 2.97311 -215.83478 1006.69268
7620.0000 -229.13089 -218.10276 11.02814 2.89291 -217.49279 935.72638
7625.0000 -227.68736 -215.35260 12.33476 2.93538 -216.61469 951.02300
7630.0000 -227.45696 -215.80873 11.64822 2.96264 -216.05121 962.79809
7635.0000 -229.43590 -217.11170 12.32421 2.94666 -216.38150 970.70732
7640.0000 -228.45103 -216.65077 11.80026 2.91716 -216.99145 971.91190
7645.0000 -227.16148 -214.29452 12.86696 2.99067 -215.47165 1021.15278
7650.0000 -226.48994 -214.36889 12.12104 3.04959 -214.25367 1056.72295
7655.0000 -226.29569 -212.25893 14.03676 3.13112 -212.56809 1072.60961
7660.0000 -225.34905 -213.15047 12.19859 3.12675 -212.65836 1076.93657
7665.0000 -224.94540 -210.10738 14.83802 3.24936 -210.12362 1163.28856
7670.0000 -222.24399 -209.64834 12.59565 3.22021 -210.72627 1124.03109
7675.0000 -226.45774 -212.83685 13.62088 3.18121 -211.53253 1115.33275
7680.0000 -226.52382 -214.07000 12.45382 3.07159 -213.79881 1034.43500
7685.0000 -226.98752 -215.12072 11.86680 3.03765 -214.50051 1032.84549
7690.0000 -228.44772 -215.99857 12.44915 3.01748 -214.91755 1020.59292
7695.0000 -228.45402 -215.08732 13.36670 3.04537 -214.34096 1032.60499
7700.0000 -227.11150 -214.72534 12.38616 3.03596 -214.53552 1044.00204
7705.0000 -225.51091 -213.97250 11.53840 3.08851 -213.44893 1057.90908
7710.0000 -227.46576 -215.31692 12.14884 3.02414 -214.77986 1007.84798
7715.0000 -225.80201 -213.09854 12.70347 3.07233 -213.78362 1053.05480
7720.0000 -225.90007 -211.35471 14.54535 3.14720 -212.23562 1120.42398
7725.0000 -226.28273 -211.92610 14.35663 3.26469 -209.80682 1195.69612
7730.0000 -226.46404 -214.04850 12.41554 3.11558 -212.88947 1086.70637
7735.0000 -223.93701 -210.49751 13.43950 3.19182 -211.31318 1138.16964
7740.0000 -226.56843 -213.09817 13.47026 3.15865 -211.99905 1114.79218
7745.0000 -224.91858 -212.33023 12.58835 3.11680 -212.86415 1089.29877
7750.0000 -224.88372 -212.57351 12.31021 3.13603 -212.46655 1099.13747
MELTING PROCESS: loop number 32 T-loop= 1079.0000000000000
main_MD> interactions number 32 at Temperature= 1079.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.12604 1.10771 0.14595
force_rgl> df(natom) -4.00722 -0.56346 3.50940
7755.0000 -226.12237 -212.75883 13.36354 3.10133 -213.18400 1062.48577
7760.0000 -223.99655 -212.10288 11.89367 3.10123 -213.18602 1088.57500
7765.0000 -224.76520 -210.93893 13.82627 3.17361 -211.68965 1091.67275
7770.0000 -227.70503 -213.08311 14.62192 3.17950 -211.56784 1114.96622
7775.0000 -227.33278 -214.30500 13.02778 3.10160 -213.17846 1086.26239
7780.0000 -225.78169 -213.16858 12.61311 3.08194 -213.58485 1074.85069
7785.0000 -223.84543 -211.00033 12.84510 3.15519 -212.07040 1099.43813
7790.0000 -225.58258 -211.72504 13.85754 3.19760 -211.19373 1083.24731
7795.0000 -226.44766 -213.35054 13.09712 3.10755 -213.05547 1072.43763
7800.0000 -227.93809 -213.39538 14.54271 3.08071 -213.61028 1070.22557
7805.0000 -226.32508 -214.82207 11.50301 3.02632 -214.73476 1025.33405
7810.0000 -227.64920 -214.31911 13.33009 3.03410 -214.57385 1052.11025
