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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_19/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_19.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 = 19 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: 19 1900
main_MD> Size of nv and nvoiz: 19 1900
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 = 19
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> -9.8162173807164327E-003 -0.10945285968195338 -0.22744381368928626 initial drift of cluster / NP1 for coalescence
init> 0.41981057082387363 0.38309834368349210 0.24971577235208409 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8534067712265747E-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) -1.73606 2.46450 -0.15715
force_rgl> df(natom) 0.44336 -0.23029 -1.40441
preparo> THERMALIZATION PROCESS AT 299.20472709250402
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -44.450356780358689 1.0251733186548000 -45.475530099013490 3.7817123740964490E-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= 323.00000000000000
main_MD> interactions number 1 at Temperature= 323.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.25225 0.17578 1.44260
force_rgl> df(natom) -1.55177 0.88468 -1.72497
5.0000 -44.91318 -44.21561 0.69757 1.64112 -44.36459 321.42731
10.0000 -45.07836 -44.39399 0.68438 1.66724 -44.17865 356.92055
15.0000 -45.53176 -44.70723 0.82453 1.61187 -44.57288 288.89628
20.0000 -45.35091 -44.74074 0.61017 1.60502 -44.62170 272.89595
25.0000 -45.31442 -44.59695 0.71747 1.62425 -44.48478 300.02393
30.0000 -45.22747 -44.43882 0.78865 1.66484 -44.19571 358.79963
35.0000 -45.28737 -44.82983 0.45754 1.60558 -44.61766 276.99418
40.0000 -45.37048 -44.80316 0.56732 1.57889 -44.80774 240.34368
45.0000 -45.36766 -44.60388 0.76377 1.59231 -44.71214 262.55088
50.0000 -45.28187 -44.79053 0.49134 1.58338 -44.77573 244.30047
55.0000 -45.09842 -44.57825 0.52017 1.60484 -44.62295 277.34570
60.0000 -45.31023 -44.61741 0.69281 1.60799 -44.60053 279.58713
65.0000 -45.39894 -44.75509 0.64385 1.61484 -44.55177 294.38841
70.0000 -45.14367 -44.37084 0.77283 1.61363 -44.56036 288.33443
75.0000 -44.95845 -44.08077 0.87768 1.66430 -44.19958 354.45655
80.0000 -45.27722 -44.47519 0.80204 1.64283 -44.35247 331.28815
85.0000 -45.15548 -44.20488 0.95060 1.62820 -44.45659 317.06489
90.0000 -45.25947 -44.40280 0.85667 1.64795 -44.31599 328.37831
95.0000 -45.17334 -44.45579 0.71755 1.62799 -44.45813 301.86350
100.0000 -45.27621 -44.66395 0.61226 1.62472 -44.48140 306.88163
105.0000 -45.29633 -44.72396 0.57237 1.61612 -44.54264 284.39371
110.0000 -45.06984 -44.27868 0.79116 1.65198 -44.28732 339.31013
115.0000 -45.37808 -44.81863 0.55945 1.61932 -44.51984 295.66172
120.0000 -45.40704 -44.60999 0.79705 1.59560 -44.68875 254.00960
125.0000 -45.27907 -44.47175 0.80732 1.63249 -44.42606 310.65349
130.0000 -45.19394 -44.39482 0.79913 1.63227 -44.42764 306.95761
135.0000 -44.81151 -44.05390 0.75761 1.65399 -44.27300 334.93579
140.0000 -45.08197 -44.34872 0.73324 1.67152 -44.14820 361.73445
145.0000 -45.29676 -44.03021 1.26655 1.66322 -44.20725 355.57657
150.0000 -44.96331 -44.49784 0.46547 1.64658 -44.32572 338.47416
155.0000 -45.13642 -44.46427 0.67214 1.62517 -44.47817 312.09610
160.0000 -45.21595 -44.31487 0.90109 1.63610 -44.40038 325.88688
165.0000 -44.98603 -44.29438 0.69165 1.65226 -44.28530 349.92917
170.0000 -45.36944 -44.58017 0.78927 1.61327 -44.56290 284.40672
175.0000 -45.33753 -44.72515 0.61238 1.62405 -44.48616 301.47184
180.0000 -45.10784 -44.59135 0.51649 1.60123 -44.64862 266.82108
185.0000 -45.29535 -44.48376 0.81159 1.62124 -44.50617 289.88883
190.0000 -45.03557 -44.32138 0.71419 1.62364 -44.48912 301.74075
195.0000 -45.24473 -44.56551 0.67922 1.62237 -44.49815 293.78215
200.0000 -45.27949 -44.79173 0.48776 1.58270 -44.78059 242.88039
205.0000 -45.23750 -44.53954 0.69796 1.61419 -44.55638 291.37641
210.0000 -45.38818 -44.33699 1.05119 1.62798 -44.45815 302.61498
215.0000 -45.31090 -44.38726 0.92363 1.63860 -44.38259 336.28815
220.0000 -45.05041 -44.10627 0.94414 1.66775 -44.17502 363.22200
225.0000 -45.41023 -44.73311 0.67712 1.64030 -44.37044 321.78379
230.0000 -45.31874 -44.68718 0.63156 1.58935 -44.73323 248.46713
235.0000 -44.97042 -44.24570 0.72471 1.63105 -44.43633 309.86178
240.0000 -45.18743 -44.43551 0.75192 1.65058 -44.29730 338.68745
245.0000 -45.27506 -44.49424 0.78082 1.63335 -44.41995 313.16594
250.0000 -45.30432 -44.50004 0.80428 1.60453 -44.62516 275.19841
MELTING PROCESS: loop number 2 T-loop= 348.00000000000000
main_MD> interactions number 2 at Temperature= 348.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.72887 2.04019 4.64809
force_rgl> df(natom) 0.07080 1.59281 -1.91901
255.0000 -45.23204 -44.07958 1.15246 1.67556 -44.11942 371.42647
260.0000 -44.81706 -44.10879 0.70827 1.69234 -43.99991 412.47620
265.0000 -45.02075 -43.82918 1.19157 1.68641 -44.04211 396.02645
270.0000 -44.90295 -44.15323 0.74972 1.69119 -44.00810 389.84619
275.0000 -45.19268 -44.28188 0.91080 1.65897 -44.23750 334.06313
280.0000 -45.01857 -44.47235 0.54622 1.64440 -44.34127 333.10466
285.0000 -45.18433 -44.49235 0.69198 1.61130 -44.57694 280.40546
290.0000 -45.11815 -44.34552 0.77263 1.64048 -44.36920 326.21659
295.0000 -45.21266 -44.43951 0.77315 1.63972 -44.37459 319.79195
300.0000 -45.31672 -44.58913 0.72759 1.61670 -44.53851 289.96563
305.0000 -45.10717 -44.31350 0.79367 1.64622 -44.32827 334.45245
310.0000 -45.20619 -44.42285 0.78334 1.65269 -44.28222 342.91201
315.0000 -45.02917 -44.15511 0.87406 1.68129 -44.07860 373.76614
320.0000 -45.19374 -44.07378 1.11996 1.67661 -44.11190 371.45150
325.0000 -45.10268 -44.35705 0.74563 1.67660 -44.11196 381.81132
330.0000 -45.19571 -44.48110 0.71461 1.64420 -44.34271 326.75119
335.0000 -45.17173 -44.36315 0.80858 1.63448 -44.41193 313.19003
340.0000 -45.01397 -44.15273 0.86124 1.65501 -44.26570 344.33177
345.0000 -45.43353 -44.40819 1.02534 1.63127 -44.43478 317.58190
350.0000 -44.97699 -43.94874 1.02825 1.65111 -44.29347 346.25008
355.0000 -44.79324 -43.99953 0.79371 1.70115 -43.93720 398.99071
360.0000 -44.76452 -44.06247 0.70205 1.68297 -44.06663 378.17539
365.0000 -45.24692 -44.44331 0.80361 1.63835 -44.38433 316.43437
370.0000 -45.20462 -44.19211 1.01250 1.64004 -44.37229 313.12103
375.0000 -45.25552 -44.55593 0.69959 1.65010 -44.30066 342.50208
380.0000 -45.09307 -44.04493 1.04814 1.62578 -44.47387 301.97737
385.0000 -45.00379 -44.12258 0.88121 1.68892 -44.02429 390.21933
390.0000 -44.83420 -43.86165 0.97255 1.68099 -44.08072 378.15030
395.0000 -45.15591 -44.34488 0.81103 1.68527 -44.05025 384.07969
400.0000 -45.19169 -44.36941 0.82228 1.64418 -44.34284 330.28903
405.0000 -44.74135 -43.96341 0.77794 1.65548 -44.26239 344.77995
410.0000 -45.33219 -44.49348 0.83871 1.65833 -44.24209 341.46237
415.0000 -45.53581 -44.77433 0.76148 1.62050 -44.51146 291.02794
420.0000 -45.04887 -44.26031 0.78856 1.61045 -44.58304 281.49833
425.0000 -45.14052 -44.30499 0.83552 1.64942 -44.30552 335.98975
430.0000 -45.37713 -44.60246 0.77467 1.61199 -44.57207 280.29566
435.0000 -45.23729 -44.39369 0.84360 1.63105 -44.43635 308.82526
440.0000 -45.04267 -44.19652 0.84615 1.64734 -44.32033 341.36497
445.0000 -45.17319 -44.35033 0.82286 1.64407 -44.34364 333.12419
450.0000 -45.18077 -44.53806 0.64271 1.62708 -44.46460 297.40932
455.0000 -45.25972 -44.56456 0.69516 1.62406 -44.48610 300.19103
460.0000 -45.20214 -44.29718 0.90496 1.62840 -44.45520 318.93379
465.0000 -45.24662 -44.64684 0.59978 1.62067 -44.51025 293.72511
470.0000 -44.89974 -44.08085 0.81889 1.64321 -44.34975 332.41542
475.0000 -45.25378 -44.27001 0.98377 1.66595 -44.18784 359.03627
480.0000 -45.14500 -44.35912 0.78588 1.65817 -44.24323 343.80481
485.0000 -45.28454 -44.44281 0.84174 1.62161 -44.50355 301.95368
490.0000 -44.93978 -44.03798 0.90180 1.67210 -44.14402 362.89017
495.0000 -45.24017 -44.46429 0.77588 1.65749 -44.24808 361.90200
500.0000 -44.98044 -44.00241 0.97804 1.65660 -44.25437 357.89446
MELTING PROCESS: loop number 3 T-loop= 373.00000000000000
main_MD> interactions number 3 at Temperature= 373.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.51073 -4.06698 -0.70326
force_rgl> df(natom) -0.03927 1.30275 0.17592
505.0000 -45.19818 -43.88702 1.31117 1.67414 -44.12954 364.20324
510.0000 -45.36875 -44.26580 1.10295 1.68047 -44.08444 390.44435
515.0000 -45.22297 -44.22265 1.00032 1.64717 -44.32153 335.31051
520.0000 -45.07190 -44.16363 0.90827 1.66562 -44.19021 363.79294
525.0000 -45.20981 -44.18745 1.02235 1.66497 -44.19480 383.66746
530.0000 -44.72571 -43.80590 0.91981 1.69358 -43.99112 409.04736
535.0000 -45.16227 -44.17405 0.98823 1.68201 -44.07346 383.48191
540.0000 -44.98573 -44.19936 0.78637 1.66839 -44.17045 353.51086
545.0000 -44.98303 -44.01281 0.97021 1.68661 -44.04075 381.33656
550.0000 -44.77076 -44.08382 0.68693 1.68221 -44.07204 388.16709
555.0000 -44.90701 -44.08679 0.82022 1.68099 -44.08070 370.83289
560.0000 -44.99040 -43.49984 1.49056 1.71165 -43.86244 433.32475
565.0000 -44.70242 -43.92725 0.77517 1.73774 -43.67668 461.98261
570.0000 -44.79866 -43.85291 0.94575 1.67495 -44.12374 369.49809
575.0000 -45.28092 -44.42052 0.86040 1.66818 -44.17192 358.39216
580.0000 -45.36390 -44.61989 0.74401 1.61871 -44.52421 301.93354
585.0000 -45.26337 -44.29549 0.96789 1.63200 -44.42956 325.72429
590.0000 -45.07802 -44.35489 0.72313 1.66795 -44.17357 360.16781
595.0000 -45.04290 -43.70206 1.34084 1.68169 -44.07572 380.86774
600.0000 -44.68503 -43.48046 1.20457 1.74864 -43.59907 492.11387
605.0000 -45.12576 -44.00413 1.12163 1.70053 -43.94158 413.94840
610.0000 -45.19598 -44.23011 0.96587 1.70340 -43.92114 425.26793
615.0000 -44.84972 -43.98465 0.86507 1.68167 -44.07593 378.75950
620.0000 -44.99741 -44.16780 0.82961 1.69801 -43.95951 411.84514
625.0000 -45.31992 -44.51781 0.80211 1.65106 -44.29384 335.81605
630.0000 -45.18457 -43.94545 1.23912 1.66155 -44.21915 347.92771
635.0000 -44.82022 -44.04942 0.77081 1.69054 -44.01270 386.60569
640.0000 -45.03876 -44.17287 0.86589 1.66014 -44.22918 343.26401
645.0000 -44.83349 -43.91996 0.91353 1.70271 -43.92610 414.56391
650.0000 -44.99963 -44.35908 0.64055 1.67992 -44.08832 382.10931
655.0000 -45.07095 -44.00346 1.06749 1.66629 -44.18538 369.09131
660.0000 -44.78419 -43.88418 0.90000 1.68769 -44.03305 384.59270
665.0000 -45.03622 -44.05630 0.97993 1.67740 -44.10630 374.63200
670.0000 -44.79071 -43.54060 1.25010 1.69068 -44.01173 395.24723
675.0000 -44.95435 -43.99841 0.95594 1.71503 -43.83837 420.25619
680.0000 -45.30143 -44.39315 0.90828 1.66447 -44.19836 348.03633
685.0000 -45.30529 -44.49092 0.81438 1.65155 -44.29033 332.21212
690.0000 -45.13403 -44.44706 0.68697 1.63939 -44.37692 321.58645
695.0000 -44.87244 -43.98085 0.89159 1.64159 -44.36127 318.42886
700.0000 -45.22709 -44.44966 0.77743 1.64937 -44.30590 343.62036
705.0000 -44.90409 -43.98047 0.92362 1.66315 -44.20775 367.20445
710.0000 -45.14269 -44.40029 0.74240 1.67622 -44.11470 388.32951
715.0000 -45.11033 -44.05373 1.05660 1.63331 -44.42025 321.65092
720.0000 -45.28648 -44.15887 1.12761 1.68030 -44.08566 390.97055
725.0000 -45.20920 -44.42499 0.78421 1.64936 -44.30598 345.31344
730.0000 -45.37325 -44.54129 0.83196 1.62562 -44.47496 312.38041
735.0000 -44.92953 -44.25185 0.67768 1.60606 -44.61424 273.34657
740.0000 -45.19961 -44.33188 0.86773 1.64918 -44.30723 338.13735
745.0000 -44.90639 -43.98905 0.91734 1.65631 -44.25650 340.50348
750.0000 -44.65098 -43.62469 1.02629 1.70753 -43.89179 414.47009
MELTING PROCESS: loop number 4 T-loop= 398.00000000000000
main_MD> interactions number 4 at Temperature= 398.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.81110 -1.90736 5.92509
force_rgl> df(natom) 0.40859 0.59030 -0.23858
755.0000 -44.95844 -44.12143 0.83701 1.70895 -43.88163 430.30136
760.0000 -44.79733 -43.72799 1.06933 1.71015 -43.87309 411.58959
765.0000 -44.71532 -43.30369 1.41163 1.76562 -43.47813 487.75669
770.0000 -45.03264 -43.99766 1.03499 1.74256 -43.64234 457.69808
775.0000 -44.80920 -43.82984 0.97935 1.69656 -43.96988 402.14192
780.0000 -44.97565 -43.91654 1.05912 1.71858 -43.81305 441.83463
785.0000 -45.00901 -44.16754 0.84147 1.70048 -43.94197 416.57995
790.0000 -45.25833 -44.35970 0.89862 1.65415 -44.27188 353.94897
795.0000 -44.61877 -43.96551 0.65325 1.66050 -44.22665 350.53246
800.0000 -44.98882 -43.85262 1.13620 1.69000 -44.01661 384.29575
805.0000 -44.94757 -44.07369 0.87388 1.71616 -43.83028 435.85084
810.0000 -44.71469 -43.71389 1.00081 1.70840 -43.88555 411.03917
815.0000 -44.82613 -43.81318 1.01296 1.72672 -43.75510 439.58161
820.0000 -45.02760 -43.54298 1.48463 1.69693 -43.96724 395.05769
825.0000 -45.11512 -44.17149 0.94363 1.69955 -43.94856 405.11917
830.0000 -45.06000 -43.86866 1.19134 1.70835 -43.88592 421.31944
835.0000 -44.66557 -43.64105 1.02451 1.72025 -43.80119 428.42268
840.0000 -45.13865 -44.01143 1.12723 1.73504 -43.69591 448.40692
845.0000 -44.57201 -43.65965 0.91236 1.70495 -43.91012 405.79402
850.0000 -44.95667 -44.03917 0.91750 1.71718 -43.82306 429.65048
855.0000 -45.14285 -44.31609 0.82676 1.68271 -44.06851 380.59181
860.0000 -44.88921 -43.85338 1.03582 1.67469 -44.12559 383.23478
865.0000 -44.95072 -44.07352 0.87720 1.69668 -43.96901 399.29430
870.0000 -45.08112 -43.99828 1.08284 1.69142 -44.00643 394.68946
875.0000 -45.16642 -44.23378 0.93264 1.64177 -44.35997 325.06807
880.0000 -44.90687 -43.60090 1.30597 1.70162 -43.93384 417.63172
885.0000 -44.91483 -43.91645 0.99837 1.73011 -43.73096 448.46979
890.0000 -44.99746 -44.06978 0.92769 1.68587 -44.04597 378.82384
895.0000 -44.84209 -43.87247 0.96962 1.69436 -43.98552 385.75222
900.0000 -45.15009 -44.07081 1.07928 1.70639 -43.89989 416.04369
905.0000 -44.98424 -43.61145 1.37279 1.73009 -43.73114 452.10449
910.0000 -44.95747 -44.10054 0.85694 1.70736 -43.89295 404.32842
915.0000 -45.00988 -44.01811 0.99177 1.70161 -43.93394 403.27585
920.0000 -44.97287 -43.54195 1.43092 1.69303 -43.99503 394.34056
925.0000 -44.85468 -43.52295 1.33173 1.76495 -43.48289 491.12196
930.0000 -45.13133 -44.21166 0.91967 1.76765 -43.46365 488.37538
935.0000 -44.85301 -43.99305 0.85996 1.67405 -44.13014 361.70595
940.0000 -45.23201 -44.33617 0.89584 1.67011 -44.15819 375.04089
945.0000 -45.06590 -43.99139 1.07451 1.67431 -44.12827 374.31656
950.0000 -45.09321 -44.19819 0.89502 1.67690 -44.10985 369.93291
955.0000 -45.07718 -44.14281 0.93437 1.66840 -44.17039 368.41428
960.0000 -44.55317 -43.60848 0.94468 1.71427 -43.84378 434.18649
965.0000 -45.05976 -43.84834 1.21141 1.73281 -43.71176 451.38911
970.0000 -44.83806 -43.60141 1.23665 1.71681 -43.82572 425.85708
975.0000 -44.97927 -43.77529 1.20399 1.74355 -43.63529 455.46417
980.0000 -44.79202 -43.83517 0.95685 1.72413 -43.77354 432.61935
985.0000 -44.77301 -43.98507 0.78794 1.71423 -43.84406 419.36448
990.0000 -44.92242 -43.90020 1.02222 1.69362 -43.99083 385.81179
995.0000 -44.84556 -43.67648 1.16908 1.70234 -43.92869 401.27596
1000.0000 -44.92124 -43.99570 0.92554 1.73238 -43.71479 449.38952
MELTING PROCESS: loop number 5 T-loop= 423.00000000000000
main_MD> interactions number 5 at Temperature= 423.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.46992 0.04826 -1.46893
force_rgl> df(natom) -1.28754 -0.55039 2.66220
1005.0000 -44.76644 -43.93881 0.82763 1.72077 -43.79746 440.83192
1010.0000 -44.80565 -43.74699 1.05866 1.70327 -43.92206 396.97103
1015.0000 -45.13667 -43.84164 1.29503 1.72189 -43.78952 430.65241
1020.0000 -44.92820 -43.97608 0.95212 1.69394 -43.98852 384.82685
1025.0000 -45.04553 -43.47552 1.57001 1.69565 -43.97636 394.56748
1030.0000 -44.59856 -43.58288 1.01568 1.74143 -43.65039 460.34016
1035.0000 -44.98193 -43.92206 1.05986 1.76166 -43.50630 481.47595
1040.0000 -45.19204 -44.23424 0.95780 1.66684 -44.18146 354.47317
1045.0000 -45.26616 -44.08344 1.18272 1.66928 -44.16413 374.88868
1050.0000 -44.98284 -43.93534 1.04751 1.70036 -43.94282 406.12068
1055.0000 -44.58047 -43.73591 0.84456 1.68771 -44.03291 395.15829
1060.0000 -45.06712 -43.99712 1.07000 1.71188 -43.86077 424.06714
1065.0000 -44.83911 -44.07698 0.76213 1.68752 -44.03422 385.09218
1070.0000 -45.02995 -44.07512 0.95483 1.65314 -44.27901 345.59949
