tmlkyza
/
nanoparticlesims
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_65/melt.log

2034 lines
201 KiB
Plaintext
Raw Blame History

main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_65.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 = 65 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: 65 6500
main_MD> Size of nv and nvoiz: 65 6500
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 = 65
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> 3.5513326782196611E-002 -3.9051436608165839E-002 4.2787517060697028E-002 initial drift of cluster / NP1 for coalescence
init> 0.27878125013967370 0.30934586434515410 0.29751268732097480 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8029644660455620E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.69942 -0.73379 -1.28260
force_rgl> df(natom) -0.18449 -0.12808 -0.37775
preparo> THERMALIZATION PROCESS AT 281.12857960670743
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -164.07077050141112 1.7608621453527975 -165.83163264676392 3.6486553170621689E-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= 307.00000000000000
main_MD> interactions number 1 at Temperature= 307.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.21140 -3.07724 -3.13158
force_rgl> df(natom) -0.18521 -0.51187 1.19882
5.0000 -165.80073 -163.37193 2.42880 1.72959 -163.78908 280.82399
10.0000 -165.36939 -162.71473 2.65466 1.77674 -163.02688 318.78338
15.0000 -165.34856 -162.77063 2.57793 1.78605 -162.87630 329.66485
20.0000 -165.98544 -163.51164 2.47380 1.78454 -162.90075 332.05995
25.0000 -165.63102 -163.46987 2.16115 1.75539 -163.37192 302.87587
30.0000 -166.02533 -163.36104 2.66429 1.75418 -163.39148 303.68359
35.0000 -166.30702 -163.52902 2.77800 1.75401 -163.39433 299.28441
40.0000 -165.58569 -163.05677 2.52892 1.74860 -163.48174 296.94361
45.0000 -166.36395 -163.50553 2.85841 1.77140 -163.11308 317.67135
50.0000 -166.19101 -163.55227 2.63874 1.75054 -163.45033 298.57781
55.0000 -165.82413 -163.10281 2.72132 1.76350 -163.24083 311.17593
60.0000 -166.40567 -163.50772 2.89795 1.75491 -163.37966 312.35555
65.0000 -166.29681 -163.70548 2.59133 1.76380 -163.23600 323.64662
70.0000 -166.60644 -163.93141 2.67503 1.72405 -163.87862 287.26230
75.0000 -166.32642 -164.27573 2.05069 1.71450 -164.03307 276.09507
80.0000 -166.14254 -163.85953 2.28301 1.71188 -164.07540 276.06947
85.0000 -166.30142 -163.73403 2.56738 1.72411 -163.87760 286.51939
90.0000 -165.67816 -162.69900 2.97916 1.75562 -163.36819 307.61340
95.0000 -165.86432 -163.46221 2.40211 1.77145 -163.11229 324.07306
100.0000 -166.13650 -163.76977 2.36673 1.72994 -163.78337 290.38442
105.0000 -166.22781 -164.06525 2.16256 1.73129 -163.76162 294.62539
110.0000 -165.87336 -163.30473 2.56863 1.71978 -163.94762 279.46417
115.0000 -166.07380 -163.59469 2.47911 1.74959 -163.46576 303.51791
120.0000 -165.93594 -163.56488 2.37106 1.74415 -163.55364 297.98093
125.0000 -165.55540 -162.62134 2.93406 1.76942 -163.14520 316.16211
130.0000 -166.15153 -163.68895 2.46258 1.77865 -162.99600 325.16448
135.0000 -165.83547 -163.40940 2.42607 1.73730 -163.66443 285.87939
140.0000 -166.02863 -163.59672 2.43191 1.75103 -163.44236 297.68024
145.0000 -165.93573 -163.63604 2.29969 1.74395 -163.55686 291.03597
150.0000 -165.51433 -162.90483 2.60950 1.77053 -163.12716 312.19431
155.0000 -165.79495 -163.16598 2.62897 1.78082 -162.96082 331.51866
160.0000 -166.17388 -163.51069 2.66320 1.77764 -163.01222 324.37085
165.0000 -166.31021 -163.70945 2.60076 1.75112 -163.44098 299.97313
170.0000 -165.93998 -163.67408 2.26590 1.74167 -163.59381 292.54092
175.0000 -165.59299 -163.44079 2.15220 1.71960 -163.95046 267.84031
180.0000 -166.03045 -163.77667 2.25378 1.73706 -163.66826 285.73292
185.0000 -165.75965 -163.29497 2.46468 1.74397 -163.55659 295.54969
190.0000 -166.12419 -163.51550 2.60869 1.76056 -163.28836 307.18289
195.0000 -166.12598 -163.67021 2.45577 1.74002 -163.62040 288.43375
200.0000 -165.75701 -163.33528 2.42173 1.75124 -163.43907 299.92078
205.0000 -165.60732 -163.06750 2.53982 1.77689 -163.02439 319.22286
210.0000 -165.38106 -162.68208 2.69898 1.79483 -162.73435 337.22566
215.0000 -165.59569 -162.72012 2.87558 1.80079 -162.63794 342.72771
220.0000 -166.03922 -163.68890 2.35032 1.76232 -163.25984 312.50202
225.0000 -166.56990 -164.24628 2.32362 1.72410 -163.87784 274.38301
230.0000 -166.08936 -163.71531 2.37405 1.72313 -163.89350 273.82906
235.0000 -165.36503 -163.01565 2.34938 1.75829 -163.32508 307.79812
240.0000 -165.81916 -163.50457 2.31460 1.75572 -163.36662 304.71743
245.0000 -165.71433 -163.14170 2.57264 1.75838 -163.32355 303.24093
250.0000 -165.61884 -162.96137 2.65746 1.78903 -162.82815 332.25482
MELTING PROCESS: loop number 2 T-loop= 332.00000000000000
main_MD> interactions number 2 at Temperature= 332.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.54227 1.33515 -3.32569
force_rgl> df(natom) -0.72627 -1.64427 -1.91230
255.0000 -166.07960 -163.41016 2.66944 1.76478 -163.22021 314.29295
260.0000 -165.18016 -162.26756 2.91261 1.78877 -162.83225 332.81281
265.0000 -164.70427 -161.98510 2.71917 1.83216 -162.13089 369.34070
270.0000 -166.10226 -163.00596 3.09630 1.81358 -162.43120 354.02334
275.0000 -166.11328 -163.05490 3.05838 1.78377 -162.91317 334.48410
280.0000 -165.68731 -162.85867 2.82864 1.78300 -162.92554 332.79385
285.0000 -165.85481 -163.53040 2.32442 1.78114 -162.95570 326.80211
290.0000 -165.76838 -163.35196 2.41642 1.75375 -163.39841 302.74432
295.0000 -165.61194 -162.43165 3.18029 1.76907 -163.15075 315.40996
300.0000 -165.83126 -161.97051 3.86074 1.82608 -162.22917 363.39780
305.0000 -165.28902 -162.19789 3.09113 1.82454 -162.25403 352.31421
310.0000 -165.77749 -163.71052 2.06697 1.77750 -163.01449 309.83795
315.0000 -165.12474 -162.07035 3.05438 1.80704 -162.53690 327.65108
320.0000 -165.01863 -162.32744 2.69119 1.82765 -162.20383 356.83171
325.0000 -165.31012 -162.55033 2.75979 1.80846 -162.51398 329.08066
330.0000 -165.27752 -163.15176 2.12577 1.78608 -162.87587 314.70144
335.0000 -165.52713 -162.82124 2.70590 1.78587 -162.87926 310.68161
340.0000 -165.45720 -163.04273 2.41446 1.78717 -162.85820 312.49163