7815.0000 -225.82237 -213.51312 12.30925 3.05476 -214.14685 1063.15340
7820.0000 -225.83243 -213.68048 12.15195 3.10045 -213.20221 1074.12191
7825.0000 -227.82062 -211.64151 16.17911 3.10121 -213.18650 1086.49483
7830.0000 -225.10815 -212.78033 12.32782 3.15293 -212.11713 1108.46990
7835.0000 -225.22854 -213.09080 12.13774 3.12422 -212.71071 1080.70206
7840.0000 -224.11684 -211.93288 12.18396 3.11747 -212.85023 1054.86407
7845.0000 -226.86071 -214.40534 12.45537 3.09517 -213.31128 1074.61032
7850.0000 -226.99709 -213.33649 13.66060 3.06755 -213.88235 1042.78432
7855.0000 -224.04220 -211.08058 12.96161 3.13502 -212.48757 1051.74590
7860.0000 -227.57482 -214.21950 13.35531 3.15491 -212.07626 1068.23179
7865.0000 -225.82104 -214.36581 11.45524 3.04678 -214.31179 1031.77022
7870.0000 -223.95053 -209.85387 14.09666 3.12678 -212.65791 1070.01118
7875.0000 -223.82042 -211.54746 12.27296 3.15663 -212.04083 1089.95491
7880.0000 -227.96944 -215.80220 12.16724 3.11869 -212.82507 1076.26240
7885.0000 -227.11139 -216.33041 10.78098 2.97032 -215.89250 1022.78518
7890.0000 -226.01617 -213.14682 12.86935 3.10040 -213.20317 1066.74892
7895.0000 -226.13655 -212.76461 13.37194 3.17541 -211.65250 1107.81099
7900.0000 -226.89741 -215.38869 11.50873 3.13002 -212.59076 1083.87250
7905.0000 -225.78427 -212.41188 13.37239 3.06164 -214.00456 1052.52986
7910.0000 -226.71483 -212.10133 14.61349 3.17766 -211.60606 1143.63330
7915.0000 -224.97637 -211.74817 13.22820 3.20090 -211.12547 1136.20205
7920.0000 -224.20491 -210.07575 14.12916 3.17409 -211.67983 1126.45804
7925.0000 -226.22358 -212.41530 13.80828 3.19141 -211.32159 1121.00158
7930.0000 -222.99342 -210.51243 12.48099 3.25463 -210.01471 1182.27014
7935.0000 -226.67095 -213.64590 13.02505 3.16601 -211.84671 1114.71928
7940.0000 -225.36944 -213.01706 12.35238 3.07792 -213.66794 1031.75070
7945.0000 -226.24647 -213.61003 12.63643 3.08284 -213.56628 1039.35090
7950.0000 -227.20760 -213.49886 13.70874 3.13355 -212.51778 1108.30438
7955.0000 -228.06316 -216.44526 11.61791 3.00691 -215.13596 1014.25626
7960.0000 -225.60791 -214.89001 10.71790 3.01143 -215.04261 1003.27957
7965.0000 -226.79863 -212.83872 13.95991 3.05613 -214.11852 1035.52910
7970.0000 -225.21792 -212.75666 12.46127 3.06872 -213.85808 1038.36146
7975.0000 -225.69858 -214.49230 11.20628 3.06914 -213.84953 1041.90385
7980.0000 -227.79594 -214.71071 13.08524 3.02018 -214.86171 1021.30647
7985.0000 -225.55212 -212.97807 12.57405 3.08728 -213.47453 1060.86685
7990.0000 -225.83437 -211.38308 14.45128 3.08135 -213.59714 1060.32775
7995.0000 -226.12593 -214.32158 11.80435 3.10709 -213.06493 1082.01599
8000.0000 -226.94285 -212.87953 14.06332 3.12324 -212.73111 1050.70563
MELTING PROCESS: loop number 33 T-loop= 1104.0000000000000
main_MD> interactions number 33 at Temperature= 1104.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.01430 3.95020 -2.99752
force_rgl> df(natom) -0.41090 -1.28586 3.93948
8005.0000 -223.46110 -210.74504 12.71606 3.17812 -211.59644 1120.31071