1075.0000 -45.05490 -44.15058 0.90431 1.66119 -44.22172 358.76260
1080.0000 -44.86034 -43.70111 1.15923 1.71935 -43.80758 435.24476
1085.0000 -44.75001 -43.47417 1.27584 1.76159 -43.50682 488.46905
1090.0000 -44.84828 -43.67806 1.17022 1.74668 -43.61301 485.45033
1095.0000 -44.75106 -43.74335 1.00771 1.72462 -43.77005 437.50859
1100.0000 -44.86255 -43.66126 1.20129 1.73570 -43.69120 453.51207
1105.0000 -44.84659 -43.56919 1.27740 1.73199 -43.71761 471.24953
1110.0000 -45.08176 -43.98448 1.09728 1.71573 -43.83341 438.94182
1115.0000 -44.77947 -44.13285 0.64662 1.69040 -44.01372 406.11822
1120.0000 -44.89253 -43.69456 1.19796 1.70798 -43.88852 419.30792
1125.0000 -44.85925 -43.85484 1.00441 1.71390 -43.84637 422.68568
1130.0000 -45.04074 -44.23041 0.81032 1.68447 -44.05598 386.53366
1135.0000 -44.83148 -43.82046 1.01102 1.68297 -44.06663 387.57476
1140.0000 -44.92874 -43.59876 1.32998 1.74862 -43.59916 463.16867
1145.0000 -44.37367 -43.55138 0.82229 1.75275 -43.56974 482.09702
1150.0000 -44.70630 -43.61903 1.08727 1.73228 -43.71550 455.44360
1155.0000 -44.26430 -43.65322 0.61108 1.71105 -43.86673 414.77584
1160.0000 -44.85054 -43.97405 0.87650 1.72983 -43.73297 446.46583
1165.0000 -44.72204 -43.68581 1.03623 1.72907 -43.73837 453.80387
1170.0000 -44.67664 -43.59770 1.07894 1.76978 -43.44852 491.53900
1175.0000 -44.69610 -43.61540 1.08070 1.74911 -43.59570 460.54879
1180.0000 -44.85079 -43.91278 0.93801 1.69451 -43.98450 398.99796
1185.0000 -45.21747 -44.33875 0.87872 1.67847 -44.09865 388.62900
1190.0000 -45.06054 -44.01601 1.04452 1.64484 -44.33815 336.77063
1195.0000 -44.49132 -43.33905 1.15227 1.74522 -43.62339 458.74022
1200.0000 -44.76089 -43.36222 1.39866 1.79319 -43.28182 571.86678
1205.0000 -44.89127 -43.87395 1.01732 1.74272 -43.64121 471.95682
1210.0000 -44.92318 -43.94058 0.98260 1.70054 -43.94151 397.94194
1215.0000 -44.94402 -43.97183 0.97219 1.70804 -43.88811 420.39874
1220.0000 -45.02626 -43.96495 1.06131 1.66211 -44.21513 359.20462
1225.0000 -44.93224 -44.07568 0.85655 1.67565 -44.11879 364.73307
1230.0000 -45.19573 -43.89819 1.29754 1.71964 -43.80550 440.79110
1235.0000 -45.03930 -44.14742 0.89189 1.69107 -44.00900 406.84768
1240.0000 -45.25731 -44.19554 1.06177 1.64436 -44.34155 330.92164
1245.0000 -45.01097 -44.08190 0.92907 1.68417 -44.05811 380.75450
1250.0000 -45.24626 -44.21557 1.03069 1.66503 -44.19436 368.06969
MELTING PROCESS: loop number 6 T-loop= 448.00000000000000
main_MD> interactions number 6 at Temperature= 448.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.93395 -2.03854 2.57303
force_rgl> df(natom) -1.51312 -0.29509 2.03517
1255.0000 -44.95466 -43.60862 1.34604 1.72350 -43.77805 437.51175
1260.0000 -45.19234 -43.97476 1.21758 1.72691 -43.75373 446.17357
1265.0000 -45.21949 -44.53527 0.68422 1.67181 -44.14612 384.12479
1270.0000 -45.07601 -43.92978 1.14622 1.69473 -43.98292 399.56213
1275.0000 -45.19682 -43.72987 1.46695 1.74055 -43.65667 466.40205
1280.0000 -44.66427 -43.51969 1.14458 1.75652 -43.54293 502.70076
1285.0000 -44.32700 -43.17318 1.15382 1.76152 -43.50731 488.48494
1290.0000 -44.46847 -43.45228 1.01620 1.79386 -43.27709 512.85266
1295.0000 -44.76082 -43.67243 1.08839 1.76648 -43.47205 498.68688
1300.0000 -44.90582 -43.70153 1.20429 1.74291 -43.63981 483.36035
1305.0000 -44.82224 -43.73320 1.08904 1.71466 -43.84096 421.97968
1310.0000 -44.31617 -43.36127 0.95491 1.75939 -43.52247 479.23587
1315.0000 -44.37724 -43.33732 1.03992 1.76998 -43.44711 501.43166
1320.0000 -44.76578 -43.78518 0.98060 1.73428 -43.70128 443.16025
1325.0000 -44.83558 -43.96981 0.86577 1.70564 -43.90525 430.92321
1330.0000 -44.43396 -43.30042 1.13354 1.74571 -43.61991 467.93919
1335.0000 -44.57450 -43.53088 1.04362 1.80085 -43.22726 538.34603
1340.0000 -44.88909 -44.19818 0.69091 1.71912 -43.80923 429.84139
1345.0000 -45.13548 -44.12483 1.01064 1.65108 -44.29370 334.19918
1350.0000 -44.84308 -43.54522 1.29785 1.72113 -43.79491 420.50565
1355.0000 -44.49962 -43.34030 1.15932 1.78160 -43.36433 509.52823
1360.0000 -44.63854 -43.43619 1.20235 1.75068 -43.58454 469.59821
1365.0000 -44.93492 -43.92103 1.01389 1.74385 -43.63318 463.97618
1370.0000 -44.78947 -43.55817 1.23131 1.74910 -43.59574 464.98617
1375.0000 -45.11255 -43.92257 1.18998 1.72303 -43.78139 427.70305
1380.0000 -44.63960 -43.31763 1.32196 1.73534 -43.69375 459.41456
1385.0000 -45.02808 -43.91192 1.11615 1.72622 -43.75865 442.58776
1390.0000 -44.73934 -43.60470 1.13464 1.74329 -43.63714 453.69284
1395.0000 -44.78089 -43.46638 1.31451 1.75262 -43.57072 491.05728
1400.0000 -44.57024 -43.34710 1.22314 1.78240 -43.35869 507.85092
1405.0000 -44.15670 -43.06951 1.08719 1.77243 -43.42964 503.69616
1410.0000 -44.63381 -43.13191 1.50190 1.81448 -43.13027 555.89335
1415.0000 -44.46343 -42.97471 1.48872 1.84443 -42.91696 603.57240
1420.0000 -44.41535 -42.95791 1.45744 1.81485 -43.12759 585.04800
1425.0000 -44.42789 -43.26779 1.16010 1.78458 -43.34310 517.73599
1430.0000 -44.78410 -43.64099 1.14311 1.78343 -43.35133 489.99521
1435.0000 -44.72805 -43.60860 1.11945 1.69261 -43.99801 396.33895
1440.0000 -44.81039 -43.67475 1.13563 1.73749 -43.67844 473.78536
1445.0000 -44.61678 -43.52305 1.09373 1.74483 -43.62618 459.66503
1450.0000 -44.66965 -43.41855 1.25110 1.77378 -43.42002 500.80495
1455.0000 -44.59045 -43.52587 1.06458 1.76165 -43.50641 508.53362
1460.0000 -44.76191 -43.37893 1.38298 1.74214 -43.64534 463.54932
1465.0000 -44.72625 -43.29503 1.43122 1.76668 -43.47056 526.78983
1470.0000 -44.75665 -43.19493 1.56172 1.79109 -43.29675 522.12808
1475.0000 -44.28180 -42.93383 1.34797 1.83730 -42.96777 552.72344
1480.0000 -44.30008 -43.27201 1.02807 1.82270 -43.07172 476.23022
1485.0000 -44.18944 -43.17686 1.01259 1.81261 -43.14353 501.34257
1490.0000 -44.66641 -43.60906 1.05734 1.77918 -43.38162 442.72083
1495.0000 -44.57193 -43.47280 1.09913 1.75263 -43.57062 403.26523
1500.0000 -44.27664 -43.24012 1.03652 1.75524 -43.55202 418.23844
MELTING PROCESS: loop number 7 T-loop= 473.00000000000000
main_MD> interactions number 7 at Temperature= 473.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.90955 0.88724 2.23222
force_rgl> df(natom) 0.41337 -2.49552 -0.25698
1505.0000 -43.55413 -42.06683 1.48730 1.86361 -42.78044 596.59662
1510.0000 -43.56738 -42.03204 1.53534 1.95836 -42.10575 662.12570
1515.0000 -44.23777 -43.15339 1.08437 1.88178 -42.65102 563.17222
1520.0000 -44.53768 -43.65689 0.88079 1.77017 -43.44575 421.46982
1525.0000 -44.58749 -43.23827 1.34922 1.76672 -43.47030 423.67111
1530.0000 -44.31260 -42.74754 1.56507 1.80276 -43.21370 488.10382
1535.0000 -44.63435 -42.74270 1.89165 1.89284 -42.57232 618.48108
1540.0000 -44.30941 -43.13510 1.17431 1.84682 -42.89995 500.65941
1545.0000 -44.26792 -43.09557 1.17234 1.80229 -43.21702 449.14188
1550.0000 -44.36005 -43.05144 1.30861 1.82335 -43.06711 495.35336
1555.0000 -44.10572 -42.93891 1.16680 1.80883 -43.17045 469.69010
1560.0000 -44.61077 -43.55036 1.06040 1.80077 -43.22783 467.60738
1565.0000 -44.23441 -43.16048 1.07393 1.80348 -43.20854 465.34532
1570.0000 -44.46827 -43.24498 1.22330 1.78151 -43.36501 520.64149
1575.0000 -44.54137 -43.42526 1.11611 1.78041 -43.37285 530.13768
1580.0000 -44.22318 -43.28951 0.93367 1.79598 -43.26193 520.39337
1585.0000 -44.69551 -43.74164 0.95387 1.75031 -43.58713 464.28643
1590.0000 -44.85041 -43.63549 1.21492 1.74442 -43.62908 453.94373
1595.0000 -44.89889 -43.63675 1.26214 1.75157 -43.57817 476.49631
1600.0000 -44.27853 -43.17672 1.10181 1.79217 -43.28912 528.94264
1605.0000 -44.57994 -43.44829 1.13165 1.82808 -43.03342 562.19451
1610.0000 -44.92632 -43.95771 0.96860 1.72532 -43.76509 434.91015
1615.0000 -44.47088 -43.13834 1.33254 1.75564 -43.54921 443.13793
1620.0000 -44.67909 -43.42091 1.25819 1.78423 -43.34563 416.42998
1625.0000 -44.66990 -43.72367 0.94622 1.77621 -43.40271 420.71058
1630.0000 -44.45444 -43.57167 0.88277 1.74081 -43.65476 400.40725
1635.0000 -44.17193 -43.17426 0.99767 1.80730 -43.18137 495.90816
1640.0000 -44.55022 -43.38218 1.16804 1.79427 -43.27416 444.80208
1645.0000 -44.08943 -42.91506 1.17437 1.79091 -43.29803 448.67090
1650.0000 -43.82194 -42.84155 0.98039 1.84979 -42.87883 533.54205
1655.0000 -44.49079 -43.12290 1.36788 1.79291 -43.28386 445.34344
1660.0000 -44.64607 -43.50576 1.14031 1.78087 -43.36958 437.60737
1665.0000 -44.38537 -43.25387 1.13150 1.77405 -43.41814 452.84519
1670.0000 -44.39336 -43.26860 1.12477 1.77492 -43.41195 443.29085
1675.0000 -44.02102 -43.05345 0.96758 1.80571 -43.19271 451.65905
1680.0000 -44.51139 -43.49105 1.02034 1.80786 -43.17735 469.91006
1685.0000 -44.30554 -42.92735 1.37819 1.80078 -43.22777 459.76680
1690.0000 -44.56366 -43.18757 1.37609 1.82327 -43.06765 511.47175
1695.0000 -44.52892 -42.94245 1.58648 1.84347 -42.92385 513.40237
1700.0000 -44.50510 -43.35387 1.15123 1.79725 -43.25292 451.42795
1705.0000 -44.92390 -43.98756 0.93633 1.73793 -43.67528 455.70383
1710.0000 -44.81147 -43.82075 0.99072 1.70801 -43.88834 420.35252
1715.0000 -45.03294 -44.14346 0.88948 1.69937 -43.94984 419.73926
1720.0000 -45.14735 -44.22204 0.92532 1.64972 -44.30338 343.18842
1725.0000 -44.30949 -43.44285 0.86664 1.73003 -43.73155 459.93359
1730.0000 -44.85465 -43.28464 1.57001 1.81914 -43.09703 551.79563
1735.0000 -44.53352 -43.20126 1.33225 1.82400 -43.06247 564.26553
1740.0000 -44.62558 -43.56625 1.05933 1.77898 -43.38301 507.75465
1745.0000 -44.90468 -43.84220 1.06249 1.75852 -43.52866 477.68371
1750.0000 -44.82595 -43.69765 1.12830 1.74973 -43.59130 467.83771
MELTING PROCESS: loop number 8 T-loop= 498.00000000000000
main_MD> interactions number 8 at Temperature= 498.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.56551 -4.54884 0.29485
force_rgl> df(natom) -1.81792 2.98276 0.96469
1755.0000 -44.93674 -43.80645 1.13029 1.70509 -43.90911 410.22351
1760.0000 -44.64251 -43.33396 1.30856 1.73736 -43.67937 447.08894
1765.0000 -44.45666 -43.43489 1.02177 1.75121 -43.58076 452.99932
1770.0000 -44.85976 -43.75812 1.10164 1.73508 -43.69556 439.18303
1775.0000 -44.55268 -43.66210 0.89059 1.75414 -43.55986 473.04365
1780.0000 -44.63191 -43.67542 0.95648 1.74522 -43.62337 461.67965
1785.0000 -44.68835 -43.61834 1.07001 1.72687 -43.75406 441.22275
1790.0000 -43.97055 -42.74985 1.22070 1.75621 -43.54512 470.26167
1795.0000 -44.38212 -43.05014 1.33198 1.89311 -42.57038 629.43861
1800.0000 -44.77056 -43.34725 1.42331 1.80315 -43.21091 530.00349
1805.0000 -44.77812 -43.52445 1.25366 1.77392 -43.41904 513.71065
1810.0000 -44.76533 -43.57812 1.18721 1.77028 -43.44492 485.45087
1815.0000 -44.62790 -43.32158 1.30633 1.76208 -43.50332 499.51671
1820.0000 -44.66302 -43.45124 1.21178 1.75713 -43.53861 487.74201
1825.0000 -44.56868 -43.44609 1.12259 1.78558 -43.33604 517.91541
1830.0000 -44.67021 -43.38260 1.28761 1.79572 -43.26381 532.57367
1835.0000 -44.67538 -43.54202 1.13337 1.78111 -43.36786 514.62288
1840.0000 -44.93220 -43.38539 1.54681 1.76368 -43.49195 493.83828
1845.0000 -44.56779 -43.50345 1.06434 1.76402 -43.48951 506.55488
1850.0000 -44.65050 -43.14794 1.50255 1.76549 -43.47906 492.92498
1855.0000 -44.43017 -43.29533 1.13484 1.78955 -43.30777 531.16101
1860.0000 -44.66161 -43.60083 1.06078 1.78354 -43.35057 510.31393
1865.0000 -44.84557 -43.77791 1.06766 1.73672 -43.68389 448.78499
1870.0000 -44.70569 -43.84993 0.85576 1.74868 -43.59873 463.76436
1875.0000 -44.81441 -43.53871 1.27570 1.71007 -43.87367 424.35034
1880.0000 -44.77629 -43.41308 1.36321 1.75650 -43.54310 478.66322
1885.0000 -44.41726 -43.41979 0.99747 1.76794 -43.46165 489.73831
1890.0000 -44.65499 -43.31341 1.34158 1.81334 -43.13835 534.90783
1895.0000 -44.33194 -43.04220 1.28974 1.80692 -43.18405 575.59730
1900.0000 -44.63445 -43.30461 1.32985 1.78760 -43.32166 520.33689
1905.0000 -44.07925 -42.69054 1.38872 1.82703 -43.04087 484.27445
1910.0000 -44.43414 -43.23171 1.20242 1.83628 -42.97501 516.70030
1915.0000 -43.76386 -42.71430 1.04957 1.84904 -42.88416 491.91526
1920.0000 -44.38913 -42.66947 1.71966 1.87472 -42.70131 538.65515
1925.0000 -44.18574 -43.14681 1.03893 1.79711 -43.25390 476.68367
1930.0000 -44.44364 -43.50664 0.93700 1.81087 -43.15597 502.84623
1935.0000 -44.83471 -43.76507 1.06964 1.75845 -43.52919 424.18667
1940.0000 -44.70181 -43.61418 1.08764 1.73579 -43.69057 397.42088
1945.0000 -44.60261 -43.52823 1.07438 1.74498 -43.62507 405.38718
1950.0000 -44.22861 -42.99052 1.23809 1.79492 -43.26950 457.01635
1955.0000 -44.52811 -43.36230 1.16581 1.82239 -43.07390 519.46201
1960.0000 -44.73243 -43.67656 1.05587 1.75830 -43.53024 426.59643
1965.0000 -44.28573 -42.83365 1.45208 1.79676 -43.25641 477.45073
1970.0000 -43.65876 -42.43046 1.22830 1.90766 -42.46677 584.65833
1975.0000 -44.11681 -42.84251 1.27431 1.92257 -42.36059 614.67062
1980.0000 -44.34686 -43.13128 1.21558 1.85451 -42.84522 537.70536
1985.0000 -44.06965 -43.01132 1.05833 1.85240 -42.86021 533.98189
1990.0000 -44.10313 -42.70654 1.39659 1.87463 -42.70196 548.50358
1995.0000 -44.19872 -42.79876 1.39996 1.87256 -42.71671 569.41569
2000.0000 -44.58182 -43.16650 1.41532 1.86601 -42.76335 541.38225
MELTING PROCESS: loop number 9 T-loop= 523.00000000000000
main_MD> interactions number 9 at Temperature= 523.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.62884 -1.78541 1.17475
force_rgl> df(natom) 2.14462 4.68068 -1.27035
2005.0000 -44.45004 -43.26102 1.18902 1.81333 -43.13844 501.60193
2010.0000 -44.77937 -43.66465 1.11472 1.78895 -43.31199 535.27516
2015.0000 -44.81203 -43.91008 0.90196 1.74381 -43.63341 447.50729
2020.0000 -44.75624 -43.56348 1.19275 1.76390 -43.49039 487.99249
2025.0000 -44.91328 -43.56821 1.34508 1.72844 -43.74285 454.14094
2030.0000 -44.45729 -43.42674 1.03054 1.77249 -43.42923 508.87145
2035.0000 -44.44946 -43.32451 1.12495 1.76939 -43.45130 496.20571
2040.0000 -44.43855 -43.24678 1.19177 1.80787 -43.17727 540.98571
2045.0000 -44.70042 -43.45399 1.24642 1.76429 -43.48758 491.79798
2050.0000 -44.16832 -43.21111 0.95722 1.78445 -43.34407 529.16344
2055.0000 -44.58101 -42.72083 1.86018 1.82053 -43.08718 578.23779
2060.0000 -44.67237 -43.53592 1.13645 1.79387 -43.27701 533.04311
2065.0000 -44.75470 -43.72799 1.02671 1.73282 -43.71165 447.76227
2070.0000 -44.59379 -43.53127 1.06252 1.78112 -43.36775 504.97281
2075.0000 -44.64905 -43.32051 1.32854 1.78860 -43.31454 524.78807
2080.0000 -44.88887 -43.55119 1.33768 1.77954 -43.37903 510.25141
2085.0000 -44.69846 -43.57862 1.11984 1.76747 -43.46498 484.08321
2090.0000 -44.52048 -42.88585 1.63463 1.79269 -43.28540 512.96294
2095.0000 -44.36459 -42.78090 1.58369 1.85766 -42.82280 596.23058
2100.0000 -44.24373 -42.78744 1.45628 1.88668 -42.61611 631.42804
2105.0000 -44.52711 -43.14511 1.38200 1.84296 -42.92743 583.21368
2110.0000 -44.87662 -43.50348 1.37314 1.78477 -43.34175 520.63197
2115.0000 -44.93176 -43.90795 1.02380 1.73670 -43.68408 438.19833
2120.0000 -44.59939 -43.70478 0.89461 1.72192 -43.78929 437.47113
2125.0000 -44.92205 -43.53422 1.38784 1.75093 -43.58273 467.23604
2130.0000 -44.23135 -42.67421 1.55714 1.82960 -43.02254 598.67567
2135.0000 -43.87409 -42.46699 1.40710 1.87311 -42.71278 629.50571
2140.0000 -44.16721 -42.98966 1.17755 1.89975 -42.52307 641.80944
2145.0000 -44.67179 -43.47999 1.19180 1.79612 -43.26096 526.76033
2150.0000 -44.55563 -43.41239 1.14324 1.77224 -43.43100 495.12510
2155.0000 -44.79458 -43.09718 1.69740 1.78017 -43.37457 524.23341
2160.0000 -44.85182 -43.32323 1.52860 1.76976 -43.44867 494.52317
2165.0000 -44.44681 -42.89504 1.55177 1.79774 -43.24943 529.90811
2170.0000 -44.64543 -43.11799 1.52744 1.86059 -42.80189 635.61161
2175.0000 -45.10014 -43.96282 1.13732 1.74669 -43.61295 473.26920
2180.0000 -44.31928 -42.92612 1.39316 1.80082 -43.22750 554.11620
2185.0000 -44.86237 -43.66334 1.19903 1.79705 -43.25432 529.82779
2190.0000 -44.53622 -43.08232 1.45390 1.76937 -43.45146 509.89120
2195.0000 -44.59180 -43.24816 1.34364 1.77985 -43.37684 513.52576
2200.0000 -44.77089 -43.77597 0.99493 1.78514 -43.33917 517.21992
2205.0000 -44.36807 -43.18141 1.18666 1.79456 -43.27208 532.68520
2210.0000 -44.81118 -43.84396 0.96722 1.75095 -43.58262 490.87481
2215.0000 -44.86654 -43.45837 1.40817 1.76426 -43.48779 505.39370