345.0000 -165.87071 -162.99714 2.87357 1.77426 -163.06697 311.13569
350.0000 -165.83127 -163.59074 2.24053 1.77310 -163.08559 312.60284
355.0000 -165.65267 -163.09580 2.55687 1.76262 -163.25513 301.04766
360.0000 -165.71874 -163.55167 2.16707 1.77250 -163.09528 309.56973
365.0000 -165.77827 -162.79661 2.98166 1.78070 -162.96277 315.18955
370.0000 -165.25319 -162.53870 2.71449 1.78463 -162.89925 320.13624
375.0000 -165.05097 -162.15969 2.89128 1.82891 -162.18349 361.86623
380.0000 -165.51807 -162.63944 2.87864 1.81772 -162.36425 343.34207
385.0000 -165.13405 -162.23495 2.89910 1.80277 -162.60595 331.83817
390.0000 -165.42597 -162.53221 2.89376 1.80245 -162.61113 329.88113
395.0000 -166.17422 -163.48525 2.68896 1.77056 -163.12664 305.32400
400.0000 -165.10512 -162.66983 2.43529 1.77018 -163.13283 302.29793
405.0000 -164.88009 -162.20872 2.67137 1.79877 -162.67058 319.71183
410.0000 -165.56217 -162.92306 2.63911 1.81641 -162.38541 336.17248
415.0000 -165.51474 -162.24192 3.27282 1.80018 -162.64784 339.68280
420.0000 -165.67402 -163.09047 2.58355 1.79383 -162.75046 330.28404
425.0000 -165.79124 -163.23525 2.55599 1.75953 -163.30504 298.94061
430.0000 -165.93641 -163.13671 2.79970 1.76261 -163.25517 307.25487
435.0000 -165.20316 -162.32925 2.87391 1.79721 -162.69591 334.22297
440.0000 -166.09903 -163.33772 2.76131 1.79646 -162.70805 334.66686
445.0000 -165.76890 -163.45242 2.31647 1.77535 -163.04931 316.84145
450.0000 -165.68669 -162.67341 3.01328 1.78057 -162.96492 320.26716
455.0000 -165.56281 -163.09796 2.46485 1.78786 -162.84697 327.49247
460.0000 -165.60000 -162.87437 2.72563 1.77427 -163.06665 317.19304
465.0000 -165.42919 -162.52034 2.90885 1.79537 -162.72570 334.65153
470.0000 -165.59068 -162.66450 2.92619 1.79347 -162.75632 332.19965
475.0000 -165.33943 -162.73001 2.60942 1.80674 -162.54177 342.85245
480.0000 -165.72908 -162.58755 3.14153 1.81809 -162.35831 352.32618
485.0000 -165.71418 -162.77843 2.93575 1.80069 -162.63968 340.44591
490.0000 -165.21337 -162.55104 2.66232 1.79670 -162.70417 337.74839
495.0000 -165.09415 -162.30409 2.79006 1.82316 -162.27643 359.39766
500.0000 -165.53671 -162.34253 3.19418 1.81387 -162.42653 352.92673
MELTING PROCESS: loop number 3 T-loop= 357.00000000000000
main_MD> interactions number 3 at Temperature= 357.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.45136 2.12355 -3.67232
force_rgl> df(natom) 0.89552 -0.82288 -2.43625
505.0000 -165.22014 -162.32146 2.89868 1.83574 -162.07300 367.37577
510.0000 -165.51556 -162.34662 3.16894 1.81699 -162.37608 349.01585
515.0000 -165.64868 -162.32556 3.32312 1.82335 -162.27333 364.29639
520.0000 -165.38700 -162.70168 2.68533 1.81579 -162.39548 356.55997
525.0000 -165.20193 -162.40790 2.79403 1.81942 -162.33677 356.59926
530.0000 -165.81291 -162.91346 2.89945 1.80782 -162.52435 342.78363
535.0000 -165.40926 -162.28239 3.12687 1.78340 -162.91914 323.24680
540.0000 -165.51288 -161.99311 3.51977 1.83309 -162.11590 363.35395
545.0000 -164.75675 -161.51551 3.24124 1.84659 -161.89765 379.66547
550.0000 -165.09474 -161.76444 3.33030 1.85322 -161.79035 391.40768
555.0000 -164.98882 -162.00049 2.98833 1.83920 -162.01713 371.39302
560.0000 -165.40226 -161.85773 3.54453 1.85970 -161.68572 388.85758
565.0000 -164.91697 -161.91454 3.00243 1.84800 -161.87479 380.17241
570.0000 -165.37885 -162.84534 2.53351 1.81731 -162.37089 357.91287
575.0000 -165.53796 -162.24741 3.29055 1.79605 -162.71460 332.64165
580.0000 -165.07039 -162.55040 2.52000 1.80059 -162.64124 342.86701
585.0000 -165.22505 -162.02916 3.19589 1.83187 -162.13551 363.65388
590.0000 -165.32683 -162.76601 2.56082 1.81828 -162.35527 353.61866
595.0000 -165.53287 -163.20730 2.32557 1.79086 -162.79852 329.48918
600.0000 -165.22115 -162.90554 2.31561 1.79077 -162.80001 329.00511
605.0000 -165.16439 -162.29816 2.86624 1.81330 -162.43569 351.73182
610.0000 -165.01756 -162.25563 2.76192 1.84126 -161.98381 375.14825
615.0000 -165.27750 -162.23962 3.03787 1.81903 -162.34311 352.65656
620.0000 -164.63130 -161.73157 2.89973 1.84418 -161.93663 371.22735
625.0000 -165.10607 -162.19546 2.91062 1.84850 -161.86667 380.52488
630.0000 -165.37645 -162.21633 3.16011 1.82355 -162.27012 360.76295
635.0000 -165.25827 -162.02822 3.23004 1.85634 -161.74001 385.32293
640.0000 -165.05432 -161.53805 3.51627 1.83734 -162.04721 364.57369
645.0000 -164.62164 -161.97748 2.64417 1.85001 -161.84236 369.71680
650.0000 -164.58987 -161.36137 3.22850 1.82858 -162.18868 350.97099
655.0000 -164.72188 -162.18375 2.53813 1.83525 -162.08097 358.09880
660.0000 -165.63728 -163.12048 2.51680 1.81069 -162.47792 348.18357
665.0000 -165.14633 -162.14076 3.00556 1.81656 -162.38312 352.04293
670.0000 -164.89412 -162.54809 2.34603 1.82948 -162.17421 367.28287
675.0000 -165.41764 -162.75367 2.66398 1.79370 -162.75259 336.81541
680.0000 -164.85094 -162.02522 2.82572 1.82534 -162.24119 364.84336
685.0000 -165.44110 -162.53864 2.90246 1.82038 -162.32127 354.08691
690.0000 -165.46996 -162.51619 2.95378 1.79267 -162.76919 332.51743
695.0000 -165.72092 -162.71576 3.00516 1.81304 -162.43998 350.42754
700.0000 -165.06488 -161.94625 3.11862 1.84232 -161.96658 375.38957
705.0000 -165.25858 -161.89794 3.36065 1.84006 -162.00317 373.28741
710.0000 -165.76426 -162.48659 3.27767 1.83366 -162.10668 364.92805
715.0000 -165.13163 -162.44794 2.68369 1.82368 -162.26790 359.16116
720.0000 -164.98340 -161.84880 3.13460 1.83149 -162.14165 367.71872
725.0000 -165.59417 -162.02726 3.56691 1.84617 -161.90444 381.98463
730.0000 -165.37181 -162.11872 3.25308 1.82545 -162.23934 361.08149
735.0000 -164.85216 -161.79086 3.06130 1.84526 -161.91907 376.75254
740.0000 -165.46643 -162.92559 2.54084 1.82225 -162.29112 362.56840
745.0000 -165.57802 -162.68642 2.89161 1.78797 -162.84521 327.21821
750.0000 -165.21274 -161.81088 3.40186 1.81480 -162.41159 351.71349
MELTING PROCESS: loop number 4 T-loop= 382.00000000000000
main_MD> interactions number 4 at Temperature= 382.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.04171 1.54424 2.37183
force_rgl> df(natom) -0.33388 -1.52873 -2.05235
755.0000 -165.32866 -161.26389 4.06477 1.88090 -161.34289 412.59159
760.0000 -164.90510 -161.48595 3.41915 1.87472 -161.44287 398.05379