8010.0000 -224.31533 -210.41748 13.89784 3.18378 -211.47942 1120.84200
8015.0000 -223.34723 -208.57256 14.77467 3.26046 -209.89426 1174.68149
8020.0000 -223.63263 -210.41577 13.21686 3.32188 -208.62445 1196.38158
8025.0000 -223.72690 -210.02638 13.70052 3.25741 -209.95732 1162.58451
8030.0000 -223.08840 -207.92478 15.16362 3.29856 -209.10649 1191.56478
8035.0000 -223.63547 -211.19834 12.43714 3.29287 -209.22421 1176.97428
8040.0000 -224.59959 -210.49941 14.10018 3.17870 -211.58444 1113.17162
8045.0000 -223.93609 -209.17629 14.75980 3.31372 -208.79302 1192.73784
8050.0000 -224.78731 -209.57093 15.21638 3.37260 -207.57584 1225.76226
8055.0000 -223.33685 -209.31335 14.02350 3.29049 -209.27342 1156.69718
8060.0000 -223.37633 -208.64020 14.73613 3.37558 -207.51421 1228.63851
8065.0000 -223.82643 -210.21271 13.61372 3.30286 -209.01759 1209.16021
8070.0000 -224.74605 -212.99106 11.75499 3.19811 -211.18315 1098.98307
8075.0000 -224.48139 -209.93799 14.54340 3.24413 -210.23184 1149.00097
8080.0000 -222.51393 -207.45288 15.06105 3.33387 -208.37654 1198.29487
8085.0000 -222.78423 -209.17211 13.61212 3.29706 -209.13750 1181.67678
8090.0000 -223.31292 -210.03478 13.27815 3.24155 -210.28511 1127.06805
8095.0000 -225.37049 -211.24149 14.12900 3.23790 -210.36058 1162.00907
8100.0000 -222.73941 -210.29667 12.44274 3.20410 -211.05939 1076.80441
8105.0000 -221.87439 -207.63488 14.23951 3.24916 -210.12786 1130.29703
8110.0000 -222.53320 -209.48646 13.04674 3.35721 -207.89393 1215.94204
8115.0000 -221.47846 -204.88693 16.59153 3.39103 -207.19479 1272.10522
8120.0000 -220.46924 -207.05882 13.41043 3.45954 -205.77843 1286.56576
8125.0000 -226.48952 -211.28306 15.20645 3.30580 -208.95689 1190.97223
8130.0000 -225.02515 -211.39137 13.63378 3.18361 -211.48298 1118.45540
8135.0000 -225.76019 -211.47039 14.28980 3.20807 -210.97721 1139.32075
8140.0000 -226.29744 -212.26752 14.02992 3.16407 -211.88697 1083.78017
8145.0000 -226.34347 -213.40299 12.94047 3.16869 -211.79143 1101.43332
8150.0000 -226.75761 -214.27588 12.48173 3.15249 -212.12641 1099.99131
8155.0000 -224.95716 -212.76268 12.19448 3.05396 -214.16335 1028.98742
8160.0000 -225.77055 -213.74795 12.02259 3.12032 -212.79149 1072.32132
8165.0000 -226.15167 -214.05779 12.09388 3.03131 -214.63158 1022.91293
8170.0000 -226.43199 -213.15980 13.27219 3.09543 -213.30600 1049.37063
8175.0000 -224.45476 -212.24586 12.20890 3.10820 -213.04186 1045.63831
8180.0000 -225.27261 -212.62068 12.65192 3.11384 -212.92543 1089.90857
8185.0000 -226.40431 -212.94734 13.45697 3.08239 -213.57554 1051.08119
8190.0000 -225.23544 -209.62208 15.61336 3.20869 -210.96446 1126.93644
8195.0000 -226.93584 -214.31946 12.61638 3.16965 -211.77154 1097.86336
8200.0000 -225.99247 -212.14198 13.85049 3.06365 -213.96300 1029.96698
8205.0000 -224.55101 -212.52313 12.02787 3.14231 -212.33682 1092.37209
8210.0000 -224.65641 -210.80639 13.85002 3.20806 -210.97741 1147.71847
8215.0000 -226.40503 -211.95949 14.44554 3.21748 -210.78268 1152.67139