2220.0000 -44.80287 -43.87220 0.93067 1.72986 -43.73279 453.30612
2225.0000 -45.08376 -43.91546 1.16829 1.71493 -43.83905 431.73311
2230.0000 -44.58739 -42.97206 1.61533 1.80272 -43.21398 538.07390
2235.0000 -43.98179 -42.52169 1.46010 1.87111 -42.72703 603.70619
2240.0000 -43.76563 -42.22573 1.53989 1.96361 -42.06835 638.84333
2245.0000 -43.65618 -42.50140 1.15478 1.93314 -42.28533 611.29836
2250.0000 -44.40119 -43.12795 1.27324 1.85963 -42.80876 542.71739
MELTING PROCESS: loop number 10 T-loop= 548.00000000000000
main_MD> interactions number 10 at Temperature= 548.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.47943 -2.26761 -1.50201
force_rgl> df(natom) -0.58776 -0.09314 2.43455
2255.0000 -43.85856 -42.48210 1.37646 1.83744 -42.96676 492.67400
2260.0000 -43.90823 -42.92230 0.98593 1.85603 -42.83436 521.43735
2265.0000 -44.27145 -42.47576 1.79570 1.88127 -42.65464 532.27759
2270.0000 -44.15114 -42.65712 1.49402 1.86814 -42.74813 533.06856
2275.0000 -44.42541 -43.52381 0.90161 1.79214 -43.28930 449.04336
2280.0000 -44.40441 -43.11861 1.28580 1.75280 -43.56939 402.05438
2285.0000 -44.20827 -42.91930 1.28897 1.82984 -43.02087 508.25987
2290.0000 -44.03310 -42.90003 1.13307 1.85972 -42.80811 523.69262
2295.0000 -44.27107 -42.78978 1.48128 1.89143 -42.58231 567.11950
2300.0000 -44.10034 -42.96264 1.13770 1.86754 -42.75246 549.52271
2305.0000 -43.95525 -42.36289 1.59236 1.86832 -42.74686 539.84004
2310.0000 -43.78417 -42.28824 1.49593 1.95451 -42.13315 664.19540
2315.0000 -43.96600 -42.57453 1.39146 1.92544 -42.34013 607.89198
2320.0000 -44.52772 -43.14760 1.38012 1.86533 -42.76816 627.75703
2325.0000 -44.80532 -43.22868 1.57664 1.81892 -43.09861 553.33184
2330.0000 -44.49628 -43.23023 1.26605 1.80797 -43.17660 576.84817
2335.0000 -44.67763 -43.85451 0.82312 1.74330 -43.63710 464.64162
2340.0000 -44.67063 -43.58115 1.08947 1.75381 -43.56223 469.10214
2345.0000 -44.60093 -43.76450 0.83642 1.71284 -43.85398 419.61278
2350.0000 -44.55922 -43.33877 1.22046 1.75223 -43.57347 462.76704
2355.0000 -44.98830 -43.42572 1.56257 1.78196 -43.36177 531.47520
2360.0000 -44.61785 -43.33478 1.28307 1.79079 -43.29892 538.48074
2365.0000 -44.56055 -43.37256 1.18799 1.80602 -43.19048 545.00701
2370.0000 -44.72748 -43.12961 1.59788 1.79873 -43.24237 547.90441
2375.0000 -44.49966 -42.91251 1.58715 1.80967 -43.16450 569.57119
2380.0000 -43.81258 -42.49754 1.31504 1.85195 -42.86340 571.64040
2385.0000 -43.95698 -42.97348 0.98350 1.88797 -42.60696 588.24164
2390.0000 -44.28848 -42.93833 1.35016 1.83164 -43.00807 479.39023
2395.0000 -44.00244 -43.02975 0.97269 1.84531 -42.91073 497.12607
2400.0000 -44.64732 -43.60480 1.04251 1.81880 -43.09947 478.12590
2405.0000 -44.45825 -42.89685 1.56140 1.83339 -42.99557 478.22112
2410.0000 -44.24776 -42.89121 1.35655 1.85531 -42.83952 542.55671
2415.0000 -44.22569 -42.73546 1.49023 1.87833 -42.67558 542.02282
2420.0000 -44.56038 -43.50691 1.05347 1.84369 -42.92227 510.53380
2425.0000 -44.07544 -42.68498 1.39045 1.80658 -43.18647 478.24273
2430.0000 -44.27197 -42.76246 1.50951 1.88292 -42.64293 555.03561
2435.0000 -44.18511 -42.14556 2.03955 1.92128 -42.36978 629.14015
2440.0000 -44.26538 -42.91715 1.34823 1.84748 -42.89529 535.59435
2445.0000 -44.29683 -42.32029 1.97654 1.82463 -43.05799 500.68730
2450.0000 -43.96835 -42.37443 1.59392 1.95390 -42.13753 652.69387
2455.0000 -44.16964 -42.99722 1.17242 1.86771 -42.75121 527.29089
2460.0000 -43.90783 -42.14208 1.76575 1.90506 -42.48525 616.66067
2465.0000 -44.28808 -42.58972 1.69837 1.95538 -42.12695 657.91016
2470.0000 -44.46406 -43.17611 1.28796 1.87720 -42.68364 556.45597
2475.0000 -44.41735 -43.43239 0.98496 1.77502 -43.41120 445.02347
2480.0000 -44.40477 -43.25025 1.15451 1.75934 -43.52286 426.57281
2485.0000 -44.23042 -43.15647 1.07396 1.81260 -43.14365 500.02414
2490.0000 -44.47438 -43.49273 0.98165 1.77193 -43.43320 419.46225
2495.0000 -44.21450 -42.94572 1.26878 1.82643 -43.04513 504.75529
2500.0000 -44.46973 -43.00153 1.46820 1.85188 -42.86390 531.30738
MELTING PROCESS: loop number 11 T-loop= 573.00000000000000
main_MD> interactions number 11 at Temperature= 573.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.52138 0.53615 0.70326
force_rgl> df(natom) -0.94022 -2.14934 2.40646
2505.0000 -44.19328 -43.08653 1.10676 1.80871 -43.17135 457.25569
2510.0000 -43.94590 -42.59280 1.35310 1.87679 -42.68655 551.15032
2515.0000 -44.27023 -43.19644 1.07379 1.85589 -42.83540 538.30076
2520.0000 -44.12168 -43.15057 0.97111 1.81168 -43.15019 459.06950
2525.0000 -44.46862 -43.33198 1.13664 1.81947 -43.09471 456.69839
2530.0000 -44.32834 -42.89710 1.43124 1.80566 -43.19300 473.83335
2535.0000 -43.87785 -42.60932 1.26853 1.84255 -42.93036 544.57995
2540.0000 -43.86715 -42.50414 1.36300 1.86071 -42.80106 564.87735
2545.0000 -43.56979 -42.05549 1.51430 1.89104 -42.58509 593.10068
2550.0000 -43.72278 -42.44065 1.28213 1.92516 -42.34212 620.97733
2555.0000 -44.13743 -42.27760 1.85983 1.94099 -42.22941 642.51672
2560.0000 -43.60687 -41.73770 1.86917 1.96806 -42.03670 665.71661
2565.0000 -44.00908 -42.39214 1.61694 1.94427 -42.20612 656.18056
2570.0000 -44.19864 -42.18612 2.01252 1.96479 -42.05995 675.25300
2575.0000 -44.06952 -42.15838 1.91114 1.98702 -41.90170 661.28813
2580.0000 -43.83585 -42.85414 0.98171 1.92116 -42.37065 609.63599
2585.0000 -44.33614 -42.84614 1.49000 1.85897 -42.81344 553.34889
2590.0000 -44.99123 -43.57021 1.42102 1.80573 -43.19252 535.88972
2595.0000 -44.28389 -43.04749 1.23640 1.80694 -43.18392 543.93200
2600.0000 -44.36338 -42.69975 1.66363 1.83362 -42.99394 563.28820
2605.0000 -44.61023 -43.43691 1.17332 1.83034 -43.01731 573.37432
2610.0000 -44.85599 -43.82584 1.03015 1.74391 -43.63275 455.80628
2615.0000 -45.04434 -43.59302 1.45132 1.72580 -43.76167 438.32579
2620.0000 -44.53045 -43.28725 1.24320 1.76103 -43.51084 503.13729
2625.0000 -44.12458 -42.45971 1.66487 1.87827 -42.67603 651.82893
2630.0000 -44.25807 -42.82914 1.42894 1.87812 -42.67708 627.51522
2635.0000 -44.02337 -42.76900 1.25437 1.85511 -42.84096 587.30712
2640.0000 -43.78062 -42.58458 1.19603 1.91943 -42.38294 626.43002
2645.0000 -44.47150 -42.35989 2.11162 1.91908 -42.38542 631.81440
2650.0000 -43.86517 -42.52166 1.34351 1.91752 -42.39656 650.47028
2655.0000 -43.81084 -42.43985 1.37099 1.89876 -42.53014 565.21701
2660.0000 -44.30018 -42.50917 1.79101 1.89865 -42.53092 573.98269
2665.0000 -43.75532 -42.31113 1.44419 1.90808 -42.46377 568.20372
2670.0000 -44.58109 -43.30363 1.27746 1.83219 -43.00411 465.80394
2675.0000 -43.86813 -42.85493 1.01320 1.83245 -43.00228 499.65425
2680.0000 -44.30680 -42.76040 1.54640 1.84957 -42.88037 521.67040
2685.0000 -44.02122 -43.23614 0.78508 1.84317 -42.92595 517.97782
2690.0000 -44.12372 -43.04885 1.07487 1.78305 -43.35404 460.51410
2695.0000 -44.09027 -42.95888 1.13139 1.85584 -42.83573 539.96846
2700.0000 -44.14046 -42.77488 1.36557 1.84837 -42.88889 523.08693
2705.0000 -44.33169 -43.01984 1.31185 1.89062 -42.58809 582.66323
2710.0000 -44.21678 -43.01487 1.20190 1.81784 -43.10631 480.55185
2715.0000 -44.12392 -42.81915 1.30476 1.82036 -43.08840 493.79591
2720.0000 -44.52821 -43.24408 1.28413 1.81545 -43.12330 515.23141
2725.0000 -44.37468 -43.23769 1.13699 1.78809 -43.31814 458.96214
2730.0000 -44.35987 -42.97180 1.38807 1.81968 -43.09321 511.78842
2735.0000 -44.34018 -43.17943 1.16074 1.81804 -43.10490 479.85431
2740.0000 -44.44145 -43.08563 1.35581 1.82836 -43.03138 495.58620
2745.0000 -44.54113 -42.94212 1.59901 1.81438 -43.13093 489.91351
2750.0000 -43.87040 -42.51529 1.35511 1.88041 -42.66080 544.45034
MELTING PROCESS: loop number 12 T-loop= 598.00000000000000
main_MD> interactions number 12 at Temperature= 598.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.37375 -1.99585 0.37014
force_rgl> df(natom) 0.18643 0.03348 1.42191
2755.0000 -44.04064 -42.19334 1.84730 1.95987 -42.09500 633.32330
2760.0000 -43.87403 -42.32237 1.55166 1.97149 -42.01230 690.32784
2765.0000 -43.89626 -42.90092 0.99534 1.88571 -42.62303 574.65150
2770.0000 -44.27614 -42.62021 1.65592 1.88036 -42.66113 586.31753
2775.0000 -43.68991 -42.21987 1.47004 1.95111 -42.15740 621.12053
2780.0000 -44.01067 -42.54419 1.46649 1.89218 -42.57701 567.81518
2785.0000 -44.04165 -42.25469 1.78696 1.92941 -42.31192 616.16271
2790.0000 -44.28742 -42.54382 1.74360 1.88353 -42.63859 590.96069
2795.0000 -43.96386 -42.72486 1.23900 1.86794 -42.74960 565.18543
2800.0000 -44.47661 -43.04494 1.43166 1.87927 -42.66889 644.54287
2805.0000 -44.08698 -42.72469 1.36229 1.83437 -42.98863 584.24046
2810.0000 -44.49360 -43.19472 1.29888 1.83323 -42.99671 584.79109
2815.0000 -44.60406 -43.04898 1.55507 1.79938 -43.23775 537.92509
2820.0000 -43.97236 -42.67104 1.30132 1.86536 -42.76797 633.79836
2825.0000 -44.04620 -42.08504 1.96115 1.87743 -42.68198 652.88779
2830.0000 -43.26931 -41.92149 1.34783 1.96636 -42.04877 750.30473
2835.0000 -43.16332 -41.91887 1.24445 1.99788 -41.82435 682.48779
2840.0000 -43.42648 -41.51626 1.91022 2.00777 -41.75397 668.77142
2845.0000 -44.31787 -42.04680 2.27107 1.96864 -42.03258 650.18327
2850.0000 -43.85510 -42.02998 1.82511 1.94487 -42.20184 674.57227
2855.0000 -43.61780 -42.41125 1.20656 1.93528 -42.27012 605.04934
2860.0000 -43.86825 -42.44848 1.41977 1.93445 -42.27603 650.01208
2865.0000 -43.74233 -42.00401 1.73832 1.94141 -42.22645 623.62972
2870.0000 -44.10585 -42.02712 2.07873 1.95233 -42.14866 662.13148
2875.0000 -44.01883 -42.62761 1.39122 1.90210 -42.50634 591.23843
2880.0000 -44.31026 -43.15371 1.15655 1.85702 -42.82734 556.29066
2885.0000 -44.04396 -42.97472 1.06924 1.82310 -43.06887 516.28597
2890.0000 -43.80761 -42.72781 1.07980 1.86587 -42.76429 558.79373
2895.0000 -43.91242 -42.06152 1.85090 1.89436 -42.56144 577.62847
2900.0000 -44.03788 -42.50552 1.53235 1.94638 -42.19106 659.62366
2905.0000 -43.77082 -41.86864 1.90218 1.95361 -42.13956 632.97348
2910.0000 -43.73467 -42.68917 1.04550 1.96070 -42.08908 663.08523
2915.0000 -44.33393 -42.97057 1.36337 1.86634 -42.76097 569.45533
2920.0000 -43.85037 -42.61574 1.23462 1.88124 -42.65486 571.31236
2925.0000 -43.87938 -42.20037 1.67901 1.94334 -42.21269 641.82114
2930.0000 -44.14322 -43.20798 0.93524 1.88293 -42.64283 553.75665
2935.0000 -44.31678 -42.91254 1.40424 1.82288 -43.07041 489.51823
2940.0000 -43.52714 -41.96728 1.55985 1.89075 -42.58714 571.66927
2945.0000 -44.12117 -43.04610 1.07508 1.94549 -42.19740 623.34617
2950.0000 -43.71375 -42.55760 1.15615 1.90435 -42.49030 589.32179
2955.0000 -43.89300 -42.65606 1.23695 1.89500 -42.55687 572.36377
2960.0000 -44.33949 -43.14581 1.19368 1.86620 -42.76194 546.38947
2965.0000 -44.38337 -43.15577 1.22761 1.81965 -43.09344 549.89656
2970.0000 -44.59389 -43.60271 0.99117 1.84435 -42.91753 591.86086
2975.0000 -44.51273 -43.30996 1.20277 1.78704 -43.32562 532.89249
2980.0000 -44.27350 -42.80292 1.47058 1.83433 -42.98892 579.89972
2985.0000 -44.06119 -42.79270 1.26848 1.84497 -42.91313 577.20628
2990.0000 -43.93606 -42.80053 1.13553 1.83271 -43.00040 506.94632
2995.0000 -44.24169 -42.78290 1.45879 1.86624 -42.76172 558.85815
3000.0000 -43.76839 -42.31785 1.45054 1.94318 -42.21387 643.63190
MELTING PROCESS: loop number 13 T-loop= 623.00000000000000
main_MD> interactions number 13 at Temperature= 623.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.38897 -6.29043 -0.35383
force_rgl> df(natom) 0.71838 1.83129 -0.54788
3005.0000 -44.04937 -42.05358 1.99579 1.93319 -42.28501 708.11809
3010.0000 -43.45373 -41.77615 1.67758 2.00470 -41.77580 725.84694
3015.0000 -44.17568 -41.94885 2.22683 1.96436 -42.06304 651.88468
3020.0000 -43.54075 -42.78965 0.75110 1.96858 -42.03299 649.14344
3025.0000 -43.88898 -42.78587 1.10311 1.85934 -42.81083 520.81984
3030.0000 -44.04567 -42.56315 1.48252 1.86282 -42.78604 530.43290
3035.0000 -42.87096 -41.65573 1.21522 1.94133 -42.22704 657.81476
3040.0000 -43.93394 -41.78594 2.14800 1.98804 -41.89439 670.57848
3045.0000 -43.50309 -41.86462 1.63847 1.97608 -41.97959 684.80452
3050.0000 -44.08055 -42.87162 1.20893 1.91764 -42.39570 600.37262
3055.0000 -43.98470 -42.19115 1.79355 1.90481 -42.48704 581.61033
3060.0000 -43.97696 -42.90462 1.07234 1.92117 -42.37057 617.41407
3065.0000 -44.46414 -42.81240 1.65174 1.84440 -42.91719 598.16052
3070.0000 -44.65089 -41.82760 2.82329 1.94173 -42.22417 720.76193
3075.0000 -43.83051 -41.58865 2.24186 2.02103 -41.65955 781.25808
3080.0000 -43.59529 -42.35245 1.24284 1.99788 -41.82439 679.69707
3085.0000 -44.41714 -42.54026 1.87688 1.88675 -42.61564 561.09748
3090.0000 -43.60507 -42.25880 1.34626 1.89705 -42.54230 589.27801
3095.0000 -44.07722 -42.70837 1.36885 1.88261 -42.64510 557.19385
3100.0000 -43.90058 -42.37896 1.52162 1.87671 -42.68714 554.75097
3105.0000 -43.46122 -42.16622 1.29500 1.90948 -42.45379 600.64031
3110.0000 -43.99979 -42.65286 1.34693 1.93431 -42.27703 593.11972
3115.0000 -43.59675 -42.13219 1.46457 1.90885 -42.45829 611.43475
3120.0000 -42.93968 -41.23112 1.70856 2.00082 -41.80343 671.30836
3125.0000 -43.22171 -41.31604 1.90568 2.06070 -41.37704 784.76473
3130.0000 -43.35922 -41.64165 1.71757 2.02702 -41.61689 706.64571
3135.0000 -43.51437 -41.75844 1.75593 2.01219 -41.72243 740.37129
3140.0000 -43.66452 -42.41044 1.25408 1.95699 -42.11549 631.99360
3145.0000 -44.15132 -43.02938 1.12194 1.88360 -42.63806 563.93673
3150.0000 -43.86726 -42.57686 1.29040 1.87014 -42.73390 578.77471
3155.0000 -43.70651 -41.97321 1.73329 1.89531 -42.55473 598.88464
3160.0000 -43.69695 -41.63229 2.06466 1.96378 -42.06718 665.99939
3165.0000 -43.75389 -41.87602 1.87787 2.02603 -41.62389 751.08315
3170.0000 -43.82204 -42.33980 1.48224 1.94908 -42.17186 643.34085
3175.0000 -44.26726 -42.99996 1.26730 1.91058 -42.44597 567.85033
3180.0000 -43.87995 -42.04640 1.83355 1.84218 -42.93299 512.81882
3185.0000 -43.58480 -42.02412 1.56068 1.95102 -42.15799 635.29580
3190.0000 -43.86169 -41.93000 1.93169 1.93974 -42.23831 650.14645
3195.0000 -43.79998 -42.01741 1.78257 1.99132 -41.87109 760.34059
3200.0000 -43.79674 -42.50506 1.29168 1.94753 -42.18289 635.27103
3205.0000 -44.06306 -42.80683 1.25623 1.88108 -42.65600 524.15325
3210.0000 -44.45381 -42.89428 1.55953 1.87094 -42.72825 589.24925
3215.0000 -44.69943 -43.56104 1.13839 1.79402 -43.27594 539.59955
3220.0000 -44.10221 -42.79656 1.30565 1.82123 -43.08219 555.53510
3225.0000 -43.72907 -41.83506 1.89401 1.92933 -42.31243 647.01378
3230.0000 -44.05737 -42.43026 1.62711 1.92778 -42.32351 618.71509
3235.0000 -43.02787 -41.94186 1.08602 1.92732 -42.32677 607.17721
3240.0000 -43.72329 -42.18179 1.54150 1.94394 -42.20844 684.20616
3245.0000 -44.17235 -43.05895 1.11341 1.92273 -42.35945 625.02170
3250.0000 -44.04323 -42.30956 1.73367 1.90097 -42.51438 600.62004
MELTING PROCESS: loop number 14 T-loop= 648.00000000000000
main_MD> interactions number 14 at Temperature= 648.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.25927 2.47257 1.45963
force_rgl> df(natom) 0.77317 0.24781 0.21806
3255.0000 -44.31568 -42.65764 1.65804 1.90135 -42.51169 561.23501
3260.0000 -43.87657 -42.52792 1.34865 1.89005 -42.59212 551.85546
3265.0000 -43.95251 -42.56961 1.38290 1.95471 -42.13171 665.78055
3270.0000 -43.91826 -42.52561 1.39265 1.89632 -42.54749 590.85912
3275.0000 -44.38492 -43.06881 1.31610 1.88821 -42.60524 582.26317
3280.0000 -44.09996 -42.56894 1.53102 1.86076 -42.80069 541.49056
3285.0000 -43.30064 -41.80740 1.49323 1.95771 -42.11039 642.28789
3290.0000 -43.74550 -42.32038 1.42513 1.97393 -41.99486 682.07653
3295.0000 -43.53437 -42.04294 1.49143 1.92963 -42.31036 690.97919
3300.0000 -43.19316 -41.40557 1.78759 1.97948 -41.95536 652.35892
3305.0000 -44.14611 -42.57939 1.56671 1.95689 -42.11622 655.18061
3310.0000 -44.07130 -42.61004 1.46126 1.88173 -42.65137 575.10217
3315.0000 -43.20822 -41.62550 1.58272 1.95089 -42.15893 669.48050
3320.0000 -44.23767 -42.21526 2.02241 1.96611 -42.05061 679.59781
3325.0000 -43.96621 -42.60952 1.35669 1.90182 -42.50834 595.96329
3330.0000 -43.95304 -42.54791 1.40512 1.89304 -42.57083 587.67928
3335.0000 -43.28395 -42.10885 1.17510 1.93676 -42.25954 630.66825
3340.0000 -44.22971 -42.43841 1.79130 1.94098 -42.22953 622.91695
3345.0000 -43.59963 -42.30875 1.29088 1.92137 -42.36912 629.56227