765.0000 -165.17008 -161.83989 3.33020 1.84755 -161.88200 374.17032
770.0000 -165.14951 -161.40228 3.74723 1.85725 -161.72527 391.59596
775.0000 -165.55361 -162.25064 3.30297 1.87017 -161.51631 387.38090
780.0000 -164.43242 -161.17406 3.25836 1.86164 -161.65424 386.48857
785.0000 -164.60174 -161.71719 2.88456 1.89744 -161.07559 406.64639
790.0000 -164.62686 -161.37124 3.25562 1.85526 -161.75741 370.53976
795.0000 -164.86554 -161.30831 3.55722 1.88291 -161.31050 399.14695
800.0000 -164.88420 -162.12777 2.75643 1.86261 -161.63866 379.24937
805.0000 -164.94355 -162.19328 2.75027 1.85571 -161.75015 376.79990
810.0000 -165.03349 -162.36875 2.66473 1.84624 -161.90332 370.86654
815.0000 -164.32884 -161.73075 2.59809 1.84025 -162.00002 370.03745
820.0000 -165.27178 -161.91937 3.35241 1.84310 -161.95397 377.20621
825.0000 -165.39075 -162.69174 2.69901 1.81079 -162.47627 347.06429
830.0000 -164.11310 -160.94933 3.16377 1.84895 -161.85941 375.78831
835.0000 -164.93954 -161.56619 3.37335 1.87160 -161.49329 385.86261
840.0000 -163.65651 -160.44634 3.21017 1.91164 -160.84602 419.51420
845.0000 -164.87600 -161.24909 3.62691 1.91399 -160.80801 421.34989
850.0000 -165.36058 -162.20189 3.15869 1.83771 -162.04120 368.39429
855.0000 -165.46586 -161.37732 4.08854 1.87968 -161.36272 411.38211
860.0000 -164.43854 -161.12311 3.31543 1.85366 -161.78328 391.13048
865.0000 -165.27913 -161.39393 3.88520 1.89782 -161.06937 425.05366
870.0000 -165.06968 -161.67214 3.39754 1.86900 -161.53539 407.83920
875.0000 -164.73245 -161.97717 2.75529 1.87351 -161.46246 406.57906
880.0000 -165.41505 -161.59114 3.82391 1.87763 -161.39581 409.98094
885.0000 -165.08065 -162.39832 2.68233 1.84927 -161.85427 374.48993
890.0000 -165.21817 -162.30037 2.91781 1.80946 -162.49785 342.15682
895.0000 -165.02980 -162.16340 2.86640 1.82584 -162.23306 352.83626
900.0000 -164.79420 -162.17115 2.62305 1.82043 -162.32045 348.01796
905.0000 -165.13813 -162.09505 3.04308 1.82426 -162.25854 353.86473
910.0000 -165.46394 -162.77377 2.69017 1.82029 -162.32275 353.65694
915.0000 -165.68312 -162.31124 3.37188 1.80874 -162.50943 349.04720
920.0000 -165.34641 -162.07963 3.26678 1.84824 -161.87096 378.28738
925.0000 -164.77902 -161.38420 3.39482 1.84311 -161.95379 375.98166
930.0000 -164.52168 -161.89588 2.62580 1.84376 -161.94331 359.54672
935.0000 -165.15711 -162.16578 2.99132 1.85410 -161.77622 372.66005
940.0000 -164.95280 -162.07430 2.87851 1.85019 -161.83934 359.71292
945.0000 -165.05982 -162.28870 2.77112 1.83267 -162.12266 347.52803
950.0000 -164.69816 -161.12005 3.57811 1.82739 -162.20806 340.90101
955.0000 -164.50331 -160.71173 3.79158 1.90823 -160.90104 416.19096
960.0000 -164.37577 -160.51849 3.85728 1.91681 -160.76238 423.29071
965.0000 -163.66191 -159.83487 3.82704 1.96449 -159.99166 463.71131
970.0000 -164.19031 -161.20223 2.98807 1.92323 -160.65867 425.96356
975.0000 -163.87600 -160.56314 3.31285 1.89916 -161.04769 408.70271
980.0000 -164.66340 -161.03524 3.62815 1.89878 -161.05392 400.93998
985.0000 -164.24777 -160.28238 3.96539 1.91537 -160.78575 422.17908
990.0000 -165.55407 -161.94554 3.60853 1.88535 -161.27093 405.68009
995.0000 -165.25221 -162.05158 3.20063 1.82365 -162.26851 357.66033
1000.0000 -164.55589 -161.20586 3.35003 1.88473 -161.28108 415.43264
MELTING PROCESS: loop number 5 T-loop= 407.00000000000000
main_MD> interactions number 5 at Temperature= 407.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.09303 1.03540 1.51493
force_rgl> df(natom) -1.33363 0.51998 -2.28959
1005.0000 -164.11430 -160.21035 3.90395 1.92936 -160.55951 444.98109
1010.0000 -163.98800 -160.18857 3.79943 1.94937 -160.23605 457.99608
1015.0000 -164.51821 -161.07983 3.43838 1.93102 -160.53270 450.07795
1020.0000 -164.37674 -160.62236 3.75438 1.89750 -161.07451 421.41593
1025.0000 -164.33960 -160.67365 3.66595 1.90093 -161.01918 425.12845
1030.0000 -164.84696 -161.64060 3.20636 1.90057 -161.02500 416.87539
1035.0000 -164.87506 -161.42831 3.44674 1.86304 -161.63158 392.65402
1040.0000 -164.86674 -161.75178 3.11497 1.86823 -161.54772 395.43203
1045.0000 -165.65493 -161.99137 3.66356 1.87008 -161.51782 399.75442
1050.0000 -164.86987 -161.32276 3.54711 1.87287 -161.47267 399.81354
1055.0000 -164.69221 -161.28914 3.40306 1.88199 -161.32532 414.97222
1060.0000 -164.49344 -161.60460 2.88884 1.89739 -161.07638 423.30873
1065.0000 -165.04932 -161.55694 3.49238 1.89013 -161.19374 422.62767
1070.0000 -164.73524 -161.37901 3.35624 1.87577 -161.42583 420.51033
1075.0000 -165.63416 -161.92262 3.71154 1.87879 -161.37705 412.11774
1080.0000 -164.87829 -161.16130 3.71699 1.87438 -161.44837 412.42595
1085.0000 -164.52054 -160.86114 3.65940 1.89807 -161.06527 438.99101
1090.0000 -164.50244 -160.93784 3.56460 1.94095 -160.37219 475.72838
1095.0000 -165.20925 -161.43419 3.77506 1.88999 -161.19594 420.22037
1100.0000 -164.88679 -162.22842 2.65838 1.85078 -161.82984 378.02709
1105.0000 -165.52923 -162.18165 3.34758 1.83044 -162.15871 381.91201
1110.0000 -165.43519 -162.41194 3.02325 1.81396 -162.42504 358.09701
1115.0000 -165.14943 -161.72742 3.42201 1.84687 -161.89302 386.25697
1120.0000 -165.33417 -161.85089 3.48328 1.84959 -161.84910 395.37643
1125.0000 -165.11202 -161.73856 3.37345 1.85594 -161.74651 400.33491
1130.0000 -164.72326 -160.64689 4.07637 1.87170 -161.49173 409.80686
1135.0000 -164.84839 -161.93814 2.91025 1.86860 -161.54170 402.98326
1140.0000 -164.43011 -161.42494 3.00517 1.88991 -161.19735 421.10435
1145.0000 -165.11092 -161.89188 3.21904 1.86532 -161.59485 404.13663
1150.0000 -164.71750 -161.63117 3.08634 1.84097 -161.98848 386.99268
1155.0000 -165.15822 -161.83879 3.31943 1.88187 -161.32723 408.18602
1160.0000 -164.77678 -161.56869 3.20809 1.85247 -161.80251 375.34239
1165.0000 -165.15334 -161.81331 3.34003 1.83822 -162.03286 365.58734
1170.0000 -165.36012 -162.00772 3.35239 1.85373 -161.78217 392.49354
1175.0000 -164.57952 -161.26944 3.31008 1.85841 -161.70653 398.21893
1180.0000 -165.02507 -162.05622 2.96885 1.87626 -161.41796 393.64245
1185.0000 -165.18052 -162.28962 2.89090 1.83465 -162.09062 375.67246
1190.0000 -165.34698 -162.08614 3.26084 1.81821 -162.35634 359.57914