8220.0000 -224.27958 -212.30726 11.97231 3.20151 -211.11280 1113.48608
8225.0000 -224.30475 -210.14049 14.16427 3.15374 -212.10052 1116.62682
8230.0000 -224.29902 -209.74723 14.55178 3.22656 -210.59502 1129.50385
8235.0000 -222.39886 -208.90564 13.49322 3.32333 -208.59440 1170.74572
8240.0000 -224.60277 -209.64643 14.95634 3.36030 -207.83009 1215.12715
8245.0000 -226.35243 -211.58732 14.76511 3.25168 -210.07573 1150.40561
8250.0000 -225.19741 -213.38878 11.80863 3.16059 -211.95887 1107.94864
MELTING PROCESS: loop number 34 T-loop= 1129.0000000000000
main_MD> interactions number 34 at Temperature= 1129.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.20681 0.70649 -0.39529
force_rgl> df(natom) -3.15960 1.91361 -0.94445
8255.0000 -225.61508 -212.47561 13.13947 3.13306 -212.52804 1099.05571
8260.0000 -225.45857 -212.64318 12.81539 3.15076 -212.16216 1081.20909
8265.0000 -222.98182 -209.60498 13.37684 3.22233 -210.68256 1122.23122
8270.0000 -224.68368 -213.42111 11.26258 3.19380 -211.27236 1107.71171
8275.0000 -226.62001 -214.37371 12.24630 3.02849 -214.68988 1018.38510
8280.0000 -223.93486 -210.99174 12.94312 3.08411 -213.53992 1067.80673
8285.0000 -223.49469 -208.87514 14.61956 3.26726 -209.75367 1151.34109
8290.0000 -225.99300 -211.07882 14.91418 3.22315 -210.66545 1162.95424
8295.0000 -225.43556 -211.70642 13.72914 3.23343 -210.45293 1126.98999
8300.0000 -225.49374 -213.39257 12.10116 3.14012 -212.38195 1082.40253
8305.0000 -225.64513 -213.07746 12.56767 3.08369 -213.54859 1064.03460
8310.0000 -224.58500 -212.29300 12.29201 3.10067 -213.19766 1057.41537
8315.0000 -222.60823 -209.50092 13.10731 3.25411 -210.02538 1150.81213
8320.0000 -225.28516 -211.28469 14.00047 3.27060 -209.68459 1192.49297
8325.0000 -226.25845 -212.53189 13.72656 3.18052 -211.54674 1122.89887
8330.0000 -223.12583 -208.86677 14.25906 3.22941 -210.53608 1131.74217
8335.0000 -223.41892 -206.78384 16.63508 3.35975 -207.84154 1217.60247
8340.0000 -220.55259 -205.86787 14.68472 3.37886 -207.44648 1221.08229
8345.0000 -223.46029 -209.80737 13.65292 3.38967 -207.22289 1206.43296
8350.0000 -227.95463 -212.65053 15.30410 3.23087 -210.50590 1121.62507
8355.0000 -223.37298 -209.35955 14.01342 3.25157 -210.07795 1143.95644
8360.0000 -225.37496 -213.19911 12.17584 3.18456 -211.46321 1086.47270
8365.0000 -225.09939 -212.93088 12.16851 3.08459 -213.53009 1064.16955
8370.0000 -224.81152 -211.85743 12.95409 3.14841 -212.21061 1108.66881
8375.0000 -223.50689 -209.69826 13.80863 3.16110 -211.94836 1102.78733
8380.0000 -224.90494 -207.65586 17.24908 3.25375 -210.03285 1155.42519
8385.0000 -221.72532 -206.75173 14.97359 3.32132 -208.63595 1179.22531
8390.0000 -220.08168 -206.07336 14.00832 3.36379 -207.75806 1217.19035
8395.0000 -223.12385 -210.25657 12.86728 3.35861 -207.86507 1243.39678
8400.0000 -224.35704 -211.45960 12.89744 3.16606 -211.84580 1094.19699
8405.0000 -225.74881 -213.45472 12.29409 3.13631 -212.46074 1076.05998
8410.0000 -227.62667 -215.46825 12.15842 2.99930 -215.29337 1017.67189