3350.0000 -43.64445 -41.73195 1.91250 2.01865 -41.67651 730.58753
3355.0000 -44.10473 -42.56682 1.53791 1.94590 -42.19446 663.72241
3360.0000 -44.37774 -42.90935 1.46839 1.84872 -42.88647 606.07923
3365.0000 -44.41374 -42.89131 1.52243 1.82030 -43.08879 550.59351
3370.0000 -43.31338 -41.94690 1.36648 1.92293 -42.35806 633.74558
3375.0000 -43.53435 -42.19898 1.33536 1.97466 -41.98969 682.13548
3380.0000 -43.76210 -42.11633 1.64577 1.95126 -42.15632 672.12551
3385.0000 -43.21304 -41.90323 1.30982 1.93571 -42.26702 632.01671
3390.0000 -43.82507 -41.34491 2.48016 2.04410 -41.49525 721.58239
3395.0000 -43.86768 -42.37244 1.49524 2.03182 -41.58267 786.80056
3400.0000 -43.51658 -41.93805 1.57853 1.96360 -42.06844 664.83512
3405.0000 -43.22014 -40.91240 2.30774 2.00739 -41.75667 712.91142
3410.0000 -43.29129 -41.69997 1.59132 1.98941 -41.88467 693.09707
3415.0000 -44.07870 -42.33154 1.74716 1.97867 -41.96112 692.85260
3420.0000 -43.79274 -41.80480 1.98794 1.99179 -41.86769 715.35976
3425.0000 -44.04013 -41.90836 2.13177 1.97058 -42.01876 673.08267
3430.0000 -43.75992 -42.24667 1.51325 1.91757 -42.39622 624.96564
3435.0000 -43.01325 -41.36845 1.64480 2.01615 -41.69427 713.93429
3440.0000 -42.93388 -41.21400 1.71988 2.09961 -41.10002 841.88330
3445.0000 -43.49743 -41.70392 1.79352 2.05195 -41.43939 780.37719
3450.0000 -44.33535 -42.77264 1.56271 1.94549 -42.19742 726.27618
3455.0000 -44.27868 -42.78460 1.49407 1.85753 -42.82374 620.77103
3460.0000 -43.86876 -42.71545 1.15330 1.86292 -42.78534 614.72786
3465.0000 -44.04340 -42.62844 1.41495 1.93517 -42.27085 715.15982
3470.0000 -44.24970 -42.90328 1.34642 1.84024 -42.94679 587.62378
3475.0000 -44.26530 -43.01042 1.25489 1.85006 -42.87687 545.70678
3480.0000 -43.53799 -42.13682 1.40118 1.88937 -42.59698 579.44106
3485.0000 -43.95988 -42.38477 1.57512 1.97893 -41.95931 659.78584
3490.0000 -43.82150 -42.07333 1.74817 1.97772 -41.96787 672.55478
3495.0000 -43.89734 -42.72491 1.17243 1.91254 -42.43201 598.40963
3500.0000 -44.48246 -43.07739 1.40507 1.85131 -42.86797 571.08339
MELTING PROCESS: loop number 15 T-loop= 673.00000000000000
main_MD> interactions number 15 at Temperature= 673.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.89794 0.96547 1.57876
force_rgl> df(natom) 3.12303 0.91533 2.35984
3505.0000 -43.47208 -41.97889 1.49319 1.91987 -42.37981 678.75457
3510.0000 -43.97888 -42.67801 1.30087 1.89649 -42.54626 671.23866
3515.0000 -44.43647 -42.00057 2.43590 1.93998 -42.23661 726.83225
3520.0000 -44.39896 -42.91670 1.48226 1.85464 -42.84432 642.62415
3525.0000 -43.78335 -41.90231 1.88104 1.95357 -42.13989 689.53042
3530.0000 -43.15394 -41.70420 1.44975 2.04885 -41.46145 762.06792
3535.0000 -43.74701 -41.57734 2.16967 2.03257 -41.57739 768.65457
3540.0000 -43.69360 -40.84939 2.84421 2.07765 -41.25637 796.81473
3545.0000 -43.61156 -41.86956 1.74201 2.06614 -41.33832 759.47191
3550.0000 -43.53571 -42.25468 1.28103 1.98167 -41.93976 697.15855
3555.0000 -43.93212 -41.87896 2.05316 1.97753 -41.96928 682.17836
3560.0000 -43.84329 -42.17870 1.66459 1.93564 -42.26750 641.73575
3565.0000 -44.17476 -42.53225 1.64251 1.91192 -42.43642 632.01429
3570.0000 -43.96157 -42.77131 1.19026 1.91876 -42.38775 643.24427
3575.0000 -44.32454 -42.38846 1.93608 1.87911 -42.67005 592.98650
3580.0000 -43.90630 -42.26952 1.63678 1.91923 -42.38434 601.35398
3585.0000 -43.36186 -42.40206 0.95980 1.91270 -42.43085 579.31137
3590.0000 -43.69406 -42.11703 1.57704 1.95312 -42.14307 636.91385
3595.0000 -43.93663 -42.69612 1.24052 1.93125 -42.29877 595.46293
3600.0000 -43.57302 -41.62866 1.94436 1.93616 -42.26383 591.54190
3605.0000 -43.73563 -42.38195 1.35369 1.96874 -42.03186 665.98020
3610.0000 -43.93436 -42.13092 1.80344 1.93031 -42.30546 630.96561
3615.0000 -43.46024 -41.58130 1.87894 1.92954 -42.31100 623.03714
3620.0000 -43.95627 -42.26287 1.69341 1.97274 -42.00339 669.94527
3625.0000 -43.79772 -41.84358 1.95415 1.94338 -42.21244 622.21710
3630.0000 -42.82065 -41.12357 1.69708 2.06132 -41.37261 771.93014
3635.0000 -43.16584 -41.54609 1.61975 2.08044 -41.23649 815.50139
3640.0000 -42.73966 -41.28451 1.45516 2.09604 -41.12540 806.39797
3645.0000 -42.78738 -40.94251 1.84487 2.13468 -40.85032 863.14081
3650.0000 -43.27848 -41.52713 1.75134 2.10236 -41.08044 866.84709
3655.0000 -43.22359 -41.12410 2.09949 2.06716 -41.33108 785.82066
3660.0000 -43.35718 -41.73080 1.62638 2.05521 -41.41616 741.58699
3665.0000 -43.78618 -42.12755 1.65863 1.96309 -42.07207 667.28736
3670.0000 -43.99228 -42.04542 1.94686 1.98069 -41.94674 695.86440
3675.0000 -43.83236 -42.04827 1.78409 1.97509 -41.98665 681.87267
3680.0000 -43.68111 -42.07413 1.60698 1.97892 -41.95939 681.75690
3685.0000 -43.93558 -42.30865 1.62693 1.95148 -42.15476 620.89618
3690.0000 -43.35746 -41.96911 1.38835 1.92929 -42.31278 620.90277
3695.0000 -43.63393 -41.81440 1.81953 2.00550 -41.77012 742.54705
3700.0000 -44.05660 -42.61341 1.44319 1.91273 -42.43067 644.84093
3705.0000 -43.24419 -41.58745 1.65675 1.93442 -42.27621 599.15042
3710.0000 -43.78320 -42.10204 1.68116 1.98158 -41.94043 712.76266
3715.0000 -43.70501 -42.44814 1.25687 1.94186 -42.22327 625.73229
3720.0000 -44.46315 -42.73970 1.72345 1.91432 -42.41936 618.93595
3725.0000 -43.93853 -42.02323 1.91530 1.89380 -42.56546 626.43970
3730.0000 -43.12355 -41.32240 1.80115 2.01658 -41.69119 714.59143
3735.0000 -43.00711 -41.20144 1.80567 2.06654 -41.33549 790.03531
3740.0000 -43.80726 -42.60857 1.19869 1.96757 -42.04015 674.64894
3745.0000 -43.61847 -41.90227 1.71620 1.94685 -42.18769 633.07963
3750.0000 -43.72825 -42.02805 1.70020 1.95904 -42.10089 683.02739
MELTING PROCESS: loop number 16 T-loop= 698.00000000000000
main_MD> interactions number 16 at Temperature= 698.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.54928 -1.78821 -1.79453
force_rgl> df(natom) -2.53563 2.44263 1.57695
3755.0000 -43.55631 -40.87324 2.68306 2.01265 -41.71918 721.64118
3760.0000 -43.24954 -41.51166 1.73788 2.07013 -41.30992 790.68503
3765.0000 -43.52517 -42.13219 1.39298 2.02152 -41.65600 727.59630
3770.0000 -43.90088 -41.92216 1.97872 1.97616 -41.97904 680.89795
3775.0000 -43.85625 -42.39945 1.45680 1.96428 -42.06357 661.09424
3780.0000 -43.44844 -41.56314 1.88530 2.00412 -41.77991 688.76048
3785.0000 -43.36641 -41.91034 1.45608 2.01669 -41.69044 716.70416
3790.0000 -43.43598 -42.04612 1.38985 2.01010 -41.73737 716.33288
3795.0000 -43.12845 -41.05890 2.06955 2.03432 -41.56487 702.63404
3800.0000 -43.52226 -41.27416 2.24811 2.13227 -40.86748 849.99530
3805.0000 -42.75095 -40.93936 1.81158 2.08452 -41.20745 815.13039
3810.0000 -43.25631 -41.30757 1.94874 2.11385 -40.99860 847.39698
3815.0000 -43.50954 -42.03854 1.47101 1.97284 -42.00267 708.41079
3820.0000 -43.78270 -42.14217 1.64053 1.95989 -42.09483 628.95056
3825.0000 -43.01727 -41.64994 1.36734 1.99311 -41.85834 681.69168
3830.0000 -43.04415 -41.55753 1.48662 2.05170 -41.44116 756.62305
3835.0000 -43.44851 -41.87386 1.57465 2.05256 -41.43499 823.47795
3840.0000 -43.80004 -42.30630 1.49373 1.95612 -42.12168 717.65609
3845.0000 -43.09724 -41.47903 1.61821 2.00347 -41.78457 726.90738
3850.0000 -43.66473 -41.43191 2.23282 2.02583 -41.62532 737.51250
3855.0000 -43.00857 -41.18482 1.82375 2.02685 -41.61806 721.06298
3860.0000 -43.48250 -41.59857 1.88394 2.05867 -41.39153 758.59680
3865.0000 -43.97294 -42.21323 1.75971 1.94626 -42.19191 640.79967
3870.0000 -43.96275 -42.28646 1.67629 1.95263 -42.14654 633.14347
3875.0000 -43.73500 -42.28982 1.44518 1.87222 -42.71913 552.67168
3880.0000 -43.38976 -42.35681 1.03295 1.95027 -42.16334 644.40222
3885.0000 -44.06261 -42.20783 1.85478 1.91502 -42.41432 693.78353
3890.0000 -44.16154 -42.51451 1.64703 1.90506 -42.48529 653.60243
3895.0000 -43.80381 -42.35150 1.45232 1.91999 -42.37893 714.81653
3900.0000 -43.63900 -42.00613 1.63287 1.93324 -42.28459 641.59784
3905.0000 -43.71476 -42.13534 1.57942 1.97590 -41.98086 664.67107
3910.0000 -43.40961 -41.67129 1.73832 1.95432 -42.13453 671.97017
3915.0000 -42.87520 -41.56088 1.31432 1.99255 -41.86235 698.76888
3920.0000 -43.90945 -42.52282 1.38663 1.99098 -41.87351 670.35979
3925.0000 -44.31210 -42.94502 1.36708 1.88348 -42.63895 590.26989
3930.0000 -43.33062 -41.72511 1.60551 1.92413 -42.34949 611.23801
3935.0000 -43.21361 -41.88246 1.33115 2.02981 -41.59698 732.61781
3940.0000 -43.52448 -42.18000 1.34448 2.00623 -41.76493 691.37159
3945.0000 -43.32368 -41.97637 1.34730 1.98078 -41.94610 678.67154
3950.0000 -43.20498 -41.24720 1.95778 2.05714 -41.40238 790.32959
3955.0000 -43.41791 -41.82886 1.58905 2.02263 -41.64816 706.32965
3960.0000 -43.51417 -42.01708 1.49709 2.01238 -41.72110 730.87953
3965.0000 -43.30498 -41.77398 1.53100 2.01461 -41.70521 704.51649
3970.0000 -43.83764 -42.15027 1.68737 1.96743 -42.04118 684.86010
3975.0000 -43.95643 -41.67154 2.28489 2.02560 -41.62698 703.23433
3980.0000 -44.29980 -43.28771 1.01209 1.88922 -42.59808 571.86562
3985.0000 -44.03331 -42.64246 1.39085 1.84282 -42.92844 504.35313
3990.0000 -43.79500 -41.98594 1.80906 1.94328 -42.21315 676.95883
3995.0000 -43.93052 -42.50737 1.42315 1.96177 -42.08147 680.25969
4000.0000 -43.76824 -41.09658 2.67167 2.00255 -41.79108 676.51045
MELTING PROCESS: loop number 17 T-loop= 723.00000000000000
main_MD> interactions number 17 at Temperature= 723.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.32306 0.76314 0.63654
force_rgl> df(natom) -2.57394 1.15041 -3.86059
4005.0000 -43.88354 -42.05182 1.83172 2.05970 -41.38420 752.54585
4010.0000 -43.75252 -41.72726 2.02526 2.01652 -41.69160 716.63030
4015.0000 -44.34436 -42.02773 2.31663 1.98908 -41.88699 719.22145
4020.0000 -43.23101 -42.23304 0.99797 1.96697 -42.04444 645.59767
4025.0000 -43.61062 -42.12143 1.48918 1.97975 -41.95348 668.02997
4030.0000 -43.81271 -42.07965 1.73306 1.96048 -42.09069 698.07239
4035.0000 -43.43004 -41.91370 1.51634 2.00268 -41.79020 719.65804
4040.0000 -43.56893 -41.52452 2.04441 2.00063 -41.80480 696.25879
4045.0000 -43.32518 -40.88039 2.44480 2.08748 -41.18636 783.12340
4050.0000 -42.69595 -41.25395 1.44199 2.05828 -41.39430 730.45087
4055.0000 -43.78992 -41.86554 1.92437 1.97822 -41.96435 667.94480
4060.0000 -43.64585 -41.83854 1.80732 2.02362 -41.64106 689.97865
4065.0000 -43.44747 -41.85415 1.59331 2.00578 -41.76809 733.53742
4070.0000 -43.65627 -41.68476 1.97151 1.95156 -42.15414 708.54363
4075.0000 -43.97881 -42.32855 1.65026 1.97685 -41.97413 689.24887
4080.0000 -43.35985 -42.18556 1.17429 1.96776 -42.03885 643.30624
4085.0000 -43.11022 -41.66670 1.44351 1.96058 -42.08992 649.61939
4090.0000 -43.70878 -41.41653 2.29226 2.02653 -41.62038 738.15149
4095.0000 -43.58067 -42.28238 1.29829 1.97703 -41.97281 666.55388
4100.0000 -43.79217 -42.37295 1.41922 1.94133 -42.22704 629.95261
4105.0000 -44.28956 -42.55107 1.73849 1.91155 -42.43909 609.66420
4110.0000 -44.00441 -42.73578 1.26864 1.93125 -42.29877 691.73817
4115.0000 -44.30981 -42.71398 1.59583 1.89872 -42.53044 646.61901
4120.0000 -44.18384 -42.85574 1.32811 1.89683 -42.54386 613.16751
4125.0000 -43.73518 -42.25469 1.48049 1.87756 -42.68110 535.79496
4130.0000 -43.84171 -41.96017 1.88155 1.95665 -42.11795 635.04403
4135.0000 -43.61247 -42.03346 1.57901 1.88471 -42.63015 562.77006
4140.0000 -43.24625 -41.90376 1.34249 1.95815 -42.10727 684.99952
4145.0000 -43.96369 -42.11310 1.85059 1.95191 -42.15166 609.71701
4150.0000 -43.96116 -42.32658 1.63458 1.92514 -42.34226 599.91915
4155.0000 -43.59659 -41.12696 2.46963 2.02214 -41.65159 760.43660
4160.0000 -43.24624 -42.13101 1.11523 2.01875 -41.67579 735.07420
4165.0000 -44.12591 -42.04102 2.08489 1.97140 -42.01290 663.39593
4170.0000 -42.87454 -40.67043 2.20411 2.03309 -41.57367 721.75370
4175.0000 -44.44686 -42.35129 2.09558 2.06629 -41.33727 749.24014
4180.0000 -44.26309 -42.37521 1.88789 1.94183 -42.22347 655.03556
4185.0000 -43.55708 -42.02177 1.53532 1.91903 -42.38578 598.88780
4190.0000 -43.71937 -42.04830 1.67106 1.94525 -42.19911 647.95482
4195.0000 -43.87219 -42.44832 1.42388 1.93114 -42.29960 616.13683
4200.0000 -43.09322 -41.55111 1.54211 1.97736 -41.97045 690.92273
4205.0000 -42.95879 -41.03021 1.92859 2.11601 -40.98321 801.14549
4210.0000 -43.47682 -41.58903 1.88778 2.05443 -41.42168 799.29780
4215.0000 -44.34586 -42.07202 2.27384 1.98952 -41.88389 731.97576
4220.0000 -44.59602 -42.81554 1.78048 1.91879 -42.38749 681.72139
4225.0000 -44.51053 -43.28971 1.22082 1.80403 -43.20462 568.84739
4230.0000 -43.94633 -42.55016 1.39617 1.80932 -43.16696 545.30138
4235.0000 -43.81219 -41.98769 1.82450 1.92669 -42.33128 710.61175
4240.0000 -44.68076 -42.88639 1.79437 1.93664 -42.26043 708.76364
4245.0000 -44.24484 -42.42329 1.82155 1.82679 -43.04258 593.39445
4250.0000 -43.42146 -42.22799 1.19347 1.96081 -42.08829 703.93344
MELTING PROCESS: loop number 18 T-loop= 748.00000000000000
main_MD> interactions number 18 at Temperature= 748.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.31905 -0.53673 -3.56850
force_rgl> df(natom) -4.97744 -0.01338 4.94856
4255.0000 -43.58645 -41.45192 2.13453 1.99292 -41.85970 678.29742
4260.0000 -43.49814 -42.04668 1.45146 1.99572 -41.83971 730.48453
4265.0000 -43.25960 -41.87371 1.38589 1.97723 -41.97139 700.36925
4270.0000 -43.63990 -42.12474 1.51516 1.99933 -41.81404 706.03738
4275.0000 -43.40701 -41.66932 1.73768 1.97004 -42.02258 711.31982
4280.0000 -43.68705 -41.94707 1.73998 1.96323 -42.07106 695.84563
4285.0000 -43.29507 -41.43595 1.85912 1.99839 -41.82072 675.35812
4290.0000 -43.61956 -41.50253 2.11703 2.00124 -41.80042 704.60424
4295.0000 -42.83966 -39.96151 2.87815 2.13889 -40.82034 904.66569
4300.0000 -42.24987 -40.23423 2.01564 2.24806 -40.04296 975.12888
4305.0000 -42.62555 -40.94986 1.67569 2.20773 -40.33013 896.03732
4310.0000 -43.39269 -40.66666 2.72602 2.11914 -40.96092 810.77711
4315.0000 -43.12526 -41.05634 2.06892 2.10786 -41.04127 844.80808
4320.0000 -43.74048 -41.87460 1.86588 2.04250 -41.50664 755.67239
4325.0000 -43.59321 -41.83644 1.75677 1.97757 -41.96895 674.75268
4330.0000 -43.08991 -41.22171 1.86820 2.04399 -41.49603 754.35505
4335.0000 -43.47043 -41.67053 1.79990 2.08618 -41.19560 825.77920
4340.0000 -43.42362 -41.38160 2.04202 2.05723 -41.40177 780.47639
4345.0000 -43.92242 -42.06868 1.85374 1.98241 -41.93451 672.28330
4350.0000 -43.77121 -42.23789 1.53332 1.99020 -41.87904 675.16271
4355.0000 -43.91603 -42.08141 1.83462 1.92643 -42.33311 627.07898
4360.0000 -43.03492 -41.42431 1.61060 2.01721 -41.68673 709.66543
4365.0000 -43.76229 -41.87715 1.88513 2.01532 -41.70021 731.25174
4370.0000 -43.04307 -41.54457 1.49850 2.01545 -41.69928 731.41397
4375.0000 -43.35449 -41.65648 1.69801 2.02257 -41.64856 784.56984
4380.0000 -43.22301 -40.96951 2.25350 2.06090 -41.37561 794.44482
4385.0000 -43.56413 -42.02168 1.54245 2.06201 -41.36776 818.87978
4390.0000 -43.56557 -42.04200 1.52357 2.00196 -41.79528 791.94582
4395.0000 -43.62042 -41.61814 2.00228 1.94535 -42.19842 626.97041
4400.0000 -43.50104 -41.78140 1.71964 1.98314 -41.92933 711.03160
4405.0000 -43.92303 -42.54992 1.37311 1.94576 -42.19545 612.78666
4410.0000 -43.56919 -41.78200 1.78719 1.96449 -42.06209 658.75183
4415.0000 -43.51425 -41.92517 1.58908 2.04723 -41.47297 744.36774
4420.0000 -42.75507 -40.87064 1.88443 2.04739 -41.47180 759.66182
4425.0000 -42.54522 -40.07340 2.47183 2.20456 -40.35270 915.09860
4430.0000 -43.23636 -41.46071 1.77565 2.12212 -40.93973 882.98381
4435.0000 -43.09408 -41.71719 1.37689 2.03070 -41.59065 787.19798
4440.0000 -43.06486 -41.89150 1.17336 1.97630 -41.97803 683.82364
4445.0000 -44.16569 -42.47884 1.68685 1.93050 -42.30412 636.43760
4450.0000 -43.31720 -41.51154 1.80566 1.98065 -41.94701 648.04929
4455.0000 -43.81370 -41.91252 1.90119 2.06087 -41.37585 752.08412
4460.0000 -43.33952 -41.60388 1.73564 2.03535 -41.55759 764.59617
4465.0000 -43.42238 -42.03889 1.38349 2.00344 -41.78475 706.41097
4470.0000 -43.58252 -41.75600 1.82652 1.97301 -42.00146 685.87521
4475.0000 -43.24376 -41.64865 1.59511 1.98495 -41.91643 663.53439
4480.0000 -43.05419 -41.01305 2.04114 2.04516 -41.48769 745.81788
4485.0000 -43.78392 -41.14053 2.64338 2.08482 -41.20531 759.64291
4490.0000 -42.83931 -40.74453 2.09478 2.17283 -40.57867 900.22836
4495.0000 -43.10871 -40.94148 2.16723 2.16773 -40.61495 846.49455