1195.0000 -165.26441 -162.18148 3.08293 1.82857 -162.18892 369.06482
1200.0000 -165.19114 -161.59520 3.59594 1.85652 -161.73713 389.31981
1205.0000 -165.30716 -162.04922 3.25794 1.85914 -161.69468 395.39288
1210.0000 -165.02889 -161.41538 3.61351 1.86382 -161.61904 399.03675
1215.0000 -164.31937 -161.26230 3.05707 1.86546 -161.59256 395.82479
1220.0000 -164.53956 -161.07304 3.46653 1.90415 -160.96705 436.00274
1225.0000 -164.91871 -161.71345 3.20525 1.88311 -161.30720 420.65137
1230.0000 -165.10625 -161.67113 3.43511 1.86278 -161.63584 395.88678
1235.0000 -164.42149 -161.09445 3.32704 1.86083 -161.66735 392.97783
1240.0000 -165.14658 -161.88455 3.26204 1.84793 -161.87591 387.74665
1245.0000 -165.56302 -162.10977 3.45325 1.83315 -162.11483 377.17257
1250.0000 -165.71856 -162.57605 3.14251 1.82901 -162.18187 369.45290
MELTING PROCESS: loop number 6 T-loop= 432.00000000000000
main_MD> interactions number 6 at Temperature= 432.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.21318 0.24679 -3.25854
force_rgl> df(natom) -1.42017 0.21281 -0.69812
1255.0000 -164.91496 -161.81161 3.10335 1.84613 -161.90504 382.01476
1260.0000 -164.67243 -160.79110 3.88133 1.88996 -161.19640 425.44359
1265.0000 -164.54824 -161.15060 3.39764 1.89104 -161.17905 428.04746
1270.0000 -164.03201 -160.10351 3.92850 1.91641 -160.76886 446.69641
1275.0000 -164.79055 -161.56913 3.22142 1.93001 -160.54900 453.68010
1280.0000 -165.40289 -161.85567 3.54722 1.86009 -161.67937 397.75640
1285.0000 -164.88296 -161.54559 3.33737 1.84236 -161.96592 384.75515
1290.0000 -164.58840 -160.93485 3.65355 1.91977 -160.71460 444.60802
1295.0000 -163.60018 -160.29989 3.30029 1.90812 -160.90283 418.50054
1300.0000 -164.25457 -160.75520 3.49936 1.94089 -160.37318 454.07648
1305.0000 -164.33000 -160.42177 3.90823 1.93728 -160.43143 443.58602
1310.0000 -163.17367 -160.10662 3.06705 1.93269 -160.50568 449.79382
1315.0000 -163.22974 -158.67589 4.55385 2.00147 -159.39370 505.38850
1320.0000 -164.68293 -160.29319 4.38974 1.98840 -159.60508 509.42696
1325.0000 -164.23124 -160.34896 3.88229 1.93736 -160.43020 467.73955
1330.0000 -164.89834 -160.93318 3.96516 1.92230 -160.67358 444.64998
1335.0000 -164.30971 -160.69841 3.61130 1.92210 -160.67688 437.14854
1340.0000 -164.34270 -159.99410 4.34860 1.93201 -160.51668 448.56341
1345.0000 -164.20757 -160.84345 3.36412 1.93895 -160.40451 442.13058
1350.0000 -164.48706 -160.13947 4.34758 1.93095 -160.53373 434.79970
1355.0000 -164.06534 -160.19923 3.86611 1.93955 -160.39486 453.55954
1360.0000 -164.03236 -160.98724 3.04512 1.94253 -160.34660 453.84810
1365.0000 -164.07228 -160.52872 3.54355 1.90478 -160.95692 435.69785
1370.0000 -165.01315 -161.02666 3.98649 1.90944 -160.88149 438.99688
1375.0000 -165.10689 -161.38722 3.71968 1.87430 -161.44964 415.38079
1380.0000 -164.39806 -160.47567 3.92239 1.91110 -160.85466 439.68339
1385.0000 -164.93667 -161.27614 3.66052 1.89012 -161.19380 427.38298
1390.0000 -164.74907 -161.39419 3.35488 1.85926 -161.69280 392.49938
1395.0000 -165.31852 -161.69838 3.62015 1.86041 -161.67412 397.91667
1400.0000 -164.38008 -161.43641 2.94367 1.85966 -161.68622 403.16516
1405.0000 -164.47455 -161.19213 3.28242 1.86587 -161.58590 399.82517
1410.0000 -164.75339 -161.34921 3.40418 1.89546 -161.10748 429.79950
1415.0000 -164.92955 -161.13233 3.79722 1.86681 -161.57072 396.38320
1420.0000 -164.19532 -160.96127 3.23405 1.92043 -160.70383 451.86010
1425.0000 -164.74896 -160.45975 4.28921 1.90204 -161.00124 437.56403
1430.0000 -165.07752 -160.81351 4.26401 1.90849 -160.89696 432.54401
1435.0000 -164.90687 -160.84098 4.06590 1.92013 -160.70870 459.15337
1440.0000 -164.41551 -160.67272 3.74280 1.88683 -161.24705 428.20507
1445.0000 -164.69902 -161.72916 2.96986 1.90531 -160.94836 433.96637
1450.0000 -164.76977 -161.56976 3.20001 1.87462 -161.44444 402.27703
1455.0000 -164.99994 -161.20740 3.79253 1.87850 -161.38171 412.76027
1460.0000 -165.14092 -162.07615 3.06477 1.85866 -161.70245 393.15228
1465.0000 -165.17148 -160.72172 4.44976 1.89968 -161.03925 428.89108
1470.0000 -164.86667 -161.51583 3.35084 1.88916 -161.20934 421.17097
1475.0000 -165.14097 -161.41295 3.72803 1.89712 -161.08066 430.16836
1480.0000 -164.99133 -161.31345 3.67788 1.86093 -161.66569 399.21640
1485.0000 -164.89728 -161.08843 3.80885 1.90117 -161.01532 439.34368
1490.0000 -165.16848 -161.88861 3.27987 1.87565 -161.42775 412.52466
1495.0000 -163.89893 -160.40299 3.49593 1.87073 -161.50737 405.39895
1500.0000 -164.38599 -160.85819 3.52781 1.94980 -160.22915 469.76828
MELTING PROCESS: loop number 7 T-loop= 457.00000000000000
main_MD> interactions number 7 at Temperature= 457.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.83155 0.59149 -2.44641
force_rgl> df(natom) 0.25878 0.17810 -0.13257
1505.0000 -164.01594 -160.67363 3.34232 1.92837 -160.57549 451.31700
1510.0000 -164.64351 -161.24044 3.40307 1.88490 -161.27829 405.87404
1515.0000 -164.95834 -161.23212 3.72622 1.90385 -160.97185 416.17359
1520.0000 -164.34178 -160.53125 3.81053 1.90821 -160.90137 422.55800
1525.0000 -163.21711 -160.02184 3.19527 1.97723 -159.78571 457.45977
1530.0000 -164.02039 -160.63283 3.38755 1.93866 -160.40913 419.65766
1535.0000 -163.26544 -159.47791 3.78754 1.93364 -160.49040 398.50645
1540.0000 -163.27676 -160.38722 2.88954 1.97691 -159.79074 463.28258
1545.0000 -163.38155 -159.28180 4.09975 1.98012 -159.73893 477.22701
1550.0000 -164.06338 -160.45419 3.60919 1.95055 -160.21692 457.30929
1555.0000 -163.76731 -158.97235 4.79496 1.95936 -160.07458 453.49708
1560.0000 -162.57955 -158.30661 4.27294 2.05136 -158.58715 519.21204
1565.0000 -164.38727 -160.24353 4.14374 2.03004 -158.93190 505.88582
1570.0000 -164.59357 -161.08902 3.50455 1.94265 -160.34467 446.35609
1575.0000 -164.00377 -160.87975 3.12402 1.88312 -161.30696 406.68154
1580.0000 -165.20148 -161.83528 3.36620 1.87102 -161.50262 399.45850
1585.0000 -164.63977 -161.47145 3.16832 1.86519 -161.59683 392.01151
1590.0000 -164.45528 -160.58432 3.87096 1.91630 -160.77059 433.06203
1595.0000 -163.54246 -159.87481 3.66765 1.95428 -160.15672 463.42177
1600.0000 -163.92498 -160.51747 3.40751 1.93980 -160.39071 448.54044
1605.0000 -164.49466 -161.22331 3.27135 1.89615 -161.09633 400.52493