8415.0000 -226.32525 -210.86689 15.45836 3.13341 -212.52085 1069.47800
8420.0000 -225.70474 -211.71769 13.98705 3.20176 -211.10767 1155.60595
8425.0000 -225.93209 -212.04231 13.88978 3.16042 -211.96231 1090.07471
8430.0000 -227.10735 -214.09950 13.00786 3.04899 -214.26612 1057.20400
8435.0000 -228.66312 -216.76690 11.89622 2.98827 -215.52134 1023.67890
8440.0000 -226.08657 -211.17044 14.91612 3.04919 -214.26200 1033.16343
8445.0000 -226.48833 -212.20845 14.27988 3.12940 -212.60359 1076.40984
8450.0000 -227.97880 -214.39652 13.58228 3.11319 -212.93869 1087.57947
8455.0000 -226.35355 -211.43819 14.91535 3.16512 -211.86516 1107.01193
8460.0000 -224.15444 -209.72394 14.43050 3.21027 -210.93186 1135.49279
8465.0000 -222.68653 -211.22372 11.46281 3.23235 -210.47541 1154.43450
8470.0000 -225.12219 -212.00316 13.11904 3.12268 -212.74267 1043.47378
8475.0000 -222.19679 -208.96505 13.23173 3.23671 -210.38527 1170.03416
8480.0000 -226.40179 -210.40185 15.99994 3.23794 -210.35975 1152.57820
8485.0000 -222.14394 -207.31723 14.82670 3.27032 -209.69036 1160.75353
8490.0000 -226.52953 -214.58625 11.94328 3.16634 -211.84007 1111.08681
8495.0000 -225.67649 -211.12719 14.54930 3.14085 -212.36701 1119.02719
8500.0000 -225.10089 -209.63287 15.46802 3.18407 -211.47348 1139.29381
MELTING PROCESS: loop number 35 T-loop= 1154.0000000000000
main_MD> interactions number 35 at Temperature= 1154.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.87146 0.59943 -4.09708
force_rgl> df(natom) -2.16863 -2.01899 1.23310
8505.0000 -223.67688 -210.71990 12.95698 3.19624 -211.22184 1116.72340
8510.0000 -225.68241 -211.53518 14.14723 3.17227 -211.71734 1108.72413
8515.0000 -224.09052 -209.95990 14.13061 3.21591 -210.81522 1145.86271
8520.0000 -223.07962 -207.46185 15.61777 3.29105 -209.26181 1202.58184
8525.0000 -222.03584 -208.57912 13.45672 3.35793 -207.87911 1236.06125
8530.0000 -225.90658 -213.93335 11.97323 3.18298 -211.49605 1100.17404
8535.0000 -223.72483 -210.87543 12.84940 3.14682 -212.24361 1086.76285
8540.0000 -224.96754 -210.19041 14.77713 3.26389 -209.82322 1159.16483
8545.0000 -223.39445 -206.14352 17.25093 3.43260 -206.33545 1279.96598
8550.0000 -227.08635 -210.16167 16.92468 3.29831 -209.11171 1179.31558
8555.0000 -224.85059 -211.08335 13.76724 3.23271 -210.46779 1125.40182
8560.0000 -223.23839 -211.03898 12.19941 3.20019 -211.14027 1122.69029
8565.0000 -226.08794 -212.68809 13.39985 3.16132 -211.94381 1117.18082
8570.0000 -225.35985 -213.46793 11.89191 3.11510 -212.89925 1092.33131
8575.0000 -223.38568 -208.53312 14.85256 3.21534 -210.82702 1135.49721
8580.0000 -223.60372 -210.97228 12.63144 3.26979 -209.70119 1180.80506
8585.0000 -222.54619 -207.78544 14.76075 3.27646 -209.56349 1161.59558
8590.0000 -223.27560 -208.05131 15.22429 3.34899 -208.06396 1252.18812
8595.0000 -224.98691 -211.41495 13.57196 3.23755 -210.36779 1145.13027
8600.0000 -225.11663 -213.49629 11.62034 3.16806 -211.80435 1097.96587
8605.0000 -226.78246 -212.01534 14.76713 3.15801 -212.01210 1113.08457