4500.0000 -43.56659 -41.24946 2.31714 2.06310 -41.36000 805.97350
MELTING PROCESS: loop number 19 T-loop= 773.00000000000000
main_MD> interactions number 19 at Temperature= 773.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.97157 0.48892 -1.28944
force_rgl> df(natom) -2.67997 3.47777 -2.89542
4505.0000 -43.65592 -41.75924 1.89668 2.05383 -41.42598 790.51945
4510.0000 -43.49668 -41.51775 1.97892 2.05858 -41.39213 794.87234
4515.0000 -43.67431 -41.96189 1.71242 2.01863 -41.67661 702.66049
4520.0000 -43.39568 -41.52458 1.87110 2.00059 -41.80504 694.42892
4525.0000 -43.76867 -42.00659 1.76208 1.99211 -41.86546 680.24712
4530.0000 -42.96830 -41.29346 1.67484 2.01006 -41.73763 720.45930
4535.0000 -43.48692 -41.51456 1.97236 2.03481 -41.56142 721.36918
4540.0000 -43.09496 -41.67978 1.41518 2.05276 -41.43359 770.60920
4545.0000 -43.49087 -41.96618 1.52469 1.95883 -42.10243 663.40557
4550.0000 -43.45437 -41.26166 2.19271 2.03118 -41.58725 765.36355
4555.0000 -43.64243 -41.39727 2.24516 2.08632 -41.19461 804.25896
4560.0000 -43.13648 -40.96604 2.17045 2.15414 -40.71170 901.85507
4565.0000 -43.32911 -40.75136 2.57775 2.06831 -41.32288 797.75055
4570.0000 -42.67382 -40.68720 1.98662 2.12548 -40.91583 826.54374
4575.0000 -43.02278 -40.84221 2.18057 2.11681 -40.97751 898.12516
4580.0000 -43.22635 -41.92398 1.30237 2.08071 -41.23458 794.50917
4585.0000 -43.53513 -42.22173 1.31340 1.97571 -41.98225 625.09980
4590.0000 -43.12529 -41.59640 1.52889 2.02744 -41.61391 705.64296
4595.0000 -43.55312 -41.97346 1.57966 1.99321 -41.85764 686.39911
4600.0000 -43.87860 -42.26015 1.61845 1.94763 -42.18218 677.71491
4605.0000 -43.68828 -41.84522 1.84306 1.92216 -42.36351 659.21460
4610.0000 -44.15472 -41.92896 2.22576 2.00230 -41.79287 757.31192
4615.0000 -43.54060 -41.48397 2.05663 2.02478 -41.63279 806.85911
4620.0000 -43.87764 -42.55787 1.31977 1.92561 -42.33892 627.82009
4625.0000 -43.30782 -41.37312 1.93471 1.94492 -42.20149 651.63845
4630.0000 -43.21764 -41.53668 1.68096 2.01297 -41.71692 702.66268
4635.0000 -42.86909 -41.26354 1.60554 2.05869 -41.39137 745.21469
4640.0000 -43.80013 -41.34324 2.45689 2.06129 -41.37285 779.41482
4645.0000 -43.31876 -41.67817 1.64058 2.02240 -41.64975 735.94425
4650.0000 -43.11989 -40.38847 2.73142 2.08762 -41.18541 818.73837
4655.0000 -42.66849 -40.59443 2.07406 2.13486 -40.84903 862.78580
4660.0000 -42.62878 -40.24421 2.38457 2.19672 -40.40852 862.96820
4665.0000 -43.51864 -41.90431 1.61433 2.08251 -41.22175 833.94306
4670.0000 -43.45772 -41.97594 1.48179 2.00850 -41.74874 696.91767
4675.0000 -43.44706 -41.48060 1.96646 2.02212 -41.65178 745.82869
4680.0000 -43.18626 -41.72382 1.46244 2.04044 -41.52132 746.50347
4685.0000 -43.22552 -41.17735 2.04817 2.02917 -41.60159 786.95071
4690.0000 -44.24485 -42.78400 1.46085 1.98408 -41.92261 741.27503
4695.0000 -44.38794 -42.70702 1.68092 1.86497 -42.77074 610.89581
4700.0000 -43.45218 -41.55556 1.89662 2.02168 -41.65486 734.13658
4705.0000 -43.52192 -42.41340 1.10852 2.00640 -41.76373 698.16834
4710.0000 -43.47811 -41.57892 1.89919 1.97437 -41.99174 691.71064
4715.0000 -43.14634 -41.02802 2.11832 2.07639 -41.26536 826.14315
4720.0000 -43.42545 -41.61604 1.80941 2.02263 -41.64815 705.28953
4725.0000 -44.06842 -42.01123 2.05719 2.06129 -41.37288 783.39087
4730.0000 -43.44838 -41.60179 1.84659 1.95062 -42.16090 658.17447
4735.0000 -43.31196 -41.49687 1.81509 2.03435 -41.56469 722.69190
4740.0000 -43.96604 -41.88245 2.08359 2.00141 -41.79925 741.17543
4745.0000 -43.30783 -41.92384 1.38399 1.99858 -41.81937 698.31852
4750.0000 -43.02877 -41.05191 1.97686 2.07343 -41.28642 828.37436
MELTING PROCESS: loop number 20 T-loop= 798.00000000000000
main_MD> interactions number 20 at Temperature= 798.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.12260 0.72440 -1.25597
force_rgl> df(natom) -0.52927 0.27907 -0.31654
4755.0000 -43.05743 -41.76953 1.28790 2.06184 -41.36893 730.82412
4760.0000 -42.82625 -40.76934 2.05690 2.08850 -41.17912 820.63133
4765.0000 -43.08180 -40.74883 2.33297 2.16967 -40.60117 846.38465
4770.0000 -44.04711 -41.76461 2.28250 2.05821 -41.39480 774.10905
4775.0000 -43.07165 -41.44135 1.63030 2.00137 -41.79948 713.34008
4780.0000 -42.84886 -41.03203 1.81683 2.05821 -41.39480 785.08027
4785.0000 -42.96932 -41.23897 1.73035 2.09791 -41.11211 781.90957
4790.0000 -43.48113 -40.63753 2.84360 2.14284 -40.79220 839.02618
4795.0000 -42.27946 -40.57097 1.70849 2.21699 -40.26422 893.20441
4800.0000 -43.15381 -41.02738 2.12643 2.11744 -40.97306 846.99854
4805.0000 -42.67560 -40.48222 2.19339 2.16507 -40.63391 943.66967
4810.0000 -42.98396 -41.11273 1.87123 2.12439 -40.92359 879.83518
4815.0000 -42.70089 -40.80920 1.89169 2.10966 -41.02841 819.09183
4820.0000 -43.49903 -41.27560 2.22343 2.06703 -41.33197 812.54770
4825.0000 -43.89093 -41.36734 2.52360 2.07705 -41.26064 812.84485
4830.0000 -43.08944 -41.86523 1.22421 2.00975 -41.73981 734.28287
4835.0000 -43.78541 -41.73887 2.04654 1.99990 -41.80998 714.76686
4840.0000 -43.74999 -42.24466 1.50533 1.95615 -42.12147 656.01246
4845.0000 -43.39898 -41.65045 1.74852 2.02713 -41.61606 724.81335
4850.0000 -43.21068 -41.10229 2.10839 2.04680 -41.47600 761.17785
4855.0000 -42.70174 -40.54994 2.15180 2.14974 -40.74303 875.50410
4860.0000 -42.71472 -41.14029 1.57443 2.18320 -40.50482 903.30236
4865.0000 -42.83035 -40.92521 1.90514 2.12438 -40.92362 794.01261
4870.0000 -42.63148 -41.24006 1.39142 2.10931 -41.03091 813.21964
4875.0000 -42.67847 -40.15568 2.52279 2.15888 -40.67795 864.59239
4880.0000 -42.61292 -40.28601 2.32691 2.22336 -40.21884 918.70481
4885.0000 -43.53627 -40.44040 3.09587 2.22098 -40.23583 976.45244
4890.0000 -43.65250 -42.00563 1.64687 2.11533 -40.98806 900.80846
4895.0000 -43.83579 -42.36260 1.47319 1.95812 -42.10748 632.93585
4900.0000 -42.81721 -40.86613 1.95108 2.01142 -41.72792 743.15993
4905.0000 -43.41541 -41.79342 1.62199 2.04270 -41.50525 751.29412
4910.0000 -43.35174 -41.10420 2.24754 2.05795 -41.39665 776.94557
4915.0000 -42.50104 -40.53088 1.97017 2.09326 -41.14522 818.89288
4920.0000 -42.62353 -39.97360 2.64993 2.22453 -40.21056 969.80240
4925.0000 -42.49055 -39.98329 2.50727 2.25925 -39.96328 1054.05071
4930.0000 -42.77429 -41.03170 1.74259 2.16356 -40.64463 826.19904
4935.0000 -42.95565 -40.30230 2.65334 2.16656 -40.62326 885.34742
4940.0000 -42.20864 -40.31553 1.89311 2.18110 -40.51977 866.49013
4945.0000 -42.45713 -40.13929 2.31784 2.22746 -40.18966 848.57284
4950.0000 -41.97358 -40.68799 1.28559 2.17607 -40.55559 866.64203
4955.0000 -42.89492 -41.29640 1.59852 2.07026 -41.30898 731.29467
4960.0000 -42.96833 -40.23331 2.73502 2.13969 -40.81462 830.84294
4965.0000 -43.35989 -41.67100 1.68889 2.08951 -41.17194 808.51484
4970.0000 -42.71232 -40.67839 2.03393 2.09523 -41.13121 767.06679
4975.0000 -42.96434 -41.18451 1.77983 2.14494 -40.77726 865.08288
4980.0000 -43.64829 -41.77286 1.87543 2.09034 -41.16600 832.66002
4985.0000 -43.34216 -41.38979 1.95237 2.06926 -41.31612 823.68061
4990.0000 -43.45843 -41.49671 1.96173 2.07998 -41.23981 811.01320
4995.0000 -43.47220 -41.38215 2.09005 2.00402 -41.78063 673.88238
5000.0000 -42.96791 -41.10398 1.86393 2.11997 -40.95506 850.73999
MELTING PROCESS: loop number 21 T-loop= 823.00000000000000
main_MD> interactions number 21 at Temperature= 823.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.04331 -2.58665 1.38586
force_rgl> df(natom) -1.60563 -7.61096 -3.27065
5005.0000 -42.34693 -40.30878 2.03814 2.17065 -40.59415 859.30260
5010.0000 -42.74339 -40.35111 2.39227 2.25163 -40.01756 975.46020
5015.0000 -42.61135 -40.48325 2.12810 2.25912 -39.96424 992.69845
5020.0000 -43.38164 -40.87427 2.50737 2.11431 -40.99537 828.37463
5025.0000 -43.06297 -41.16782 1.89515 2.06955 -41.31405 825.74665
5030.0000 -43.77869 -41.54558 2.23311 2.07030 -41.30869 823.70072
5035.0000 -43.11333 -41.17230 1.94103 2.06913 -41.31704 795.59203
5040.0000 -42.94021 -41.01475 1.92546 2.08973 -41.17035 823.80288
5045.0000 -43.88175 -41.90282 1.97893 2.08835 -41.18015 873.38490
5050.0000 -43.91016 -41.73159 2.17858 2.03655 -41.54899 762.73819
5055.0000 -43.10582 -41.69676 1.40906 2.00530 -41.77154 714.22199
5060.0000 -42.47288 -40.31732 2.15556 2.08424 -41.20947 814.52628
5065.0000 -42.59015 -40.78507 1.80508 2.13142 -40.87353 858.07356
5070.0000 -43.83026 -41.28392 2.54634 2.09207 -41.15373 801.26707
5075.0000 -42.72516 -41.05993 1.66522 2.11267 -41.00701 843.11146
5080.0000 -43.01926 -41.25162 1.76764 2.10080 -41.09151 819.39702
5085.0000 -42.91952 -40.75267 2.16686 2.08371 -41.21324 810.12766
5090.0000 -43.02277 -41.17227 1.85050 2.11164 -41.01437 857.26482
5095.0000 -43.24950 -41.51473 1.73478 2.03446 -41.56391 743.12235
5100.0000 -43.69615 -41.47401 2.22214 2.05251 -41.43536 778.08212
5105.0000 -43.22889 -40.56464 2.66425 2.08224 -41.22366 785.38559
5110.0000 -43.27014 -41.08036 2.18978 2.18398 -40.49926 865.08707
5115.0000 -42.25531 -40.72880 1.52651 2.11968 -40.95713 827.76800
5120.0000 -43.48065 -41.40864 2.07201 2.07995 -41.23999 749.11522
5125.0000 -42.61880 -40.65456 1.96424 2.07427 -41.28044 788.63454
5130.0000 -42.93746 -41.58843 1.34903 2.11690 -40.97692 821.03220
5135.0000 -42.90202 -40.96227 1.93974 2.09706 -41.11815 790.33984
5140.0000 -43.63889 -41.74749 1.89140 2.01576 -41.69704 693.00698
5145.0000 -43.22960 -40.98653 2.24307 2.04318 -41.50183 736.00298
5150.0000 -42.83002 -40.92621 1.90381 2.14875 -40.75012 879.97846
5155.0000 -43.81218 -42.09341 1.71877 2.04125 -41.51558 741.10557
5160.0000 -43.13551 -41.25440 1.88111 2.04387 -41.49687 799.92557
5165.0000 -43.01846 -40.74987 2.26859 2.11998 -40.95494 890.57238
5170.0000 -43.92724 -41.96496 1.96228 2.03191 -41.58202 785.22520
5175.0000 -44.10677 -42.49651 1.61026 1.92388 -42.35125 715.64372
5180.0000 -43.63022 -42.28834 1.34188 1.93237 -42.29082 627.34232
5185.0000 -43.29282 -41.54488 1.74794 1.97402 -41.99426 662.33166
5190.0000 -43.52002 -41.16903 2.35099 2.04462 -41.49157 759.97222
5195.0000 -42.81096 -40.33854 2.47242 2.19736 -40.40398 1034.64193
5200.0000 -42.87449 -40.53247 2.34202 2.09774 -41.11331 831.11369
5205.0000 -43.62553 -41.84159 1.78394 2.09401 -41.13991 855.05130
5210.0000 -43.20317 -41.28297 1.92021 2.07548 -41.27180 757.31069
5215.0000 -43.38099 -41.70994 1.67105 2.07034 -41.30842 781.89291
5220.0000 -43.62368 -41.62390 1.99978 2.06697 -41.33242 782.38193
5225.0000 -42.96113 -40.77764 2.18349 2.06819 -41.32372 775.21227
5230.0000 -43.30420 -41.11310 2.19110 2.06055 -41.37815 779.28192
5235.0000 -42.76684 -40.57106 2.19578 2.08880 -41.17701 839.99375
5240.0000 -43.29972 -40.85457 2.44515 2.17286 -40.57847 929.03535
5245.0000 -43.38319 -41.55740 1.82579 2.06132 -41.37263 769.85638
5250.0000 -43.71181 -42.03184 1.67997 2.01294 -41.71715 733.57349
MELTING PROCESS: loop number 22 T-loop= 848.00000000000000
main_MD> interactions number 22 at Temperature= 848.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28407 0.13518 -0.69905
force_rgl> df(natom) -1.06354 1.70108 -0.84219
5255.0000 -42.85387 -41.22202 1.63185 2.00710 -41.75869 752.71461
5260.0000 -42.67275 -40.74214 1.93061 2.13464 -40.85060 861.22641
5265.0000 -42.91740 -40.71824 2.19916 2.16392 -40.64206 870.07602
5270.0000 -43.73942 -41.33688 2.40254 2.10456 -41.06475 841.05145
5275.0000 -43.60557 -41.32605 2.27952 2.01412 -41.70872 727.67564
5280.0000 -43.87486 -41.91336 1.96150 2.03967 -41.52678 764.70527
5285.0000 -43.13117 -41.06819 2.06299 2.12011 -40.95404 832.09850
5290.0000 -42.83988 -41.55863 1.28125 2.16320 -40.64720 849.23550
5295.0000 -43.15615 -41.26668 1.88947 2.05618 -41.40924 761.53236
5300.0000 -43.11113 -41.63170 1.47943 2.03441 -41.56428 685.93092
5305.0000 -42.84451 -40.16129 2.68321 2.16460 -40.63727 880.90190
5310.0000 -43.53045 -41.33884 2.19161 2.12333 -40.93114 855.08146
5315.0000 -42.97546 -41.45032 1.52514 2.09862 -41.10707 801.29453
5320.0000 -43.37098 -41.53234 1.83864 2.07030 -41.30868 767.83213
5325.0000 -43.04390 -41.38486 1.65903 2.02518 -41.63000 735.37124
5330.0000 -43.09717 -40.61790 2.47927 2.06569 -41.34150 807.09080
5335.0000 -43.17949 -40.85890 2.32059 2.13330 -40.86012 863.48666
5340.0000 -42.45832 -40.16046 2.29786 2.21407 -40.28498 958.77949
5345.0000 -43.16925 -40.49871 2.67054 2.23213 -40.15638 1003.41395
5350.0000 -42.31008 -40.06763 2.24245 2.22192 -40.22908 958.72814
5355.0000 -42.18521 -39.79610 2.38911 2.21204 -40.29949 962.40313
5360.0000 -43.50260 -41.36206 2.14054 2.15297 -40.72004 895.65116
5365.0000 -43.65696 -41.47045 2.18651 2.03952 -41.52787 751.38276
5370.0000 -43.42743 -42.03526 1.39217 2.00359 -41.78367 700.40970
5375.0000 -41.94841 -40.24803 1.70038 2.10016 -41.09611 793.22558
5380.0000 -42.77209 -41.38993 1.38216 2.21115 -40.30580 961.28508
5385.0000 -42.49222 -40.44986 2.04236 2.14786 -40.75647 866.68018
5390.0000 -43.46498 -40.73617 2.72881 2.16481 -40.63577 901.60423
5395.0000 -42.14567 -39.43961 2.70606 2.20578 -40.34404 934.94324
5400.0000 -42.63456 -40.23990 2.39466 2.24231 -40.08393 980.68974
5405.0000 -42.87213 -40.61595 2.25618 2.16820 -40.61161 876.46620
5410.0000 -42.77588 -40.80864 1.96724 2.16104 -40.66263 880.47678
5415.0000 -43.94967 -41.48183 2.46784 2.12428 -40.92435 871.46879
5420.0000 -42.55416 -40.30974 2.24442 2.14625 -40.76793 935.70280
5425.0000 -42.35891 -39.33250 3.02641 2.25740 -39.97646 947.64384
5430.0000 -42.65094 -39.89029 2.76065 2.29531 -39.70653 972.05952
5435.0000 -42.88580 -40.70859 2.17721 2.21210 -40.29900 918.55369
5440.0000 -43.04725 -41.66580 1.38144 2.03881 -41.53289 750.45263
5445.0000 -43.59401 -41.85102 1.74299 2.02009 -41.66619 722.10515
5450.0000 -42.78424 -40.70805 2.07619 2.00751 -41.75577 716.66676
5455.0000 -42.92488 -41.11265 1.81223 2.17854 -40.53798 870.15565
5460.0000 -42.77527 -40.64979 2.12548 2.12117 -40.94651 822.17731
5465.0000 -43.93550 -42.12232 1.81318 2.03574 -41.55477 751.25576
5470.0000 -43.80049 -42.02848 1.77201 1.99665 -41.83314 721.08057
5475.0000 -43.15702 -40.80528 2.35174 2.01203 -41.72359 709.98449
5480.0000 -41.95297 -39.70217 2.25080 2.27672 -39.83894 1034.67946
5485.0000 -43.09289 -40.93411 2.15878 2.18075 -40.52222 918.36089
5490.0000 -43.48290 -41.30176 2.18114 2.10842 -41.03726 812.94395
5495.0000 -43.89364 -41.79338 2.10027 2.01474 -41.70433 712.76872
5500.0000 -43.43855 -41.55886 1.87969 2.03671 -41.54787 799.19332
MELTING PROCESS: loop number 23 T-loop= 873.00000000000000
main_MD> interactions number 23 at Temperature= 873.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.70703 0.32399 -2.51942
force_rgl> df(natom) -0.94007 -1.51849 2.49045
5505.0000 -43.27386 -40.85883 2.41503 2.12581 -40.91343 856.54002
5510.0000 -42.88552 -40.87240 2.01312 2.13663 -40.83644 867.59096
5515.0000 -42.45328 -40.19976 2.25352 2.17983 -40.52880 912.40601
5520.0000 -43.33044 -41.25055 2.07989 2.16654 -40.62343 913.74232
5525.0000 -43.02608 -40.79367 2.23241 2.12829 -40.89578 875.43965
5530.0000 -43.03919 -40.75372 2.28547 2.12874 -40.89258 838.71549
5535.0000 -42.05809 -39.72939 2.32871 2.22014 -40.24176 937.75227
5540.0000 -42.53254 -40.38869 2.14384 2.27639 -39.84124 976.19745
5545.0000 -43.12276 -41.24682 1.87595 2.14097 -40.80550 827.24862
5550.0000 -43.18032 -41.17368 2.00664 2.13380 -40.85655 869.84987
5555.0000 -42.80545 -40.79553 2.00992 2.12414 -40.92532 869.04485
5560.0000 -43.00741 -40.11536 2.89205 2.15149 -40.73058 860.35457
5565.0000 -42.01790 -39.44774 2.57016 2.28075 -39.81021 1041.90949
5570.0000 -42.22790 -39.67410 2.55380 2.38313 -39.08125 1119.93416
5575.0000 -42.70437 -40.92205 1.78232 2.18581 -40.48626 887.84312
5580.0000 -42.91404 -41.26057 1.65347 2.09263 -41.14969 829.85180
5585.0000 -43.21916 -40.98186 2.23730 2.05701 -41.40333 780.11129
5590.0000 -42.75874 -40.26152 2.49723 2.13864 -40.82210 873.21389
5595.0000 -42.62177 -40.80290 1.81887 2.18010 -40.52691 934.31949
5600.0000 -43.02558 -41.25693 1.76865 2.12092 -40.94830 844.77006
5605.0000 -42.90046 -41.00227 1.89819 2.10850 -41.03669 876.08918
5610.0000 -42.74230 -40.90085 1.84145 2.16286 -40.64965 815.40098
5615.0000 -43.41530 -41.36792 2.04738 2.08467 -41.20638 836.58594
5620.0000 -42.95019 -41.19533 1.75486 2.04379 -41.49744 823.55239