1610.0000 -162.81375 -159.65813 3.15562 1.94921 -160.23862 424.72725
1615.0000 -163.87087 -159.75906 4.11181 1.96591 -159.96861 445.43570
1620.0000 -163.84180 -160.29853 3.54327 1.95232 -160.18838 425.94219
1625.0000 -163.89190 -160.50360 3.38831 1.96172 -160.03640 454.87485
1630.0000 -164.10903 -160.53780 3.57123 1.93944 -160.39663 439.15557
1635.0000 -164.18324 -160.34489 3.83835 1.94872 -160.24657 439.79405
1640.0000 -164.19304 -160.85979 3.33325 1.91382 -160.81070 423.56269
1645.0000 -163.95075 -160.13858 3.81218 1.94511 -160.30491 425.87130
1650.0000 -165.11151 -161.81300 3.29850 1.88715 -161.24197 396.38396
1655.0000 -164.99026 -161.85186 3.13840 1.85849 -161.70516 375.46787
1660.0000 -164.70979 -160.94005 3.76974 1.87912 -161.37170 396.91587
1665.0000 -164.13349 -160.15427 3.97922 1.94160 -160.36158 449.92927
1670.0000 -163.85574 -160.73963 3.11611 1.92873 -160.56974 437.55119
1675.0000 -164.00469 -160.33427 3.67042 1.90939 -160.88243 411.68842
1680.0000 -164.86315 -160.75139 4.11176 1.93499 -160.46846 441.94111
1685.0000 -164.89570 -160.90349 3.99221 1.92697 -160.59808 428.37169
1690.0000 -164.73029 -160.58503 4.14526 1.93203 -160.51627 454.48170
1695.0000 -164.36161 -160.36379 3.99782 1.93417 -160.48173 450.07913
1700.0000 -164.82998 -160.77369 4.05629 1.94077 -160.37509 452.82344
1705.0000 -164.11054 -160.09412 4.01642 1.96222 -160.02827 467.44402
1710.0000 -164.56672 -160.95780 3.60893 1.94265 -160.34465 450.58676
1715.0000 -164.42623 -160.24589 4.18034 1.89383 -161.13397 412.48011
1720.0000 -163.63602 -159.27175 4.36427 1.96799 -159.93493 474.88477
1725.0000 -164.25664 -159.96546 4.29119 1.98694 -159.62871 496.51191
1730.0000 -164.55248 -160.87041 3.68206 1.93396 -160.48520 454.75356
1735.0000 -163.79711 -159.93644 3.86067 1.95183 -160.19633 465.90941
1740.0000 -164.23564 -160.30638 3.92926 1.98560 -159.65026 493.95642
1745.0000 -164.23492 -160.26267 3.97225 1.93835 -160.41410 450.48898
1750.0000 -163.76393 -159.05956 4.70437 1.99617 -159.47947 479.25359
MELTING PROCESS: loop number 8 T-loop= 482.00000000000000
main_MD> interactions number 8 at Temperature= 482.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.81058 2.11516 3.28242
force_rgl> df(natom) -1.84003 0.03580 2.83765
1755.0000 -162.50673 -158.44083 4.06590 2.03622 -158.83192 497.18078
1760.0000 -162.85384 -158.85453 3.99930 2.03595 -158.83629 497.65430
1765.0000 -163.74955 -159.64084 4.10871 2.01327 -159.20307 491.34608
1770.0000 -163.60283 -159.86542 3.73741 1.98116 -159.72203 458.41129
1775.0000 -163.80400 -159.87356 3.93044 1.97365 -159.84357 445.42440
1780.0000 -164.82200 -160.94203 3.87997 1.95400 -160.16113 456.38622
1785.0000 -163.38862 -159.82554 3.56308 1.96993 -159.90370 474.42096
1790.0000 -164.18541 -159.83940 4.34601 1.98199 -159.70875 473.60789
1795.0000 -163.51468 -158.68518 4.82950 2.00556 -159.32767 490.31127
1800.0000 -162.64948 -159.02981 3.61967 2.02397 -159.02997 502.06592
1805.0000 -164.15512 -159.34849 4.80663 1.98747 -159.62007 479.18088
1810.0000 -163.22487 -158.79587 4.42900 2.03248 -158.89243 511.84052
1815.0000 -163.53885 -160.04194 3.49690 2.01463 -159.18101 493.16698
1820.0000 -163.43779 -159.95772 3.48006 1.98242 -159.70167 463.15505
1825.0000 -164.00738 -160.81324 3.19414 2.00124 -159.39745 474.06157
1830.0000 -163.35019 -160.24542 3.10478 1.91993 -160.71192 408.84985
1835.0000 -162.73983 -158.36050 4.37933 1.99267 -159.53606 478.56089
1840.0000 -163.40077 -158.95021 4.45056 2.02557 -159.00415 507.14098
1845.0000 -163.73779 -159.36959 4.36820 2.03277 -158.88776 511.71364
1850.0000 -164.21593 -159.41436 4.80157 2.02707 -158.97998 519.99310
1855.0000 -163.53600 -159.60690 3.92910 2.02865 -158.95432 495.88166
1860.0000 -163.59058 -159.89407 3.69651 1.98290 -159.69398 453.61795
1865.0000 -163.78313 -160.39135 3.39177 1.96688 -159.95295 460.76125
1870.0000 -163.55301 -159.79704 3.75597 1.92127 -160.69036 410.89178
1875.0000 -163.97057 -160.50875 3.46182 1.97837 -159.76728 460.96891
1880.0000 -164.11656 -160.35584 3.76072 1.93367 -160.48985 442.06746
1885.0000 -163.42580 -159.23801 4.18779 1.99331 -159.52570 504.21531
1890.0000 -163.23965 -158.69578 4.54387 2.02374 -159.03374 514.74079
1895.0000 -163.32796 -158.97199 4.35598 2.04343 -158.71542 535.96064
1900.0000 -163.21158 -159.45239 3.75919 1.99858 -159.44055 472.51907
1905.0000 -162.62429 -159.16801 3.45629 1.99594 -159.48321 459.14123
1910.0000 -162.84526 -158.51185 4.33341 2.01925 -159.10627 481.47935
1915.0000 -162.25529 -158.18087 4.07442 2.04431 -158.70117 501.76049
1920.0000 -163.13633 -159.13699 3.99934 2.06505 -158.36585 518.06812
1925.0000 -163.53535 -159.46384 4.07151 2.00854 -159.27947 481.28818
1930.0000 -163.36606 -159.31275 4.05331 2.00733 -159.29908 492.06174
1935.0000 -163.41292 -159.23001 4.18291 2.02011 -159.09242 508.53841
1940.0000 -163.75083 -160.16590 3.58493 1.98071 -159.72935 494.24812
1945.0000 -164.74494 -160.91523 3.82971 1.94519 -160.30368 460.67327
1950.0000 -163.71329 -159.95657 3.75672 1.94363 -160.32877 472.61455
1955.0000 -164.61534 -160.36204 4.25330 1.96094 -160.04903 466.03451
1960.0000 -164.09329 -159.97785 4.11544 1.96055 -160.05523 470.50846
1965.0000 -163.56335 -160.51435 3.04900 1.96436 -159.99364 474.59414
1970.0000 -164.12120 -160.90006 3.22114 1.91870 -160.73186 437.02493
1975.0000 -164.34690 -159.61123 4.73567 1.96879 -159.92214 490.20102
1980.0000 -163.71896 -159.31166 4.40730 1.99174 -159.55107 492.11099
1985.0000 -163.68620 -159.57494 4.11126 2.01022 -159.25233 509.43384
1990.0000 -163.92349 -159.87971 4.04378 1.98214 -159.70627 481.69550
1995.0000 -163.64016 -159.61027 4.02989 1.95639 -160.12252 474.72889
2000.0000 -164.09214 -160.32144 3.77070 1.94189 -160.35695 462.98735
MELTING PROCESS: loop number 9 T-loop= 507.00000000000000
main_MD> interactions number 9 at Temperature= 507.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.98857 -2.77674 -1.50279
force_rgl> df(natom) -0.86786 -0.62178 0.34735
2005.0000 -164.03313 -160.32727 3.70586 1.96236 -160.02608 471.74153
2010.0000 -163.70255 -160.19825 3.50430 1.94611 -160.28866 456.88726
2015.0000 -163.76790 -160.00244 3.76546 1.96072 -160.05246 471.17191