8610.0000 -224.10416 -212.05965 12.04450 3.16732 -211.81966 1122.09096
8615.0000 -224.74706 -211.03030 13.71676 3.18207 -211.51486 1130.82073
8620.0000 -225.65082 -211.80254 13.84828 3.21048 -210.92748 1128.74495
8625.0000 -224.00032 -210.55431 13.44600 3.19408 -211.26643 1091.43331
8630.0000 -226.21764 -212.67352 13.54411 3.19140 -211.32190 1106.09240
8635.0000 -224.08873 -210.76745 13.32128 3.14089 -212.36603 1079.12066
8640.0000 -220.28758 -207.73886 12.54871 3.18160 -211.52445 1133.08648
8645.0000 -224.55875 -209.53610 15.02265 3.38196 -207.38236 1249.34099
8650.0000 -224.17059 -210.80375 13.36685 3.28596 -209.36706 1165.44268
8655.0000 -224.05883 -211.17125 12.88758 3.34327 -208.18226 1221.41643
8660.0000 -224.57498 -210.88727 13.68771 3.18906 -211.37037 1137.01464
8665.0000 -225.13764 -210.43963 14.69801 3.24878 -210.13558 1142.91422
8670.0000 -223.57546 -209.49627 14.07919 3.26676 -209.76386 1169.08231
8675.0000 -227.06756 -211.79436 15.27320 3.28331 -209.42181 1160.67305
8680.0000 -225.69901 -212.50138 13.19763 3.22362 -210.65587 1141.48003
8685.0000 -226.27818 -211.69702 14.58116 3.09303 -213.35549 1072.35073
8690.0000 -227.18188 -214.16816 13.01372 3.09871 -213.23809 1061.31125
8695.0000 -226.22063 -214.66517 11.55546 3.07918 -213.64191 1063.51098
8700.0000 -224.86450 -211.69918 13.16531 3.14934 -212.19137 1150.35013
8705.0000 -223.64994 -210.54709 13.10285 3.20418 -211.05776 1137.31922
8710.0000 -226.05407 -211.57470 14.47937 3.19727 -211.20062 1154.27922
8715.0000 -223.32720 -209.36240 13.96480 3.26443 -209.81213 1190.87668
8720.0000 -225.60836 -210.73898 14.86937 3.28788 -209.32727 1187.66235
8725.0000 -225.45432 -210.78466 14.66966 3.25448 -210.01778 1190.42062
8730.0000 -225.45248 -213.70952 11.74296 3.12179 -212.76101 1069.38080
8735.0000 -223.38576 -209.27460 14.11115 3.18384 -211.47819 1106.85944
8740.0000 -224.01185 -211.00984 13.00200 3.29558 -209.16804 1155.96570
8745.0000 -224.62296 -211.02708 13.59587 3.22335 -210.66141 1150.35209
8750.0000 -224.42393 -209.93091 14.49302 3.23006 -210.52259 1149.39510
MELTING PROCESS: loop number 36 T-loop= 1179.0000000000000
main_MD> interactions number 36 at Temperature= 1179.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.79584 -5.30330 1.76922
force_rgl> df(natom) 2.44458 0.20904 -0.16191
8755.0000 -224.37993 -211.78054 12.59939 3.20305 -211.08112 1101.25407
8760.0000 -223.37551 -206.87715 16.49836 3.27245 -209.64624 1146.99870
8765.0000 -222.25179 -207.77361 14.47818 3.31396 -208.78823 1199.92977
8770.0000 -223.40599 -208.43186 14.97413 3.39563 -207.09961 1238.89015
8775.0000 -226.43407 -211.12782 15.30624 3.27404 -209.61350 1192.66459
8780.0000 -223.96640 -209.77182 14.19458 3.23674 -210.38455 1137.61737
8785.0000 -222.99093 -207.90783 15.08309 3.29391 -209.20269 1182.98384
8790.0000 -222.34960 -207.83581 14.51379 3.34032 -208.24317 1204.21836
8795.0000 -221.59601 -207.15262 14.44339 3.38875 -207.24188 1234.50971
8800.0000 -222.33235 -207.32984 15.00251 3.39453 -207.12245 1263.10548