5625.0000 -41.89948 -39.76925 2.13023 2.23689 -40.12254 972.23151
5630.0000 -41.63204 -39.45771 2.17432 2.29207 -39.72962 999.57937
5635.0000 -42.48966 -40.26955 2.22011 2.27414 -39.85729 990.13908
5640.0000 -42.23483 -39.83523 2.39960 2.20813 -40.32730 942.76924
5645.0000 -42.82087 -40.10709 2.71378 2.18752 -40.47405 908.73238
5650.0000 -43.51778 -41.51316 2.00463 2.23481 -40.13736 1051.08725
5655.0000 -43.57760 -41.67235 1.90524 2.01926 -41.67212 750.69142
5660.0000 -42.85767 -40.48175 2.37591 2.09009 -41.16780 819.67443
5665.0000 -42.61066 -40.45315 2.15751 2.18435 -40.49663 919.99845
5670.0000 -42.97308 -40.53224 2.44084 2.14988 -40.74206 854.87607
5675.0000 -42.06892 -39.69191 2.37701 2.23947 -40.10412 980.67574
5680.0000 -42.85126 -40.71582 2.13544 2.20944 -40.31800 960.88426
5685.0000 -42.09657 -40.31104 1.78552 2.20254 -40.36709 948.47059
5690.0000 -43.05027 -40.94653 2.10374 2.17661 -40.55172 831.44700
5695.0000 -42.92919 -41.04404 1.88516 2.10658 -41.05038 820.05947
5700.0000 -42.94662 -41.03499 1.91163 2.10429 -41.06671 830.02088
5705.0000 -42.94590 -40.85689 2.08901 2.09516 -41.13166 772.15393
5710.0000 -41.85191 -39.80826 2.04365 2.19096 -40.44954 845.08047
5715.0000 -42.54383 -40.20136 2.34246 2.23174 -40.15918 928.85478
5720.0000 -42.77871 -40.39529 2.38341 2.17111 -40.59087 890.91862
5725.0000 -42.28690 -40.52878 1.75812 2.17822 -40.54030 952.95735
5730.0000 -41.97675 -39.01774 2.95900 2.29814 -39.68643 1049.23352
5735.0000 -42.87301 -40.96850 1.90451 2.22013 -40.24186 931.98076
5740.0000 -42.60247 -40.45644 2.14603 2.16510 -40.63367 844.79420
5745.0000 -42.60750 -40.45168 2.15582 2.19240 -40.43932 931.77697
5750.0000 -42.92142 -40.16019 2.76123 2.23969 -40.10259 1024.05419
MELTING PROCESS: loop number 24 T-loop= 898.00000000000000
main_MD> interactions number 24 at Temperature= 898.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.06164 -1.30600 2.95114
force_rgl> df(natom) -0.65972 0.89290 -0.99719
5755.0000 -42.78172 -40.91306 1.86866 2.16474 -40.63627 882.46172
5760.0000 -43.93162 -41.53149 2.40013 2.08027 -41.23772 846.51438
5765.0000 -42.84178 -41.08521 1.75657 2.07277 -41.29114 825.34731
5770.0000 -42.49236 -40.58494 1.90742 2.14096 -40.80557 900.36929
5775.0000 -42.28123 -40.10096 2.18027 2.24579 -40.05915 1018.20335
5780.0000 -42.31144 -40.20688 2.10456 2.24390 -40.07261 988.05971
5785.0000 -42.82778 -40.38166 2.44612 2.27055 -39.88285 998.93352
5790.0000 -43.42934 -41.07137 2.35797 2.16116 -40.66177 860.15028
5795.0000 -44.05218 -42.14800 1.90417 2.12168 -40.94285 851.98170
5800.0000 -43.59270 -41.32455 2.26815 2.01710 -41.68751 793.31671
5805.0000 -43.33719 -40.81039 2.52680 2.10853 -41.03647 843.36585
5810.0000 -42.62715 -40.27093 2.35622 2.25694 -39.97978 1058.83943
5815.0000 -42.60191 -40.51762 2.08429 2.16237 -40.65314 886.67295
5820.0000 -42.52115 -39.44195 3.07920 2.25036 -40.02662 1033.68607
5825.0000 -42.00327 -39.30779 2.69547 2.30984 -39.60308 1062.15463
5830.0000 -41.52718 -39.11199 2.41519 2.28334 -39.79177 1022.74856
5835.0000 -43.00732 -41.04569 1.96163 2.24924 -40.03455 937.84641
5840.0000 -42.71328 -40.17605 2.53722 2.14558 -40.77267 965.00792
5845.0000 -42.94433 -40.78469 2.15964 2.19845 -40.39620 978.35989
5850.0000 -43.39598 -40.53327 2.86272 2.10560 -41.05736 806.83401
5855.0000 -43.04244 -41.17305 1.86938 2.13785 -40.82776 898.61585
5860.0000 -43.22293 -41.05970 2.16323 2.16143 -40.65980 922.91660
5865.0000 -43.36321 -41.69124 1.67197 2.05789 -41.39707 757.74510
5870.0000 -43.01529 -41.03897 1.97631 2.11010 -41.02535 817.12106
5875.0000 -42.28508 -40.74980 1.53528 2.14556 -40.77281 883.30664
5880.0000 -42.94949 -41.06432 1.88517 2.20679 -40.33686 938.58492
5885.0000 -42.98657 -40.51744 2.46913 2.15032 -40.73890 884.07374
5890.0000 -43.52679 -40.65968 2.86711 2.12813 -40.89690 849.32099
5895.0000 -42.70161 -40.02781 2.67381 2.23752 -40.11801 950.51605
5900.0000 -42.29141 -40.02011 2.27129 2.21775 -40.25881 906.46108
5905.0000 -42.07895 -39.51201 2.56694 2.25709 -39.97867 994.73181
5910.0000 -42.60206 -39.45037 3.15169 2.41085 -38.88384 1234.91705
5915.0000 -42.40262 -40.48102 1.92160 2.23125 -40.16271 968.86400
5920.0000 -42.31490 -40.00593 2.30897 2.22050 -40.23923 980.71961
5925.0000 -42.99388 -40.10707 2.88682 2.20694 -40.33575 1000.25051
5930.0000 -43.45842 -40.82168 2.63674 2.17748 -40.54554 966.48780
5935.0000 -43.10920 -41.10723 2.00196 2.15515 -40.70454 917.94749
5940.0000 -42.74901 -40.55276 2.19625 2.12677 -40.90662 849.66847
5945.0000 -43.14771 -40.32131 2.82640 2.24426 -40.07003 987.08649
5950.0000 -43.13525 -40.52973 2.60552 2.20300 -40.36382 932.04174
5955.0000 -42.51454 -40.50495 2.00959 2.20129 -40.37602 917.75451
5960.0000 -42.77718 -39.92639 2.85079 2.20528 -40.34757 869.08690
5965.0000 -42.84055 -40.46478 2.37577 2.17004 -40.59849 926.87994
5970.0000 -42.34380 -40.08558 2.25822 2.24248 -40.08275 962.09677
5975.0000 -42.57175 -40.72923 1.84252 2.18003 -40.52739 903.98577
5980.0000 -43.41088 -41.55319 1.85768 2.07628 -41.26611 802.54108
5985.0000 -42.22381 -39.96172 2.26208 2.22308 -40.22086 955.94456
5990.0000 -43.03620 -40.42239 2.61382 2.18963 -40.45900 955.40046
5995.0000 -42.43772 -40.44037 1.99735 2.17367 -40.57267 916.41176
6000.0000 -42.40356 -39.80784 2.59572 2.24110 -40.09255 998.40292
MELTING PROCESS: loop number 25 T-loop= 923.00000000000000
main_MD> interactions number 25 at Temperature= 923.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.54945 -0.98800 -4.48175
force_rgl> df(natom) -4.33954 -1.31337 -0.06593
6005.0000 -41.30603 -38.88497 2.42106 2.34717 -39.33731 1042.88567
6010.0000 -43.35301 -40.86355 2.48946 2.25329 -40.00573 986.89158
6015.0000 -42.76270 -40.14743 2.61528 2.19747 -40.40322 952.23524
6020.0000 -43.11252 -41.62022 1.49230 2.08586 -41.19793 773.75513
6025.0000 -42.15313 -40.13362 2.01951 2.14562 -40.77242 848.20902
6030.0000 -42.80628 -40.11734 2.68894 2.18038 -40.52490 934.09183
6035.0000 -42.03853 -40.04479 1.99374 2.26951 -39.89022 964.46628
6040.0000 -43.09485 -40.66668 2.42817 2.20284 -40.36498 952.75103
6045.0000 -42.73656 -40.25731 2.47924 2.21235 -40.29726 957.79690
6050.0000 -43.04192 -40.93347 2.10845 2.18178 -40.51493 938.33678
6055.0000 -43.70589 -41.07677 2.62912 2.11952 -40.95822 840.98733
6060.0000 -41.80917 -40.01214 1.79703 2.16504 -40.63413 926.32948
6065.0000 -42.15501 -40.11300 2.04200 2.18163 -40.51596 873.24856
6070.0000 -40.94455 -38.97538 1.96916 2.32971 -39.46164 1073.93251
6075.0000 -41.82880 -40.04803 1.78078 2.29802 -39.68722 986.19423
6080.0000 -42.70202 -39.60034 3.10168 2.28894 -39.75190 1002.06296
6085.0000 -41.89730 -39.97675 1.92055 2.35815 -39.25908 1090.31743
6090.0000 -43.10377 -40.33660 2.76717 2.28462 -39.78266 1032.72306
6095.0000 -42.99990 -40.67850 2.32141 2.22096 -40.23593 1007.14298
6100.0000 -41.86707 -39.80203 2.06504 2.22808 -40.18522 917.98775
6105.0000 -43.22727 -41.19621 2.03106 2.17602 -40.55594 883.47777
6110.0000 -43.24040 -41.18172 2.05867 2.08516 -41.20286 769.80865
6115.0000 -42.99324 -41.08834 1.90491 2.10477 -41.06324 844.23371
6120.0000 -42.71972 -39.67214 3.04758 2.25233 -40.01258 1035.43840
6125.0000 -42.61595 -40.09305 2.52290 2.32656 -39.48406 1143.99807
6130.0000 -42.02209 -39.82583 2.19626 2.27892 -39.82323 1036.16719
6135.0000 -42.45720 -39.92678 2.53043 2.25487 -39.99449 960.49365
6140.0000 -41.60166 -38.97337 2.62829 2.36257 -39.22766 1108.47263
6145.0000 -42.47199 -39.81109 2.66089 2.37359 -39.14913 1143.74323
6150.0000 -42.91221 -40.04471 2.86750 2.24894 -40.03671 957.02454
6155.0000 -42.96929 -40.60579 2.36350 2.17188 -40.58541 919.71232
6160.0000 -43.22128 -40.32884 2.89243 2.20988 -40.31483 928.15383
6165.0000 -43.09431 -40.85511 2.23920 2.16603 -40.62709 889.70032
6170.0000 -42.99899 -40.96176 2.03723 2.20586 -40.34344 919.75951
6175.0000 -42.91194 -41.27726 1.63467 2.09505 -41.13245 790.41406
6180.0000 -43.43530 -40.95220 2.48310 2.16304 -40.64835 923.75834
6185.0000 -43.25856 -41.25835 2.00021 2.08601 -41.19685 782.09233
6190.0000 -42.91696 -40.42911 2.48784 2.05040 -41.45039 794.26057
6195.0000 -42.26249 -40.39592 1.86657 2.20175 -40.37273 914.08391
6200.0000 -42.17782 -39.94116 2.23665 2.22672 -40.19491 980.85603
6205.0000 -42.07121 -39.47336 2.59785 2.28351 -39.79054 999.73623
6210.0000 -41.61136 -39.33979 2.27157 2.37562 -39.13473 1111.59870
6215.0000 -42.18810 -39.58955 2.59855 2.32388 -39.50309 1048.38025
6220.0000 -41.87868 -39.33259 2.54609 2.33553 -39.42016 1031.71886
6225.0000 -41.57604 -39.11671 2.45933 2.33599 -39.41693 1110.73638
6230.0000 -42.08324 -39.10940 2.97384 2.34481 -39.35408 1106.52960
6235.0000 -42.12054 -40.21724 1.90330 2.28271 -39.79625 1051.74514
6240.0000 -42.84185 -40.86894 1.97291 2.20006 -40.38476 893.51404
6245.0000 -42.82466 -40.77538 2.04928 2.18290 -40.50696 949.51207
6250.0000 -42.48811 -40.67401 1.81410 2.18700 -40.47777 920.83671
MELTING PROCESS: loop number 26 T-loop= 948.00000000000000
main_MD> interactions number 26 at Temperature= 948.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.27707 -2.62121 -0.08259
force_rgl> df(natom) -0.64033 1.34026 0.55105
6255.0000 -41.96233 -40.17638 1.78595 2.18588 -40.48574 867.36834
6260.0000 -41.91202 -39.12330 2.78872 2.31920 -39.53647 1057.19168
6265.0000 -42.97138 -40.98908 1.98229 2.23686 -40.12275 1007.29478
6270.0000 -43.12890 -40.34968 2.77922 2.15986 -40.67101 890.20552
6275.0000 -41.43649 -38.34127 3.09522 2.26732 -39.90582 1030.21395
6280.0000 -42.43258 -39.94976 2.48282 2.35387 -39.28960 1130.77116
6285.0000 -42.86642 -40.75909 2.10733 2.18097 -40.52072 880.75013
6290.0000 -41.17370 -39.51094 1.66277 2.23103 -40.16427 931.82149
6295.0000 -41.63535 -39.65096 1.98439 2.30949 -39.60560 981.91545
6300.0000 -42.00347 -39.36189 2.64158 2.29654 -39.69780 973.84421
6305.0000 -42.53319 -39.31569 3.21750 2.27740 -39.83407 1000.39475
6310.0000 -42.83658 -40.24710 2.58947 2.27786 -39.83079 1045.67511
6315.0000 -42.20607 -40.15091 2.05515 2.25872 -39.96705 1087.99134
6320.0000 -42.48898 -39.59492 2.89406 2.24356 -40.07503 968.34470
6325.0000 -41.90959 -39.18829 2.72130 2.34947 -39.32094 1062.59047
6330.0000 -42.37597 -39.53480 2.84116 2.35194 -39.30329 1066.67365
6335.0000 -42.88150 -39.90755 2.97395 2.30118 -39.66473 1046.93978
6340.0000 -43.10163 -40.83399 2.26765 2.19222 -40.44059 946.02051
6345.0000 -42.15338 -39.61066 2.54273 2.20826 -40.32636 944.94460
6350.0000 -42.81553 -40.31083 2.50470 2.25874 -39.96694 967.01394
6355.0000 -42.99329 -40.43758 2.55571 2.21274 -40.29447 941.06484
6360.0000 -42.77938 -40.56671 2.21266 2.19390 -40.42860 916.93043
6365.0000 -42.91585 -40.34631 2.56954 2.19429 -40.42586 926.89668
6370.0000 -43.28668 -41.00038 2.28630 2.10700 -41.04739 868.36098
6375.0000 -42.99095 -40.73615 2.25480 2.17676 -40.55070 866.61108
6380.0000 -43.31919 -41.58782 1.73137 2.09476 -41.13456 795.70551
6385.0000 -42.72059 -40.56695 2.15364 2.12296 -40.93371 835.12965
6390.0000 -42.05725 -39.69018 2.36708 2.19604 -40.41340 851.11993
6395.0000 -42.83230 -39.76731 3.06499 2.35762 -39.26286 1054.64088
6400.0000 -42.18788 -39.90172 2.28616 2.23853 -40.11087 989.02643
6405.0000 -41.94075 -39.34756 2.59319 2.28601 -39.77274 997.52675
6410.0000 -41.49134 -38.93367 2.55767 2.33374 -39.43294 1028.72520
6415.0000 -42.72843 -39.76645 2.96198 2.31526 -39.56449 1028.63909
6420.0000 -41.82646 -39.19936 2.62710 2.32055 -39.52682 1024.68391
6425.0000 -42.81942 -40.92640 1.89302 2.33116 -39.45126 1108.06658
6430.0000 -42.02333 -40.22733 1.79600 2.20987 -40.31493 895.77225
6435.0000 -41.51329 -39.60563 1.90766 2.17943 -40.53162 890.80342
6440.0000 -42.56517 -40.80627 1.75890 2.22970 -40.17370 983.86022
6445.0000 -42.52980 -40.43254 2.09726 2.22803 -40.18559 954.95711
6450.0000 -43.25512 -41.21973 2.03538 2.10241 -41.08007 810.26837
6455.0000 -42.92774 -40.41689 2.51084 2.17242 -40.58159 903.06024
6460.0000 -43.08581 -41.46122 1.62459 2.17703 -40.54877 917.33304
6465.0000 -42.59069 -40.72170 1.86899 2.09074 -41.16313 781.60568
6470.0000 -44.09389 -42.18121 1.91268 2.02110 -41.65902 752.74490
6475.0000 -42.83628 -40.11230 2.72398 2.11330 -41.00250 878.51174
6480.0000 -43.16336 -40.20589 2.95746 2.22713 -40.19200 1020.70703
6485.0000 -42.97257 -40.33499 2.63758 2.23323 -40.14859 1045.28325
6490.0000 -42.53370 -40.01238 2.52132 2.14617 -40.76848 910.38316
6495.0000 -42.45529 -40.18325 2.27204 2.23371 -40.14515 979.92918
6500.0000 -42.60581 -40.50959 2.09622 2.23759 -40.11751 967.10769
MELTING PROCESS: loop number 27 T-loop= 973.00000000000000
main_MD> interactions number 27 at Temperature= 973.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.95141 -2.61214 0.12299
force_rgl> df(natom) -0.65786 -2.31351 0.22781
6505.0000 -42.04580 -39.27629 2.76951 2.25192 -40.01551 1018.74513
6510.0000 -43.02948 -40.84084 2.18864 2.18814 -40.46961 929.00542
6515.0000 -43.22322 -41.27201 1.95121 2.09912 -41.10349 837.45248
6520.0000 -43.11578 -41.00921 2.10657 2.12804 -40.89755 872.24564
6525.0000 -42.54089 -40.77286 1.76803 2.17455 -40.56644 914.27107
6530.0000 -41.57640 -39.22604 2.35036 2.32218 -39.51524 1027.77515
6535.0000 -41.21247 -38.88940 2.32307 2.42045 -38.81554 1142.32095
6540.0000 -42.58396 -39.76302 2.82094 2.37038 -39.17205 1130.61686
6545.0000 -41.61297 -39.52203 2.09095 2.31595 -39.55960 1110.26961
6550.0000 -42.41111 -39.85688 2.55423 2.33906 -39.39502 1055.02994
6555.0000 -43.99563 -41.55334 2.44229 2.16485 -40.63546 918.78787
6560.0000 -43.45798 -41.32906 2.12892 2.06085 -41.37597 788.72529
6565.0000 -41.72600 -39.73353 1.99247 2.17172 -40.58654 869.20617
6570.0000 -42.37498 -40.30104 2.07394 2.32744 -39.47777 1025.67252
6575.0000 -42.39655 -40.39446 2.00209 2.28025 -39.81375 956.27140
6580.0000 -41.44682 -39.33763 2.10919 2.24855 -40.03952 987.57643
6585.0000 -41.95952 -39.34100 2.61852 2.39033 -39.03001 1170.68105
6590.0000 -43.17301 -40.63710 2.53591 2.29994 -39.67356 1026.60517
6595.0000 -42.63096 -40.37051 2.26044 2.16117 -40.66164 873.68642
6600.0000 -42.82196 -40.15842 2.66354 2.23209 -40.15673 988.13403
6605.0000 -43.41200 -40.75292 2.65908 2.23643 -40.12581 928.18825
6610.0000 -42.57165 -39.67844 2.89321 2.25075 -40.02383 967.88685
6615.0000 -42.61553 -39.79186 2.82367 2.32185 -39.51755 1116.80424
6620.0000 -42.55816 -39.36009 3.19807 2.34495 -39.35311 1109.17009
6625.0000 -42.08041 -40.07484 2.00557 2.29699 -39.69461 998.63640
6630.0000 -42.79173 -40.77981 2.01193 2.23714 -40.12075 1019.26248
6635.0000 -43.01307 -40.84827 2.16480 2.18761 -40.47342 988.13533
6640.0000 -42.72407 -39.84559 2.87848 2.19117 -40.44808 871.24492
6645.0000 -42.39281 -40.32280 2.07001 2.15829 -40.68220 881.95577
6650.0000 -42.81670 -40.32219 2.49451 2.12099 -40.94776 840.62495
6655.0000 -43.44627 -41.45495 1.99131 2.13770 -40.82880 849.76617
6660.0000 -41.94986 -39.92689 2.02297 2.11048 -41.02257 815.77050
6665.0000 -43.02438 -40.43991 2.58447 2.27325 -39.86365 1017.12810
6670.0000 -42.96759 -40.27010 2.69750 2.18498 -40.49216 878.95749
6675.0000 -42.80088 -40.08060 2.72028 2.19686 -40.40757 929.68810
6680.0000 -41.89945 -39.91543 1.98402 2.30218 -39.65765 1134.56395
6685.0000 -41.91447 -38.55504 3.35943 2.38185 -39.09035 1100.30146
6690.0000 -42.05036 -39.11394 2.93642 2.35295 -39.29612 1118.98898
6695.0000 -42.27050 -40.35226 1.91824 2.32119 -39.52230 1008.28557
6700.0000 -42.06366 -39.63036 2.43331 2.24490 -40.06548 1012.33427
6705.0000 -42.73098 -39.91066 2.82032 2.30421 -39.64318 1053.30921
6710.0000 -42.57121 -40.16914 2.40207 2.23875 -40.10925 960.87934
6715.0000 -42.68174 -39.94319 2.73855 2.21958 -40.24581 971.47985
6720.0000 -42.21096 -39.35504 2.85591 2.25813 -39.97131 990.75363
6725.0000 -43.05762 -40.26012 2.79749 2.27552 -39.84746 1004.88742
6730.0000 -42.29464 -40.20071 2.09393 2.25869 -39.96730 896.60323
6735.0000 -42.38586 -40.31206 2.07380 2.21874 -40.25176 874.10164
6740.0000 -42.68905 -40.63977 2.04928 2.22185 -40.22960 947.41905
6745.0000 -42.57779 -40.86044 1.71736 2.15062 -40.73683 889.26212
6750.0000 -42.80720 -40.91368 1.89352 2.14243 -40.79509 886.23018
MELTING PROCESS: loop number 28 T-loop= 998.00000000000000
main_MD> interactions number 28 at Temperature= 998.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.44892 -9.67661 -1.65205