2020.0000 -163.70084 -159.01920 4.68163 2.01745 -159.13535 515.63781
2025.0000 -162.88406 -157.41758 5.46648 2.05842 -158.47315 539.62692
2030.0000 -162.87686 -158.83174 4.04513 2.05374 -158.54869 518.43946
2035.0000 -163.51533 -159.13428 4.38105 2.02558 -159.00404 527.35795
2040.0000 -163.75682 -159.64535 4.11147 1.98536 -159.65419 494.50047
2045.0000 -164.49901 -159.90464 4.59437 1.97301 -159.85383 462.47206
2050.0000 -163.77227 -159.38674 4.38553 2.01423 -159.18749 498.25279
2055.0000 -162.48827 -158.84293 3.64534 2.03703 -158.81893 523.69601
2060.0000 -162.90062 -159.14521 3.75541 2.02067 -159.08339 510.52676
2065.0000 -163.98596 -160.26777 3.71819 1.99379 -159.51798 501.11845
2070.0000 -164.14584 -160.03026 4.11558 1.94359 -160.32953 470.48505
2075.0000 -163.89457 -159.58135 4.31322 1.94944 -160.23490 473.50946
2080.0000 -164.58507 -160.40841 4.17665 1.95265 -160.18294 474.18742
2085.0000 -164.14684 -159.68230 4.46453 1.95890 -160.08192 481.06016
2090.0000 -163.68562 -159.69911 3.98651 1.98244 -159.70144 492.08929
2095.0000 -163.51166 -159.62251 3.88915 1.98273 -159.69678 493.93051
2100.0000 -164.44576 -160.13494 4.31082 1.98040 -159.73442 495.27288
2105.0000 -164.10411 -160.20151 3.90260 1.97329 -159.84940 495.76727
2110.0000 -163.59378 -159.77587 3.81791 1.95511 -160.14317 476.58295
2115.0000 -163.96552 -160.70333 3.26219 1.97882 -159.75997 496.55928
2120.0000 -164.46737 -160.53148 3.93588 1.91839 -160.73684 442.53653
2125.0000 -163.45367 -159.53975 3.91392 1.94959 -160.23243 467.78991
2130.0000 -164.04637 -159.76657 4.27980 1.98490 -159.66158 500.31014
2135.0000 -164.05407 -160.16538 3.88869 1.96630 -159.96239 496.98766
2140.0000 -163.70816 -159.72028 3.98788 1.94642 -160.28364 477.48026
2145.0000 -163.53047 -159.65227 3.87820 1.98783 -159.61425 494.96867
2150.0000 -163.48112 -159.37172 4.10941 1.98903 -159.59482 496.87344
2155.0000 -163.62961 -159.61693 4.01268 1.99190 -159.54845 503.02243
2160.0000 -164.29778 -160.36660 3.93118 1.96682 -159.95395 481.51674
2165.0000 -164.47874 -159.77771 4.70102 1.94924 -160.23811 476.29241
2170.0000 -163.61561 -159.38730 4.22831 1.99469 -159.50331 511.04597
2175.0000 -163.67510 -159.46013 4.21497 1.99757 -159.45686 507.04086
2180.0000 -164.37234 -159.85112 4.52121 2.01225 -159.21943 519.41889
2185.0000 -164.28720 -159.43773 4.84947 1.97484 -159.82429 491.75296
2190.0000 -164.09355 -160.39686 3.69669 1.97478 -159.82524 492.48038
2195.0000 -163.29143 -159.46277 3.82866 1.97297 -159.85450 482.91673
2200.0000 -163.23725 -159.29604 3.94120 2.02446 -159.02205 503.82257
2205.0000 -163.74309 -159.65477 4.08832 1.98206 -159.70761 470.47373
2210.0000 -163.76943 -159.55185 4.21758 1.98630 -159.63905 465.70286
2215.0000 -163.01279 -158.43628 4.57651 2.06762 -158.32440 534.25024
2220.0000 -162.76751 -159.21514 3.55236 2.02759 -158.97156 490.08254
2225.0000 -162.25988 -158.08821 4.17167 2.05192 -158.57820 500.24535
2230.0000 -161.56300 -157.34713 4.21587 2.09463 -157.88776 526.87485
2235.0000 -161.44225 -156.92415 4.51810 2.14393 -157.09078 568.12231
2240.0000 -162.52102 -158.34138 4.17964 2.09840 -157.82673 517.62764
2245.0000 -161.49854 -157.02687 4.47167 2.08831 -157.98990 513.74640
2250.0000 -162.05379 -157.90833 4.14546 2.13095 -157.30057 553.82074
MELTING PROCESS: loop number 10 T-loop= 532.00000000000000
main_MD> interactions number 10 at Temperature= 532.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.05749 1.55369 -0.88858
force_rgl> df(natom) 1.45959 -3.29737 2.26426
2255.0000 -162.97258 -158.42118 4.55140 2.08920 -157.97551 537.42697
2260.0000 -162.83284 -158.77947 4.05337 2.05697 -158.49657 506.28335
2265.0000 -163.21389 -158.41051 4.80338 2.05166 -158.58240 529.06596
2270.0000 -163.12741 -158.61498 4.51242 2.03902 -158.78679 534.60106
2275.0000 -162.24493 -157.67209 4.57285 2.07440 -158.21479 540.21955
2280.0000 -162.45802 -157.82057 4.63745 2.07740 -158.16626 534.66963
2285.0000 -162.82927 -157.89844 4.93083 2.10047 -157.79323 551.67427
2290.0000 -162.84846 -158.68128 4.16718 2.04758 -158.64831 517.10448
2295.0000 -162.99604 -158.04605 4.94999 2.05792 -158.48125 537.93135
2300.0000 -161.87695 -157.62379 4.25317 2.09453 -157.88938 557.21505
2305.0000 -162.63447 -158.64940 3.98507 2.09614 -157.86327 559.02371
2310.0000 -162.78198 -157.97478 4.80719 2.06034 -158.44202 517.67150
2315.0000 -162.17301 -157.34484 4.82818 2.09801 -157.83312 537.05257
2320.0000 -162.86380 -158.08373 4.78008 2.09909 -157.81558 554.49464
2325.0000 -163.42743 -159.28929 4.13814 2.03970 -158.77569 505.32310
2330.0000 -163.13077 -158.93503 4.19573 2.00515 -159.33424 484.86769
2335.0000 -162.33942 -157.25285 5.08658 2.06831 -158.31322 528.76314
2340.0000 -163.91731 -158.65862 5.25869 2.09620 -157.86227 567.08942
2345.0000 -162.66783 -158.53263 4.13520 2.05347 -158.55306 519.99680
2350.0000 -163.04547 -158.25501 4.79046 2.07153 -158.26116 523.90043
2355.0000 -163.72153 -159.24086 4.48067 2.06548 -158.35891 512.31688
2360.0000 -162.88073 -158.81516 4.06557 2.02850 -158.95677 503.86959
2365.0000 -161.89493 -158.05038 3.84455 2.05920 -158.46052 501.20700
2370.0000 -162.17360 -157.82581 4.34779 2.07101 -158.26955 493.71806
2375.0000 -162.44919 -157.97578 4.47342 2.14349 -157.09784 574.84232
2380.0000 -163.15065 -159.02717 4.12348 2.04621 -158.67045 497.91396
2385.0000 -162.62275 -158.12207 4.50069 2.07184 -158.25619 518.25582
2390.0000 -162.40735 -157.63827 4.76907 2.08491 -158.04488 553.13420
2395.0000 -162.38920 -157.61714 4.77207 2.08508 -158.04211 545.82308
2400.0000 -162.32851 -157.75195 4.57656 2.11720 -157.52277 558.61053
2405.0000 -162.79332 -158.55363 4.23970 2.08481 -158.04649 551.68168
2410.0000 -162.80823 -158.64604 4.16219 2.03962 -158.77710 520.38295
2415.0000 -162.88008 -158.29741 4.58267 2.07604 -158.18818 554.71919
2420.0000 -162.53394 -158.12179 4.41215 2.07038 -158.27978 539.88671
2425.0000 -163.54368 -158.54894 4.99474 2.06722 -158.33078 515.94475
2430.0000 -162.13013 -157.83221 4.29792 2.07348 -158.22967 533.09932
2435.0000 -162.32930 -158.40597 3.92333 2.11165 -157.61261 525.65633
2440.0000 -162.21437 -158.14982 4.06455 2.05835 -158.47428 499.85132
2445.0000 -163.56195 -159.42927 4.13267 2.05338 -158.55465 502.87464