8805.0000 -225.88369 -211.88117 14.00252 3.28442 -209.39883 1157.08100
8810.0000 -225.18066 -208.69031 16.49035 3.27690 -209.55438 1147.07861
8815.0000 -225.15975 -209.82942 15.33033 3.25383 -210.03133 1154.01634
8820.0000 -224.67377 -210.14930 14.52447 3.27581 -209.57692 1157.58237
8825.0000 -224.66494 -212.45565 12.20930 3.24391 -210.23631 1142.14640
8830.0000 -224.38433 -208.53430 15.85003 3.23915 -210.33471 1136.15528
8835.0000 -221.97764 -207.09111 14.88653 3.35418 -207.95654 1209.62103
8840.0000 -222.39813 -208.22639 14.17174 3.31337 -208.80041 1218.97360
8845.0000 -226.12928 -210.79375 15.33554 3.20467 -211.04753 1116.43111
8850.0000 -223.08496 -207.95096 15.13400 3.27471 -209.59963 1163.39157
8855.0000 -224.78077 -209.13677 15.64400 3.35259 -207.98949 1236.84574
8860.0000 -224.69477 -211.37783 13.31694 3.25492 -210.00866 1168.10481
8865.0000 -225.17919 -211.30485 13.87434 3.18493 -211.45568 1142.09694
8870.0000 -226.66156 -212.88141 13.78015 3.15662 -212.04101 1079.56738
8875.0000 -224.73106 -211.90531 12.82575 3.16261 -211.91714 1107.31322
8880.0000 -226.57227 -214.25717 12.31510 3.07696 -213.68785 1073.26246
8885.0000 -224.78937 -210.89367 13.89571 3.16814 -211.80271 1099.25059
8890.0000 -228.67415 -215.67896 12.99519 3.16497 -211.86836 1140.26844
8895.0000 -225.41666 -210.68312 14.73354 3.06476 -213.94001 1034.64479
8900.0000 -222.35090 -210.13248 12.21842 3.23046 -210.51443 1162.47294
8905.0000 -224.48032 -210.55893 13.92138 3.26918 -209.71391 1167.72237
8910.0000 -222.98750 -209.84339 13.14410 3.20807 -210.97721 1125.11221
8915.0000 -221.99383 -209.08688 12.90695 3.28307 -209.42676 1189.46099
8920.0000 -222.11393 -206.22359 15.89034 3.43216 -206.34447 1252.00767
8925.0000 -221.04724 -206.67318 14.37406 3.45362 -205.90094 1291.78724
8930.0000 -225.51551 -208.65769 16.85781 3.38868 -207.24336 1229.92869
8935.0000 -223.85110 -209.78848 14.06262 3.29441 -209.19240 1158.61602
8940.0000 -223.75646 -210.35135 13.40512 3.28277 -209.43293 1184.91279
8945.0000 -224.11249 -208.57025 15.54223 3.25524 -210.00200 1140.56714
8950.0000 -222.07257 -207.65037 14.42220 3.30854 -208.90009 1181.65534
8955.0000 -220.61305 -206.98144 13.63162 3.43382 -206.31028 1258.67023
8960.0000 -223.03885 -209.59847 13.44038 3.33891 -208.27230 1199.47590
8965.0000 -224.30695 -210.05976 14.24719 3.27809 -209.52967 1180.50488
8970.0000 -223.38168 -209.29523 14.08645 3.26206 -209.86106 1142.24908
8975.0000 -223.23872 -206.98504 16.25368 3.30122 -209.05161 1174.77549
8980.0000 -221.58029 -208.26359 13.31670 3.32772 -208.50370 1215.50800
8985.0000 -224.67200 -209.63696 15.03503 3.30678 -208.93664 1185.34509
8990.0000 -224.55182 -213.18695 11.36487 3.17885 -211.58143 1135.40435
8995.0000 -225.59273 -212.70509 12.88764 3.14903 -212.19790 1104.67443
9000.0000 -225.00252 -210.69187 14.31065 3.15722 -212.02852 1131.33665
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 16 [min], 25.3498386 [s].
main_MD> Deallocating global variables
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