force_rgl> df(natom) 3.05925 -0.39918 2.61563
6755.0000 -42.72990 -40.42957 2.30033 2.19687 -40.40747 892.63023
6760.0000 -41.47136 -39.26835 2.20301 2.25512 -39.99274 969.69419
6765.0000 -42.85681 -40.77511 2.08170 2.25565 -39.98891 1023.95626
6770.0000 -43.52237 -40.90029 2.62208 2.15608 -40.69792 835.64428
6775.0000 -42.96296 -40.67984 2.28312 2.18770 -40.47278 968.72739
6780.0000 -42.41093 -40.49456 1.91636 2.20325 -40.36206 890.71785
6785.0000 -42.26932 -39.52754 2.74178 2.27455 -39.85436 1049.02981
6790.0000 -41.90250 -38.83416 3.06833 2.36929 -39.17979 1113.14150
6795.0000 -42.06451 -39.69341 2.37110 2.37229 -39.15840 1118.12757
6800.0000 -42.52143 -38.34668 4.17476 2.40548 -38.92211 1097.51188
6805.0000 -42.10085 -39.86632 2.23453 2.38900 -39.03947 1136.30496
6810.0000 -41.66858 -39.30801 2.36057 2.27363 -39.86090 991.11670
6815.0000 -40.73758 -37.71345 3.02413 2.50180 -38.23627 1201.99065
6820.0000 -42.49415 -39.68529 2.80885 2.38685 -39.05476 1135.39026
6825.0000 -42.55630 -40.07801 2.47829 2.33456 -39.42706 1040.27927
6830.0000 -41.57642 -38.90618 2.67024 2.29453 -39.71209 1015.60162
6835.0000 -42.35287 -39.55784 2.79503 2.28903 -39.75129 983.62340
6840.0000 -41.95156 -39.11355 2.83801 2.29452 -39.71215 995.15475
6845.0000 -41.83387 -39.52698 2.30689 2.35517 -39.28029 1066.69754
6850.0000 -42.77963 -39.53997 3.23966 2.32284 -39.51055 1094.01345
6855.0000 -42.43296 -39.83526 2.59770 2.26168 -39.94599 989.63104
6860.0000 -42.55079 -39.58523 2.96556 2.20225 -40.36917 968.48493
6865.0000 -42.68297 -41.38941 1.29356 2.14433 -40.78160 876.82206
6870.0000 -42.70420 -40.11277 2.59143 2.19296 -40.43529 836.93639
6875.0000 -40.98936 -38.64693 2.34243 2.34432 -39.35761 1073.13969
6880.0000 -41.66215 -38.99009 2.67206 2.42292 -38.79789 1190.60060
6885.0000 -42.42994 -39.73500 2.69494 2.32125 -39.52182 1045.73423
6890.0000 -42.46625 -39.92289 2.54336 2.21311 -40.29186 893.72497
6895.0000 -41.66742 -38.68079 2.98662 2.25324 -40.00608 958.17892
6900.0000 -42.72885 -40.14050 2.58835 2.33349 -39.43470 1065.62077
6905.0000 -42.04044 -39.21788 2.82257 2.26440 -39.92667 984.44680
6910.0000 -41.27593 -38.10792 3.16801 2.47339 -38.43858 1314.20735
6915.0000 -43.17931 -40.59699 2.58233 2.22884 -40.17986 906.44119
6920.0000 -43.23246 -40.43214 2.80032 2.20618 -40.34117 938.64823
6925.0000 -43.43584 -41.86403 1.57181 2.12238 -40.93789 823.14580
6930.0000 -42.86284 -41.42363 1.43921 2.08062 -41.23525 808.44724
6935.0000 -43.12453 -40.52214 2.60239 2.10583 -41.05572 818.00074
6940.0000 -43.34977 -40.75411 2.59566 2.22680 -40.19439 950.76373
6945.0000 -43.04633 -41.50027 1.54606 2.05504 -41.41739 767.92321
6950.0000 -42.24799 -40.12378 2.12421 2.22715 -40.19187 943.99524
6955.0000 -42.01361 -39.74122 2.27239 2.35478 -39.28312 1103.35281
6960.0000 -41.75965 -39.34654 2.41312 2.34861 -39.32702 951.60801
6965.0000 -42.73454 -40.05731 2.67722 2.25978 -39.95955 1013.70868
6970.0000 -43.22318 -40.75302 2.47016 2.19929 -40.39025 901.28093
6975.0000 -41.86597 -40.03917 1.82680 2.23820 -40.11316 961.65068
6980.0000 -41.85033 -39.34748 2.50285 2.29623 -39.70001 1051.80228
6985.0000 -41.88672 -39.55379 2.33293 2.36900 -39.18185 1077.04725
6990.0000 -41.85403 -39.64174 2.21230 2.20878 -40.32269 905.82823
6995.0000 -42.39514 -40.41951 1.97562 2.21755 -40.26020 986.20309
7000.0000 -43.51176 -41.33184 2.17993 2.16414 -40.64054 880.64564
MELTING PROCESS: loop number 29 T-loop= 1023.0000000000000
main_MD> interactions number 29 at Temperature= 1023.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.32806 -2.40324 0.46439
force_rgl> df(natom) 2.34988 -0.62506 -1.01150
7005.0000 -43.93782 -41.33127 2.60655 2.02365 -41.64086 777.06274
7010.0000 -43.31589 -41.15701 2.15888 2.12215 -40.93953 889.22361
7015.0000 -42.04846 -40.22670 1.82176 2.19512 -40.41991 913.17290
7020.0000 -42.10440 -39.81663 2.28777 2.32601 -39.48797 1067.48199
7025.0000 -43.13134 -40.46624 2.66510 2.20542 -40.34657 902.73030
7030.0000 -42.81443 -40.12631 2.68812 2.22145 -40.23244 933.33037
7035.0000 -41.54454 -39.28667 2.25788 2.28567 -39.77521 940.43588
7040.0000 -42.44042 -40.05863 2.38179 2.33497 -39.42413 1095.95321
7045.0000 -42.80404 -40.53341 2.27063 2.27336 -39.86284 1044.26265
7050.0000 -43.23060 -41.41749 1.81310 2.08426 -41.20928 853.09896
7055.0000 -43.19891 -41.29113 1.90778 2.03545 -41.55685 773.76839
7060.0000 -42.66118 -40.09457 2.56662 2.15790 -40.68497 860.96840
7065.0000 -42.35865 -39.66045 2.69820 2.26301 -39.93653 951.23444
7070.0000 -42.56325 -39.77909 2.78416 2.35753 -39.26349 1138.86244
7075.0000 -41.96353 -40.02929 1.93424 2.28582 -39.77414 1010.51716
7080.0000 -41.61654 -38.64544 2.97110 2.33822 -39.40100 1086.44247
7085.0000 -42.13097 -39.81173 2.31924 2.33334 -39.43578 972.70527
7090.0000 -42.01008 -38.50551 3.50457 2.33139 -39.44963 1093.22579
7095.0000 -40.51005 -37.87007 2.63998 2.51133 -38.16838 1236.81122
7100.0000 -42.70338 -39.68575 3.01764 2.46293 -38.51305 1242.83023
7105.0000 -43.05068 -40.43541 2.61527 2.24249 -40.08264 979.85023
7110.0000 -42.44096 -40.27011 2.17085 2.19913 -40.39137 935.41301
7115.0000 -42.12136 -40.51181 1.60955 2.11969 -40.95704 847.52365
7120.0000 -42.82453 -40.63855 2.18597 2.14981 -40.74259 921.09333
7125.0000 -42.39565 -40.13569 2.25997 2.15808 -40.68369 853.74531
7130.0000 -42.43747 -39.66062 2.77685 2.29503 -39.70856 1006.98137
7135.0000 -43.51225 -40.73945 2.77280 2.21109 -40.30622 958.86961
7140.0000 -43.39740 -41.08364 2.31377 2.11765 -40.97154 866.09285
7145.0000 -42.43674 -40.36419 2.07255 2.19805 -40.39907 860.06449
7150.0000 -42.65816 -39.86894 2.78921 2.20461 -40.35240 955.77280
7155.0000 -42.50534 -39.31157 3.19377 2.30726 -39.62149 1070.14870
7160.0000 -40.89600 -39.20707 1.68893 2.33625 -39.41503 1075.11138
7165.0000 -42.26201 -39.78717 2.47484 2.28737 -39.76308 994.88161
7170.0000 -42.02406 -39.25073 2.77334 2.36108 -39.23821 1134.62906
7175.0000 -40.67218 -38.09722 2.57497 2.42854 -38.75789 1194.59399
7180.0000 -41.73185 -37.97610 3.75574 2.46230 -38.51754 1253.39981
7185.0000 -42.56546 -39.20481 3.36064 2.39904 -38.96798 1166.03590
7190.0000 -41.66277 -39.21105 2.45172 2.29339 -39.72024 1052.99202
7195.0000 -42.10966 -39.03733 3.07233 2.43165 -38.73578 1176.33725
7200.0000 -42.54740 -39.51288 3.03453 2.34013 -39.38742 1057.46830
7205.0000 -42.18269 -39.70549 2.47720 2.27917 -39.82150 922.30620
7210.0000 -41.63245 -39.85551 1.77694 2.25373 -40.00264 945.22001
7215.0000 -42.36374 -39.52559 2.83815 2.35706 -39.26685 1108.56816
7220.0000 -42.85369 -40.33365 2.52003 2.31684 -39.55326 1077.46522
7225.0000 -42.08040 -38.62405 3.45634 2.26914 -39.89292 982.94380
7230.0000 -41.96601 -39.62326 2.34274 2.39730 -38.98035 1119.65300
7235.0000 -42.71833 -40.58568 2.13265 2.27676 -39.83865 1008.75560
7240.0000 -41.91582 -39.43367 2.48214 2.32362 -39.50499 1043.48572
7245.0000 -42.39090 -40.26300 2.12791 2.26234 -39.94129 929.69099
7250.0000 -41.48209 -39.14324 2.33885 2.28100 -39.80842 1044.05314
MELTING PROCESS: loop number 30 T-loop= 1048.0000000000000
main_MD> interactions number 30 at Temperature= 1048.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.21731 -5.13589 1.28249
force_rgl> df(natom) -2.23160 1.29515 2.53123
7255.0000 -41.05874 -39.34348 1.71526 2.38039 -39.10072 1085.51970
7260.0000 -41.97775 -40.26198 1.71576 2.33165 -39.44777 1077.62040
7265.0000 -42.05753 -38.84495 3.21258 2.29764 -39.68994 1026.35129
7270.0000 -41.87824 -39.11040 2.76783 2.49228 -38.30404 1214.47172
7275.0000 -41.44678 -39.39898 2.04780 2.42849 -38.75826 1205.79361
7280.0000 -42.58950 -39.20646 3.38304 2.42511 -38.78235 1175.89047
7285.0000 -41.81203 -38.15532 3.65671 2.42678 -38.77042 1232.88807
7290.0000 -41.51746 -39.04906 2.46840 2.40523 -38.92387 1137.61994
7295.0000 -43.22152 -39.97317 3.24835 2.33164 -39.44790 1109.34505
7300.0000 -42.33007 -39.48556 2.84452 2.29773 -39.68932 1081.73213
7305.0000 -41.76419 -39.55559 2.20859 2.27161 -39.87531 1040.94671
7310.0000 -41.87540 -39.46201 2.41339 2.29150 -39.73367 1026.52355
7315.0000 -41.36015 -38.50642 2.85373 2.35631 -39.27222 1135.85919
7320.0000 -42.37400 -40.67534 1.69865 2.27152 -39.87595 1033.42092
7325.0000 -42.78761 -40.57488 2.21273 2.20276 -40.36557 889.65212
7330.0000 -42.50980 -39.83302 2.67678 2.31614 -39.55822 1080.26884
7335.0000 -42.25026 -39.28836 2.96190 2.30783 -39.61741 1052.17001
7340.0000 -42.33536 -40.17679 2.15857 2.27513 -39.85022 1060.84308
7345.0000 -42.62140 -39.78721 2.83419 2.26806 -39.90058 986.68545
7350.0000 -42.43916 -39.23522 3.20394 2.35475 -39.28328 1081.12648
7355.0000 -41.46222 -38.41258 3.04964 2.42548 -38.77969 1140.46552
7360.0000 -42.36789 -39.72457 2.64332 2.27962 -39.81824 984.08647
7365.0000 -41.58499 -39.67798 1.90701 2.29677 -39.69616 1060.82552
7370.0000 -42.42626 -40.39897 2.02730 2.19734 -40.40412 850.92150
7375.0000 -42.43567 -40.30295 2.13272 2.23407 -40.14260 1026.15723
7380.0000 -42.06971 -39.94550 2.12421 2.18162 -40.51608 909.36431
7385.0000 -43.00375 -40.02682 2.97694 2.25178 -40.01649 1035.82294
7390.0000 -42.09663 -39.79153 2.30509 2.27579 -39.84553 1005.40732
7395.0000 -42.74973 -39.38444 3.36529 2.30845 -39.61297 997.22006
7400.0000 -42.12383 -39.90771 2.21611 2.33917 -39.39426 1045.63422
7405.0000 -42.81577 -40.48782 2.32795 2.22665 -40.19541 933.50494
7410.0000 -42.51012 -40.43677 2.07335 2.18866 -40.46591 942.12663
7415.0000 -42.58690 -40.40886 2.17804 2.25009 -40.02850 1013.92140
7420.0000 -42.70869 -39.70487 3.00382 2.21451 -40.28186 976.22724
7425.0000 -41.99772 -39.33100 2.66672 2.22289 -40.22222 926.61070
7430.0000 -42.76383 -40.95802 1.80581 2.35781 -39.26154 1080.01821
7435.0000 -42.15128 -39.29683 2.85445 2.20996 -40.31428 965.50552
7440.0000 -41.56613 -38.93270 2.63343 2.36983 -39.17592 1133.39418
7445.0000 -42.00202 -39.18697 2.81505 2.37148 -39.16416 1004.57459
7450.0000 -43.18554 -41.41134 1.77420 2.23572 -40.13087 952.14810
7455.0000 -41.89172 -39.52990 2.36182 2.20907 -40.32064 923.87442
7460.0000 -41.57851 -38.98199 2.59652 2.32241 -39.51359 1049.47871
7465.0000 -41.77570 -38.60635 3.16935 2.46190 -38.52039 1213.28225
7470.0000 -43.06259 -40.22636 2.83624 2.36613 -39.20227 1075.87067
7475.0000 -42.57865 -39.32148 3.25718 2.22619 -40.19871 904.41134
7480.0000 -42.40026 -39.72757 2.67269 2.38711 -39.05291 1176.26144
7485.0000 -41.55356 -39.17862 2.37494 2.39196 -39.01839 1101.50845
7490.0000 -41.56307 -38.30636 3.25671 2.34676 -39.34020 1119.54982
7495.0000 -42.25335 -39.93069 2.32266 2.38524 -39.06623 1128.37310
7500.0000 -41.84531 -38.98624 2.85907 2.31924 -39.53616 1088.77385
MELTING PROCESS: loop number 31 T-loop= 1073.0000000000000
main_MD> interactions number 31 at Temperature= 1073.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24842 -1.95231 1.80691
force_rgl> df(natom) 0.32224 -0.68725 -2.03396
7505.0000 -41.49998 -38.43204 3.06795 2.45658 -38.55827 1221.19974
7510.0000 -41.22210 -38.82181 2.40029 2.43753 -38.69392 1148.16887
7515.0000 -41.26423 -38.77042 2.49381 2.41715 -38.83900 1141.61852
7520.0000 -42.81634 -39.69728 3.11906 2.34434 -39.35746 1035.51982
7525.0000 -42.29405 -39.37732 2.91674 2.31453 -39.56967 1047.05426
7530.0000 -41.89196 -39.29908 2.59288 2.31900 -39.53785 1075.80988
7535.0000 -42.19347 -39.07937 3.11410 2.32882 -39.46798 1065.71010
7540.0000 -41.42374 -38.57710 2.84664 2.41218 -38.87440 1143.68018
7545.0000 -42.00186 -39.88862 2.11324 2.37871 -39.11273 1107.92307
7550.0000 -41.94713 -39.89100 2.05613 2.34222 -39.37253 1119.98985
7555.0000 -41.33171 -38.37064 2.96107 2.40498 -38.92566 1068.57712
7560.0000 -41.94333 -39.04637 2.89696 2.38203 -39.08904 1110.42555
7565.0000 -40.93594 -38.38334 2.55260 2.39663 -38.98509 1076.21947
7570.0000 -41.41222 -38.06414 3.34808 2.52528 -38.06910 1237.59677
7575.0000 -41.81834 -38.91211 2.90623 2.50036 -38.24654 1194.78504
7580.0000 -41.54134 -39.32045 2.22089 2.35990 -39.24668 1107.24145
7585.0000 -42.79368 -39.43268 3.36101 2.34578 -39.34722 1000.72224
7590.0000 -41.73970 -39.21646 2.52324 2.31698 -39.55228 1053.11409
7595.0000 -41.03247 -38.08537 2.94710 2.40264 -38.94232 1170.70444
7600.0000 -42.38600 -39.27457 3.11143 2.47886 -38.39962 1242.96711
7605.0000 -42.80774 -39.34097 3.46677 2.37058 -39.17057 1059.03140
7610.0000 -42.55073 -40.32901 2.22172 2.25463 -39.99621 950.69387
7615.0000 -41.50187 -38.06448 3.43739 2.50938 -38.18232 1317.68433
7620.0000 -41.86339 -38.72750 3.13589 2.46964 -38.46527 1186.76255
7625.0000 -41.15218 -37.61330 3.53888 2.48324 -38.36840 1208.39667
7630.0000 -42.03093 -39.44412 2.58681 2.45663 -38.55790 1167.07399
7635.0000 -41.73718 -39.10391 2.63327 2.34044 -39.38521 1092.19923
7640.0000 -42.04052 -39.32098 2.71954 2.38574 -39.06268 1212.63073
7645.0000 -42.55600 -39.66162 2.89439 2.30856 -39.61223 1106.72295
7650.0000 -42.64689 -39.86813 2.77875 2.21344 -40.28948 912.16208
7655.0000 -42.23787 -40.17661 2.06125 2.23493 -40.13646 960.06232
7660.0000 -42.91911 -40.18595 2.73315 2.24716 -40.04938 1019.50078
7665.0000 -42.77710 -40.08610 2.69100 2.18786 -40.47165 929.45573
7670.0000 -41.80342 -38.81239 2.99103 2.28876 -39.75317 1068.35268
7675.0000 -43.04841 -40.30002 2.74839 2.23120 -40.16303 969.96751
7680.0000 -41.52126 -39.54351 1.97775 2.29366 -39.71833 960.76209
7685.0000 -43.15937 -41.52348 1.63589 2.16007 -40.66948 881.86271
7690.0000 -41.24842 -38.86854 2.37989 2.19947 -40.38900 913.03439
7695.0000 -42.33256 -39.08948 3.24308 2.34836 -39.32885 1064.63402
7700.0000 -42.26530 -39.80563 2.45968 2.35406 -39.28825 1132.79203
7705.0000 -42.22129 -39.45602 2.76527 2.26769 -39.90325 923.36420
7710.0000 -40.80886 -39.05668 1.75218 2.36470 -39.21244 980.71841
7715.0000 -42.29456 -38.95554 3.33901 2.43753 -38.69389 1094.95317
7720.0000 -41.72430 -38.87135 2.85295 2.34802 -39.33125 1099.99349
7725.0000 -41.90466 -38.79976 3.10490 2.37976 -39.10526 1111.40952
7730.0000 -42.07676 -38.83968 3.23708 2.41867 -38.82822 1165.76131
7735.0000 -41.51651 -38.00090 3.51561 2.39905 -38.96792 1167.26521
7740.0000 -41.60482 -38.93366 2.67116 2.46810 -38.47620 1203.03705
7745.0000 -41.97772 -39.29037 2.68735 2.35511 -39.28078 1126.98541
7750.0000 -42.39205 -39.16349 3.22857 2.30341 -39.64890 966.01340
MELTING PROCESS: loop number 32 T-loop= 1098.0000000000000
main_MD> interactions number 32 at Temperature= 1098.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.64494 2.30794 0.38220
force_rgl> df(natom) -3.17846 10.61754 2.17253
7755.0000 -41.24649 -38.90994 2.33655 2.46852 -38.47320 1206.13023
7760.0000 -41.74011 -39.17354 2.56658 2.42993 -38.74800 1143.67082
7765.0000 -42.09410 -39.18026 2.91384 2.37333 -39.15100 1188.91736
7770.0000 -42.33336 -39.24576 3.08760 2.33413 -39.43017 1105.46262
7775.0000 -42.30873 -39.41322 2.89551 2.34750 -39.33495 1095.76158
7780.0000 -41.36411 -38.48866 2.87545 2.38816 -39.04544 1108.95219
7785.0000 -40.74655 -38.19951 2.54704 2.46271 -38.51461 1230.31686
7790.0000 -41.66018 -38.24420 3.41599 2.47784 -38.40688 1249.44206
7795.0000 -41.10939 -38.51681 2.59258 2.49373 -38.29372 1199.18757
7800.0000 -42.96369 -40.67717 2.28652 2.31262 -39.58327 1027.06401
7805.0000 -40.25044 -38.01594 2.23450 2.37311 -39.15261 1121.31957
7810.0000 -41.12982 -38.53648 2.59334 2.53404 -38.00669 1314.12341
7815.0000 -42.07511 -39.90609 2.16902 2.31742 -39.54912 1116.74677
7820.0000 -42.80326 -38.44439 4.35888 2.33940 -39.39261 1102.38485
7825.0000 -41.60261 -39.38815 2.21446 2.33178 -39.44687 1035.16646
7830.0000 -41.37044 -38.38505 2.98539 2.38983 -39.03356 1058.54688
7835.0000 -41.14962 -37.92243 3.22719 2.54331 -37.94067 1285.72593
7840.0000 -42.30314 -40.57537 1.72776 2.41005 -38.88956 1096.56197
7845.0000 -42.02830 -38.90678 3.12152 2.31098 -39.59495 1037.97441
7850.0000 -42.11417 -39.46633 2.64783 2.53634 -37.99036 1386.35615
7855.0000 -42.23927 -39.55619 2.68308 2.31651 -39.55558 1028.84945
7860.0000 -41.78732 -39.49492 2.29240 2.35517 -39.28030 1056.27826
7865.0000 -42.31589 -40.31828 1.99761 2.23761 -40.11738 959.63621
7870.0000 -42.70658 -40.02831 2.67827 2.23632 -40.12656 951.03359
7875.0000 -40.47302 -38.30158 2.17144 2.42004 -38.81842 1160.06640
7880.0000 -41.57380 -38.83959 2.73421 2.45992 -38.53449 1188.48646