2450.0000 -163.25929 -158.67287 4.58642 2.02073 -159.08244 463.86515
2455.0000 -162.63069 -158.40022 4.23047 2.08430 -158.05465 543.01508
2460.0000 -162.74177 -158.03664 4.70513 2.06870 -158.30696 525.55159
2465.0000 -162.70851 -158.02095 4.68756 2.08021 -158.12086 561.28503
2470.0000 -163.41842 -158.40437 5.01406 2.07868 -158.14556 561.94904
2475.0000 -163.35290 -158.50118 4.85173 2.03433 -158.86256 536.88873
2480.0000 -162.60035 -158.10006 4.50030 2.08520 -158.04018 573.60627
2485.0000 -163.51931 -158.82958 4.68973 2.04085 -158.75713 519.73175
2490.0000 -163.62883 -159.10452 4.52431 2.04454 -158.69754 518.64441
2495.0000 -162.81401 -158.59800 4.21602 2.02892 -158.94999 498.11098
2500.0000 -162.82864 -158.84392 3.98473 2.03850 -158.79512 503.49412
MELTING PROCESS: loop number 11 T-loop= 557.00000000000000
main_MD> interactions number 11 at Temperature= 557.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.24322 2.32659 -0.11570
force_rgl> df(natom) 0.09587 4.25483 -0.39492
2505.0000 -163.34284 -158.80319 4.53966 2.02767 -158.97022 517.13482
2510.0000 -163.92953 -159.51870 4.41082 2.02157 -159.06886 526.96102
2515.0000 -162.59190 -158.51425 4.07765 2.01694 -159.14375 513.27933
2520.0000 -162.06541 -157.57299 4.49242 2.09079 -157.94972 550.33276
2525.0000 -162.38254 -156.94466 5.43788 2.14590 -157.05894 588.85378
2530.0000 -161.85075 -157.65388 4.19687 2.13067 -157.30513 584.50584
2535.0000 -161.09105 -157.18243 3.90862 2.13454 -157.24252 565.98803
2540.0000 -162.46877 -157.26489 5.20388 2.14103 -157.13757 577.16741
2545.0000 -162.42608 -156.63417 5.79190 2.16511 -156.74832 569.65182
2550.0000 -161.91215 -157.08319 4.82896 2.15014 -156.99031 552.95581
2555.0000 -161.28422 -157.08217 4.20206 2.13922 -157.16689 565.46045
2560.0000 -161.58932 -157.37553 4.21379 2.13191 -157.28512 543.01772
2565.0000 -162.12424 -156.92010 5.20414 2.14373 -157.09395 556.00270
2570.0000 -162.64988 -157.66520 4.98469 2.13475 -157.23912 576.88307
2575.0000 -162.16723 -157.95258 4.21465 2.09032 -157.95745 549.90921
2580.0000 -162.85926 -157.90962 4.94964 2.08210 -158.09029 561.18746
2585.0000 -163.42475 -158.31724 5.10751 2.06494 -158.36777 530.20856
2590.0000 -162.61148 -158.15801 4.45348 2.06915 -158.29967 535.04134
2595.0000 -162.83169 -157.26426 5.56743 2.09948 -157.80929 535.60891
2600.0000 -162.06267 -156.90882 5.15385 2.15502 -156.91145 578.23217
2605.0000 -161.65050 -157.35619 4.29432 2.14144 -157.13094 586.29429
2610.0000 -161.48640 -156.70587 4.78053 2.14910 -157.00720 584.65097
2615.0000 -161.76966 -156.65543 5.11423 2.13431 -157.24622 581.68393
2620.0000 -161.32556 -157.23130 4.09426 2.16081 -156.81777 574.60096
2625.0000 -162.77803 -158.25971 4.51833 2.13211 -157.28174 569.12717
2630.0000 -162.82835 -157.28113 5.54722 2.11879 -157.49715 555.62194
2635.0000 -162.18319 -158.04060 4.14259 2.13354 -157.25874 570.84504
2640.0000 -161.27623 -157.08956 4.18667 2.10577 -157.70768 531.06410
2645.0000 -161.93349 -157.51896 4.41453 2.12825 -157.34425 562.98479
2650.0000 -162.84059 -157.59090 5.24969 2.13227 -157.27926 583.55451
2655.0000 -161.42166 -156.82165 4.60001 2.13135 -157.29416 575.29183
2660.0000 -161.46313 -156.56273 4.90040 2.15977 -156.83467 585.41183
2665.0000 -161.07466 -156.95994 4.11472 2.16255 -156.78976 565.43480
2670.0000 -161.99813 -157.57287 4.42526 2.13731 -157.19782 543.03692
2675.0000 -161.49626 -156.60301 4.89325 2.14243 -157.11500 561.69275
2680.0000 -161.97795 -156.10815 5.86980 2.15693 -156.88049 586.18963
2685.0000 -161.91367 -157.12507 4.78860 2.18643 -156.40359 613.06498
2690.0000 -162.26822 -158.40038 3.86785 2.09420 -157.89469 541.12210
2695.0000 -162.29526 -157.77091 4.52435 2.07555 -158.19622 504.75527
2700.0000 -162.39419 -157.45661 4.93758 2.10933 -157.65003 554.80412
2705.0000 -162.27759 -157.29969 4.97790 2.10018 -157.79802 549.15519
2710.0000 -161.59305 -156.17630 5.41675 2.14731 -157.03608 581.20385
2715.0000 -161.24597 -157.27682 3.96915 2.11790 -157.51151 540.91795
2720.0000 -161.74631 -157.58363 4.16268 2.09781 -157.83627 534.99815
2725.0000 -162.22812 -157.81898 4.40914 2.08275 -158.07981 510.62507
2730.0000 -162.37675 -158.49384 3.88290 2.07492 -158.20632 514.07327
2735.0000 -162.17573 -157.37951 4.79622 2.09505 -157.88099 544.80147
2740.0000 -162.02995 -157.53294 4.49701 2.11503 -157.55797 533.85112
2745.0000 -162.42868 -157.94375 4.48493 2.08938 -157.97259 536.03483
2750.0000 -162.03155 -157.24478 4.78677 2.11127 -157.61874 544.43228
MELTING PROCESS: loop number 12 T-loop= 582.00000000000000
main_MD> interactions number 12 at Temperature= 582.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.09721 1.75631 1.89152
force_rgl> df(natom) -1.00571 0.04365 2.08616
2755.0000 -160.60153 -155.99578 4.60575 2.18560 -156.41709 587.87548
2760.0000 -161.23815 -155.59454 5.64361 2.21661 -155.91584 619.67518
2765.0000 -162.10628 -156.90761 5.19866 2.18875 -156.36610 610.06906
2770.0000 -161.56436 -156.14313 5.42123 2.15414 -156.92573 574.46573
2775.0000 -162.29194 -156.63087 5.66108 2.20524 -156.09951 621.26995
2780.0000 -161.62098 -156.22676 5.39421 2.17584 -156.57482 597.08064
2785.0000 -161.76512 -156.87615 4.88897 2.18469 -156.43183 603.56204
2790.0000 -161.12134 -155.99956 5.12177 2.18644 -156.40345 607.76937
2795.0000 -161.63268 -156.88468 4.74800 2.15739 -156.87313 565.98201
2800.0000 -161.86972 -156.26491 5.60481 2.14953 -157.00024 591.03492
2805.0000 -161.57826 -156.22343 5.35483 2.17999 -156.50772 607.23772
2810.0000 -162.05195 -157.75106 4.30089 2.16954 -156.67671 606.03104
2815.0000 -162.75274 -158.19227 4.56048 2.09326 -157.90987 533.09420
2820.0000 -162.08997 -157.91755 4.17242 2.07837 -158.15054 534.24094
2825.0000 -161.53537 -157.16468 4.37069 2.13665 -157.20840 556.49561
2830.0000 -161.47157 -157.48948 3.98208 2.12514 -157.39453 520.95910
2835.0000 -161.21903 -155.52555 5.69347 2.19062 -156.33591 570.46023
2840.0000 -160.71450 -155.44942 5.26508 2.20174 -156.15615 603.13039
2845.0000 -162.29202 -156.91189 5.38013 2.16324 -156.77857 584.00996
2850.0000 -162.21569 -156.97203 5.24366 2.16459 -156.75679 593.19495
2855.0000 -160.97100 -156.10558 4.86542 2.17644 -156.56519 588.53418