7885.0000 -41.87682 -39.06006 2.81675 2.37342 -39.15038 1114.69593
7890.0000 -41.74972 -39.14309 2.60663 2.33768 -39.40487 1020.21096
7895.0000 -41.06924 -37.65233 3.41691 2.58471 -37.64590 1275.11808
7900.0000 -41.87090 -39.50348 2.36743 2.43835 -38.68804 1129.08806
7905.0000 -41.70292 -38.95570 2.74721 2.36449 -39.21398 1127.69875
7910.0000 -42.29794 -39.38544 2.91250 2.37287 -39.15430 1128.38940
7915.0000 -42.08444 -39.09927 2.98516 2.33333 -39.43583 1082.66812
7920.0000 -40.58622 -38.07795 2.50827 2.46083 -38.52796 1197.94798
7925.0000 -42.34600 -39.80273 2.54326 2.46528 -38.49629 1157.71798
7930.0000 -42.16757 -39.80980 2.35777 2.33572 -39.41878 1051.84798
7935.0000 -42.05057 -39.13771 2.91287 2.27585 -39.84508 940.18601
7940.0000 -42.26786 -38.31195 3.95591 2.40728 -38.90931 1267.55444
7945.0000 -41.87021 -38.34960 3.52061 2.50662 -38.20195 1287.69186
7950.0000 -39.88730 -37.53198 2.35532 2.58154 -37.66850 1349.92508
7955.0000 -42.86116 -39.59232 3.26884 2.44721 -38.62499 1170.17015
7960.0000 -43.23124 -40.66258 2.56866 2.22754 -40.18909 952.25400
7965.0000 -42.06573 -39.91843 2.14730 2.27151 -39.87605 1025.82507
7970.0000 -41.43978 -38.87731 2.56247 2.30498 -39.63770 1014.11655
7975.0000 -41.27735 -39.60145 1.67590 2.40306 -38.93930 1155.96328
7980.0000 -42.58161 -40.97791 1.60370 2.24662 -40.05321 954.82712
7985.0000 -42.17880 -39.97152 2.20728 2.25064 -40.02464 968.18328
7990.0000 -43.10609 -41.01231 2.09379 2.18664 -40.48031 935.93761
7995.0000 -41.09474 -39.44623 1.64851 2.28852 -39.75492 1023.46790
8000.0000 -41.74787 -38.89722 2.85065 2.37170 -39.16259 1069.14532
MELTING PROCESS: loop number 33 T-loop= 1123.0000000000000
main_MD> interactions number 33 at Temperature= 1123.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40706 -6.02492 0.26240
force_rgl> df(natom) 0.90147 -1.96943 -3.30431
8005.0000 -41.78206 -37.66588 4.11618 2.45978 -38.53548 1223.73919
8010.0000 -41.04844 -38.79287 2.25557 2.50732 -38.19693 1229.61988
8015.0000 -40.91456 -37.75511 3.15945 2.45140 -38.59512 1223.90594
8020.0000 -40.15211 -37.31551 2.83660 2.61244 -37.44848 1331.88645
8025.0000 -41.71571 -38.30539 3.41032 2.58793 -37.62301 1301.23239
8030.0000 -41.29169 -39.08696 2.20473 2.37589 -39.13276 1146.56355
8035.0000 -41.85598 -38.12484 3.73114 2.42207 -38.80394 1190.04465
8040.0000 -41.61717 -39.30262 2.31455 2.36756 -39.19211 1098.89915
8045.0000 -42.31305 -39.61794 2.69511 2.33006 -39.45910 1058.42020
8050.0000 -41.90327 -39.91151 1.99176 2.29225 -39.72834 990.37224
8055.0000 -41.71862 -38.19026 3.52836 2.32973 -39.46147 1082.10555
8060.0000 -40.24902 -37.15332 3.09570 2.64360 -37.22661 1465.49665
8065.0000 -41.67655 -38.93373 2.74282 2.60534 -37.49901 1375.95423
8070.0000 -40.95568 -37.84782 3.10786 2.39579 -38.99108 1092.46478
8075.0000 -42.02504 -38.63660 3.38844 2.52061 -38.10236 1158.81787
8080.0000 -41.44238 -38.52059 2.92178 2.38940 -39.03659 1137.92196
8085.0000 -42.60906 -39.69387 2.91519 2.34999 -39.31723 1138.80686
8090.0000 -41.56821 -38.79343 2.77479 2.31830 -39.54289 1107.28202
8095.0000 -42.26247 -40.35833 1.90415 2.32637 -39.48542 1087.99483
8100.0000 -40.82332 -38.48135 2.34197 2.28063 -39.81111 1006.40203
8105.0000 -41.30734 -38.76680 2.54054 2.42395 -38.79061 1107.19541
8110.0000 -42.51099 -39.38112 3.12986 2.43619 -38.70346 1140.09215
8115.0000 -42.24114 -39.53981 2.70132 2.36149 -39.23534 1082.18892
8120.0000 -42.48075 -39.99600 2.48475 2.34858 -39.32722 1122.89298
8125.0000 -42.62866 -39.21232 3.41635 2.29491 -39.70943 1032.66473
8130.0000 -41.05604 -38.99846 2.05759 2.39093 -39.02567 1143.03189
8135.0000 -42.01642 -39.93246 2.08396 2.35902 -39.25289 1074.10900
8140.0000 -41.86076 -39.07584 2.78492 2.42225 -38.80267 1128.06696
8145.0000 -41.64958 -38.77458 2.87500 2.40925 -38.89523 1143.77738
8150.0000 -40.98625 -39.05774 1.92852 2.38355 -39.07823 1122.59259
8155.0000 -41.49231 -38.69994 2.79238 2.36707 -39.19556 1098.71403
8160.0000 -40.90074 -38.15321 2.74753 2.46439 -38.50266 1197.37232
8165.0000 -42.30656 -39.59990 2.70666 2.41806 -38.83252 1090.34778
8170.0000 -41.90825 -39.17504 2.73321 2.40072 -38.95601 1119.58752
8175.0000 -40.90122 -38.72656 2.17466 2.45417 -38.57538 1209.44638
8180.0000 -41.98233 -39.24172 2.74061 2.30558 -39.63339 974.31747
8185.0000 -40.76339 -37.85935 2.90404 2.43991 -38.67694 1173.89644
8190.0000 -41.89377 -39.49430 2.39947 2.49031 -38.31807 1173.01333
8195.0000 -41.67316 -38.79655 2.87660 2.40908 -38.89645 1130.01772
8200.0000 -41.36413 -38.37634 2.98779 2.46671 -38.48609 1184.81701
8205.0000 -41.93243 -38.55906 3.37337 2.52154 -38.09574 1171.53936
8210.0000 -42.18216 -39.46023 2.72193 2.42206 -38.80408 1153.45730
8215.0000 -42.17051 -39.37169 2.79882 2.28303 -39.79400 978.37559
8220.0000 -42.41569 -39.57982 2.83588 2.32485 -39.49624 1037.79025
8225.0000 -42.19910 -40.18840 2.01071 2.24050 -40.09684 954.01113
8230.0000 -43.02033 -40.49014 2.53019 2.22231 -40.22632 943.26193
8235.0000 -42.06673 -39.66929 2.39744 2.24696 -40.05085 1001.80955
8240.0000 -42.36525 -40.37701 1.98824 2.27422 -39.85674 1024.17763
8245.0000 -42.11829 -39.57771 2.54058 2.28077 -39.81011 1063.25155
8250.0000 -41.51673 -39.79780 1.71893 2.29817 -39.68620 1043.46936
MELTING PROCESS: loop number 34 T-loop= 1148.0000000000000
main_MD> interactions number 34 at Temperature= 1148.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.77580 0.40309 2.67676
force_rgl> df(natom) 2.48533 0.05142 0.87451
8255.0000 -41.26056 -38.25257 3.00799 2.31741 -39.54915 1094.25296
8260.0000 -41.07644 -38.08376 2.99268 2.50384 -38.22170 1256.25367
8265.0000 -40.62537 -37.99755 2.62782 2.57247 -37.73304 1350.61840
8270.0000 -42.86153 -39.15719 3.70434 2.47531 -38.42490 1275.49333
8275.0000 -42.17017 -38.76743 3.40274 2.38925 -39.03765 1186.05320
8280.0000 -40.96062 -38.29419 2.66643 2.48033 -38.38912 1205.78460
8285.0000 -41.02919 -38.18232 2.84686 2.47146 -38.45231 1202.85597
8290.0000 -42.01413 -38.85084 3.16328 2.51060 -38.17363 1284.82813
8295.0000 -42.04309 -39.68319 2.35990 2.38772 -39.04855 1157.88612
8300.0000 -42.04184 -39.51011 2.53173 2.25872 -39.96711 938.11733
8305.0000 -40.81747 -37.71269 3.10478 2.44026 -38.67448 1144.62520
8310.0000 -42.00573 -38.10646 3.89926 2.47341 -38.43842 1242.14249
8315.0000 -41.33205 -38.64378 2.68826 2.44795 -38.61968 1327.59112
8320.0000 -41.83805 -38.88386 2.95419 2.37705 -39.12452 1103.09463
8325.0000 -41.80704 -38.74260 3.06444 2.40190 -38.94757 1174.19485
8330.0000 -41.14757 -37.63947 3.50810 2.44655 -38.62966 1193.06414
8335.0000 -41.33896 -39.00115 2.33780 2.47410 -38.43349 1223.84893
8340.0000 -42.40191 -40.34295 2.05897 2.25077 -40.02371 1030.12270
8345.0000 -42.03648 -39.46663 2.56985 2.20983 -40.31519 981.84738
8350.0000 -41.78851 -38.67762 3.11089 2.40680 -38.91274 1223.09387
8355.0000 -41.71185 -38.25084 3.46101 2.48342 -38.36717 1293.47081
8360.0000 -41.89808 -38.33051 3.56757 2.47503 -38.42687 1231.89252
8365.0000 -40.87560 -37.97521 2.90038 2.51017 -38.17667 1268.50992
8370.0000 -41.41939 -39.04532 2.37406 2.45250 -38.58729 1205.87533
8375.0000 -42.02818 -38.80110 3.22708 2.40116 -38.95285 1081.02572
8380.0000 -41.71987 -39.62926 2.09061 2.31607 -39.55874 1010.40503
8385.0000 -42.09179 -39.80715 2.28464 2.35512 -39.28069 1000.26565
8390.0000 -41.52862 -38.78911 2.73951 2.32221 -39.51504 972.41070
8395.0000 -41.22277 -38.03387 3.18891 2.46607 -38.49069 1229.49136
8400.0000 -42.28655 -39.79559 2.49095 2.41263 -38.87117 1139.36318
8405.0000 -41.38223 -39.40922 1.97301 2.25057 -40.02510 951.20417
8410.0000 -41.50499 -38.65099 2.85400 2.35094 -39.31048 1058.34087
8415.0000 -42.33717 -39.62933 2.70784 2.37085 -39.16866 1135.71779
8420.0000 -41.39875 -38.85654 2.54221 2.44218 -38.66081 1228.42928
8425.0000 -42.42087 -39.78508 2.63579 2.34830 -39.32926 1160.22778
8430.0000 -41.30454 -38.33680 2.96774 2.37487 -39.14004 1157.49175
8435.0000 -41.64002 -38.82573 2.81429 2.48305 -38.36977 1322.74508
8440.0000 -40.99227 -37.56148 3.43079 2.45735 -38.55275 1193.37687
8445.0000 -41.40034 -38.90340 2.49695 2.54363 -37.93839 1322.57985
8450.0000 -41.20650 -38.50573 2.70077 2.40411 -38.93186 1170.57646
8455.0000 -41.45920 -38.40949 3.04971 2.44476 -38.64240 1230.39264
8460.0000 -42.09859 -38.75603 3.34257 2.47884 -38.39976 1216.80527
8465.0000 -42.75636 -39.72000 3.03636 2.36361 -39.22021 1100.41611
8470.0000 -42.53827 -40.14647 2.39180 2.34114 -39.38020 1096.81825
8475.0000 -42.81048 -40.15969 2.65078 2.23828 -40.11265 987.72801
8480.0000 -42.44045 -39.71977 2.72068 2.28053 -39.81178 1041.68422
8485.0000 -41.57955 -38.90078 2.67877 2.31088 -39.59568 1026.58256
8490.0000 -41.18229 -38.14326 3.03903 2.41677 -38.84169 1135.97683
8495.0000 -41.02756 -38.09099 2.93657 2.44817 -38.61815 1252.37971
8500.0000 -41.07078 -38.87114 2.19964 2.56478 -37.78781 1283.52457
MELTING PROCESS: loop number 35 T-loop= 1173.0000000000000
main_MD> interactions number 35 at Temperature= 1173.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.17586 0.11100 4.26353
force_rgl> df(natom) 1.64193 1.42766 1.18455
8505.0000 -42.17259 -38.69875 3.47383 2.40114 -38.95299 1125.15155
8510.0000 -41.91220 -38.89812 3.01407 2.44686 -38.62748 1247.80254
8515.0000 -41.67656 -38.39945 3.27711 2.46199 -38.51974 1195.67030
8520.0000 -42.26949 -38.96227 3.30722 2.48709 -38.34100 1195.21265
8525.0000 -42.09344 -39.57792 2.51551 2.47701 -38.41279 1218.03122
8530.0000 -42.11370 -38.86835 3.24535 2.32496 -39.49544 1046.66052
8535.0000 -42.00885 -39.88444 2.12442 2.33745 -39.40649 1093.12618
8540.0000 -42.31778 -40.45624 1.86154 2.22690 -40.19367 918.88997
8545.0000 -41.51164 -38.76305 2.74859 2.30540 -39.63474 1099.33104
8550.0000 -41.47953 -39.21871 2.26082 2.44449 -38.64436 1248.01348
8555.0000 -42.05714 -38.90208 3.15506 2.39449 -39.00032 1124.46334
8560.0000 -41.73322 -38.44472 3.28850 2.46275 -38.51434 1194.34562
8565.0000 -41.58514 -38.44068 3.14446 2.38921 -39.03792 1097.39547
8570.0000 -41.61959 -38.90110 2.71849 2.46605 -38.49084 1254.22866
8575.0000 -41.99735 -39.41172 2.58563 2.46372 -38.50743 1132.72164
8580.0000 -41.64033 -38.40808 3.23225 2.43275 -38.72789 1101.92720
8585.0000 -41.42348 -38.97180 2.45168 2.44925 -38.61042 1153.54346
8590.0000 -41.62394 -38.91005 2.71389 2.30508 -39.63701 1038.82013
8595.0000 -41.45753 -38.90987 2.54766 2.44605 -38.63320 1123.14343
8600.0000 -41.84446 -38.57619 3.26827 2.48521 -38.35439 1160.67744
8605.0000 -41.52768 -37.78966 3.73802 2.50057 -38.24503 1211.47051
8610.0000 -41.14933 -38.54189 2.60744 2.54062 -37.95982 1226.16446
8615.0000 -41.66617 -38.83230 2.83387 2.41626 -38.84531 1206.93126
8620.0000 -42.42722 -40.03870 2.38852 2.32519 -39.49379 1015.46737
8625.0000 -41.80426 -39.12148 2.68277 2.38586 -39.06177 1149.09682
8630.0000 -41.72446 -39.10595 2.61851 2.40154 -38.95012 1073.70512
8635.0000 -42.08236 -39.63848 2.44388 2.34063 -39.38382 1054.46550
8640.0000 -42.62655 -40.36953 2.25701 2.30325 -39.65004 956.93777
8645.0000 -41.82685 -38.15277 3.67408 2.45424 -38.57492 1157.22710
8650.0000 -41.28344 -37.77789 3.50555 2.57750 -37.69726 1324.23604
8655.0000 -41.36012 -38.33659 3.02353 2.51613 -38.13424 1288.13566
8660.0000 -40.85626 -38.27194 2.58432 2.39058 -39.02819 1155.78125
8665.0000 -43.20200 -40.06741 3.13458 2.34283 -39.36821 1057.76991
8670.0000 -42.41753 -40.34365 2.07389 2.12739 -40.90223 841.40025
8675.0000 -42.91834 -40.19658 2.72177 2.20998 -40.31413 951.63251
8680.0000 -41.33361 -38.36446 2.96915 2.37000 -39.17475 1149.94856
8685.0000 -41.08029 -37.84646 3.23384 2.56150 -37.81115 1350.83423
8690.0000 -40.59606 -38.18927 2.40679 2.52919 -38.04127 1347.67511
8695.0000 -40.96775 -37.95345 3.01430 2.62023 -37.39298 1413.98040
8700.0000 -41.60424 -38.57703 3.02721 2.66526 -37.07234 1388.12733
8705.0000 -41.81378 -38.48622 3.32756 2.49474 -38.28651 1331.59942
8710.0000 -41.78715 -38.45590 3.33125 2.48914 -38.32642 1295.96410
8715.0000 -40.59401 -37.54283 3.05118 2.63777 -37.26813 1351.87864
8720.0000 -41.89183 -38.65863 3.23319 2.56490 -37.78700 1372.43187
8725.0000 -41.96257 -39.46262 2.49995 2.42026 -38.81684 1199.85705
8730.0000 -42.08686 -39.39711 2.68975 2.27154 -39.87580 1008.94191
8735.0000 -41.69492 -38.74898 2.94594 2.38937 -39.03677 1083.21781
8740.0000 -41.13628 -38.37999 2.75629 2.45448 -38.57317 1191.67728
8745.0000 -41.47377 -38.91386 2.55991 2.53243 -38.01819 1267.87959
8750.0000 -40.89686 -38.34031 2.55654 2.43868 -38.68569 1156.74100
MELTING PROCESS: loop number 36 T-loop= 1198.0000000000000
main_MD> interactions number 36 at Temperature= 1198.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.66394 0.12642 -1.66441
force_rgl> df(natom) -2.10635 -0.88361 2.22329
8755.0000 -41.22350 -38.97033 2.25317 2.43180 -38.73467 1158.73316
8760.0000 -40.66028 -38.21546 2.44482 2.45133 -38.59565 1234.85876
8765.0000 -41.01428 -38.78835 2.22594 2.47096 -38.45585 1177.88659
8770.0000 -40.80290 -38.37675 2.42615 2.47958 -38.39445 1230.64710
8775.0000 -41.57677 -38.97628 2.60050 2.41436 -38.85884 1097.62073
8780.0000 -41.90235 -39.43662 2.46574 2.34503 -39.35254 1111.11127
8785.0000 -42.21338 -39.56249 2.65088 2.33717 -39.40853 1093.04672
8790.0000 -40.66854 -36.82492 3.84362 2.48502 -38.35572 1214.37307
8795.0000 -41.41404 -36.90626 4.50778 2.71341 -36.72951 1509.20262
8800.0000 -42.48417 -39.47878 3.00540 2.57268 -37.73156 1346.24592
8805.0000 -41.83184 -39.19901 2.63284 2.36732 -39.19378 1074.77497
8810.0000 -41.28625 -38.34540 2.94086 2.42952 -38.75096 1198.24517
8815.0000 -41.24348 -37.94222 3.30127 2.54676 -37.91616 1279.37093
8820.0000 -41.50259 -39.28709 2.21550 2.38098 -39.09658 1026.42055
8825.0000 -41.80074 -38.85709 2.94365 2.38441 -39.07212 1160.31039
8830.0000 -42.41971 -39.93057 2.48914 2.35008 -39.31659 1112.14512
8835.0000 -42.04116 -39.15757 2.88359 2.34522 -39.35120 1128.19727
8840.0000 -41.46022 -38.12301 3.33721 2.38414 -39.07407 1145.93680
8845.0000 -41.47097 -37.73800 3.73297 2.51044 -38.17474 1186.57916
8850.0000 -42.50670 -39.71577 2.79092 2.38931 -39.03727 1101.11989
8855.0000 -42.21071 -39.80970 2.40101 2.29282 -39.72431 1063.26753
8860.0000 -43.16305 -40.43159 2.73146 2.12617 -40.91090 886.59961
8865.0000 -42.34549 -40.24781 2.09768 2.17823 -40.54017 913.73804
8870.0000 -43.00025 -40.51580 2.48445 2.23707 -40.12126 958.95432
8875.0000 -42.59233 -40.30377 2.28856 2.23788 -40.11545 986.49393
8880.0000 -43.21643 -40.76740 2.44903 2.20046 -40.38191 892.38860
8885.0000 -42.10143 -39.34824 2.75319 2.25172 -40.01689 1025.17981
8890.0000 -41.74229 -38.79429 2.94800 2.40191 -38.94751 1163.76509
8895.0000 -42.45905 -39.01187 3.44718 2.39770 -38.97748 1144.59595
8900.0000 -41.19892 -38.36066 2.83825 2.39326 -39.00912 1140.30948
8905.0000 -41.84481 -39.74076 2.10405 2.37197 -39.16072 1021.73446
8910.0000 -43.26336 -40.08818 3.17518 2.38982 -39.03362 1136.77535
8915.0000 -41.27575 -38.98388 2.29187 2.31431 -39.57126 1004.54690
8920.0000 -42.51435 -39.99594 2.51841 2.25691 -39.97999 897.09621
8925.0000 -42.08154 -39.44701 2.63453 2.24240 -40.08331 941.26664
8930.0000 -40.83500 -37.84181 2.99319 2.44957 -38.60817 1148.07503
8935.0000 -41.81052 -39.38439 2.42613 2.42166 -38.80687 1203.16262
8940.0000 -41.71800 -39.44646 2.27154 2.31922 -39.53634 1084.24485
8945.0000 -42.49583 -40.03205 2.46377 2.32953 -39.46286 1076.93443
8950.0000 -40.90040 -38.97624 1.92416 2.33842 -39.39960 1070.66215
8955.0000 -41.44843 -38.56069 2.88775 2.48760 -38.33735 1269.54766
8960.0000 -40.93816 -38.45655 2.48161 2.51979 -38.10818 1324.03947
8965.0000 -41.21566 -37.45403 3.76163 2.48036 -38.38893 1194.11661
8970.0000 -40.97359 -38.00273 2.97086 2.62090 -37.38820 1341.02083
8975.0000 -42.15005 -38.74923 3.40083 2.45832 -38.54588 1202.43072
8980.0000 -41.38272 -37.62293 3.75979 2.54155 -37.95322 1339.60220
8985.0000 -42.19329 -38.34905 3.84424 2.56710 -37.77132 1333.90154
8990.0000 -41.20479 -37.65329 3.55150 2.60907 -37.47245 1341.34686
8995.0000 -41.94029 -39.63917 2.30112 2.45338 -38.58105 1244.87812
9000.0000 -41.39518 -38.44824 2.94694 2.48523 -38.35427 1273.19682
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 34.6441295 [s].
main_MD> Deallocating global variables
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