2860.0000 -161.93712 -156.65116 5.28595 2.16885 -156.68778 587.23790
2865.0000 -162.58322 -157.56177 5.02145 2.15410 -156.92639 590.84009
2870.0000 -161.90285 -157.32017 4.58269 2.10061 -157.79102 548.81103
2875.0000 -162.59851 -157.38199 5.21652 2.11969 -157.48261 525.94480
2880.0000 -161.73060 -157.19842 4.53218 2.10844 -157.66440 535.17869
2885.0000 -161.02895 -155.62358 5.40538 2.20987 -156.02471 602.60414
2890.0000 -162.70073 -157.67315 5.02758 2.16854 -156.69281 609.20661
2895.0000 -162.38796 -157.28326 5.10470 2.10964 -157.64507 529.71976
2900.0000 -161.75961 -156.91010 4.84951 2.15214 -156.95795 583.12451
2905.0000 -162.58482 -156.86799 5.71683 2.14629 -157.05257 577.63551
2910.0000 -162.45519 -157.79804 4.65715 2.11508 -157.55708 570.06395
2915.0000 -161.75139 -157.90216 3.84922 2.11894 -157.49478 565.79751
2920.0000 -161.50322 -156.88501 4.61821 2.10816 -157.66895 529.24247
2925.0000 -162.70331 -157.06483 5.63848 2.15893 -156.84826 565.07047
2930.0000 -161.52345 -157.09913 4.42432 2.14701 -157.04097 592.32593
2935.0000 -161.11994 -156.33164 4.78830 2.14888 -157.01072 565.96729
2940.0000 -162.13878 -158.22263 3.91615 2.14224 -157.11809 569.11585
2945.0000 -161.76398 -157.19670 4.56728 2.12798 -157.34852 553.64871
2950.0000 -161.18945 -155.70826 5.48119 2.19827 -156.21218 611.65865
2955.0000 -160.20290 -155.53201 4.67089 2.21757 -155.90024 620.73383
2960.0000 -162.23246 -156.99758 5.23488 2.20465 -156.10914 599.12352
2965.0000 -161.37605 -155.41414 5.96190 2.20947 -156.03124 611.62270
2970.0000 -161.29066 -156.17573 5.11494 2.22081 -155.84790 613.13207
2975.0000 -161.68783 -156.67538 5.01245 2.19965 -156.18991 608.05999
2980.0000 -161.11026 -156.14677 4.96349 2.16649 -156.72595 595.57683
2985.0000 -161.67561 -156.52561 5.15000 2.17490 -156.59009 590.22817
2990.0000 -161.67621 -157.47360 4.20261 2.15014 -156.99030 554.75627
2995.0000 -162.03906 -158.15714 3.88192 2.10038 -157.79471 513.99931
3000.0000 -161.34562 -156.49394 4.85167 2.15414 -156.92559 542.35081
MELTING PROCESS: loop number 13 T-loop= 607.00000000000000
main_MD> interactions number 13 at Temperature= 607.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70206 -0.47255 1.12243
force_rgl> df(natom) 1.21111 -0.14898 1.21102
3005.0000 -161.19667 -156.89374 4.30293 2.20408 -156.11839 590.87912
3010.0000 -159.93143 -154.62110 5.31034 2.23129 -155.67838 585.67628
3015.0000 -161.66789 -156.78360 4.88429 2.23995 -155.53838 624.54767
3020.0000 -162.38332 -156.72114 5.66218 2.16741 -156.71114 578.59032
3025.0000 -161.75591 -156.57317 5.18274 2.13119 -157.29666 558.63231
3030.0000 -162.04008 -156.63594 5.40414 2.17389 -156.60640 593.93249
3035.0000 -162.12189 -157.92815 4.19374 2.14331 -157.10079 582.68086
3040.0000 -161.60574 -157.59477 4.01097 2.13294 -157.26832 549.82235
3045.0000 -161.04260 -155.99636 5.04625 2.14817 -157.02225 565.85018
3050.0000 -161.95560 -156.94855 5.00705 2.14605 -157.05642 600.25015
3055.0000 -162.41659 -157.99378 4.42281 2.11748 -157.51832 557.84707
3060.0000 -162.09097 -157.01239 5.07858 2.09416 -157.89533 542.02892
3065.0000 -161.46403 -155.95956 5.50447 2.18357 -156.44995 596.37405
3070.0000 -161.93186 -157.92285 4.00902 2.19712 -156.23088 591.40215
3075.0000 -162.23260 -158.18927 4.04333 2.07230 -158.24879 500.00805
3080.0000 -162.25636 -157.88276 4.37360 2.09968 -157.80611 538.27325
3085.0000 -162.68195 -157.22716 5.45479 2.11825 -157.50593 586.41060
3090.0000 -161.75905 -156.93624 4.82280 2.13837 -157.18054 595.60408
3095.0000 -160.86244 -156.31625 4.54619 2.14292 -157.10697 582.87520
3100.0000 -161.74938 -156.18907 5.56031 2.18786 -156.38061 613.56065
3105.0000 -162.19329 -157.67281 4.52049 2.17585 -156.57467 594.68655
3110.0000 -161.06080 -156.49440 4.56640 2.13765 -157.19229 583.30796
3115.0000 -161.67174 -156.25893 5.41281 2.18165 -156.48100 614.96003
3120.0000 -162.44939 -158.12952 4.31987 2.14345 -157.09851 559.84766
3125.0000 -162.77044 -157.54614 5.22431 2.10049 -157.79299 520.65933
3130.0000 -160.75144 -156.25400 4.49745 2.14693 -157.04229 568.90340
3135.0000 -161.39630 -156.30092 5.09537 2.21400 -155.95800 603.63675
3140.0000 -159.80459 -155.13013 4.67446 2.21729 -155.90469 605.70767
3145.0000 -160.91809 -155.89235 5.02574 2.25629 -155.27422 660.80009
3150.0000 -161.38944 -156.84542 4.54403 2.20724 -156.06731 598.69960
3155.0000 -161.40500 -155.82896 5.57603 2.18187 -156.47733 585.82949
3160.0000 -161.36935 -156.98633 4.38302 2.19476 -156.26898 607.34780
3165.0000 -162.98707 -157.27020 5.71687 2.11035 -157.63353 549.83588
3170.0000 -161.60129 -155.91193 5.68936 2.17599 -156.57246 602.32300
3175.0000 -161.86588 -157.79898 4.06690 2.15191 -156.96179 555.82765
3180.0000 -161.27094 -156.68620 4.58474 2.17058 -156.65983 584.00536
3185.0000 -160.15395 -155.84658 4.30737 2.19532 -156.26001 607.16933
3190.0000 -161.08547 -157.26694 3.81852 2.15219 -156.95714 574.29902
3195.0000 -161.28959 -156.31413 4.97546 2.18602 -156.41031 590.69235
3200.0000 -161.71454 -157.21800 4.49654 2.15832 -156.85815 600.10890
3205.0000 -162.73265 -157.75234 4.98031 2.10376 -157.74015 562.07994
3210.0000 -162.43982 -157.11254 5.32727 2.13551 -157.22687 578.96460
3215.0000 -162.03511 -157.78297 4.25214 2.14595 -157.05800 577.29308
3220.0000 -162.44233 -157.51383 4.92850 2.12442 -157.40615 590.78980
3225.0000 -162.93350 -157.09347 5.84002 2.15410 -156.92636 613.53095
3230.0000 -162.96221 -157.49866 5.46355 2.12019 -157.47459 572.13760
3235.0000 -162.43425 -157.22265 5.21160 2.15764 -156.86907 607.98536
3240.0000 -161.53900 -156.80912 4.72988 2.15096 -156.97709 571.76338
3245.0000 -161.20001 -156.18913 5.01088 2.16932 -156.68027 580.28642
3250.0000 -161.43292 -156.52890 4.90402 2.17737 -156.55017 600.89146
MELTING PROCESS: loop number 14 T-loop= 632.00000000000000
main_MD> interactions number 14 at Temperature= 632.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.92502 -0.30981 -0.65688
force_rgl> df(natom) -0.29360 -0.30395 -0.03414
3255.0000 -162.34893 -156.59139 5.75753 2.17793 -156.54111 601.98462
3260.0000 -161.83805 -155.83956 5.99849 2.21695 -155.91023 611.58023
3265.0000 -161.70969 -155.50775 6.20194 2.18609 -156.40922 598.41015
3270.0000 -161.93428 -157.06373 4.87055 2.20319 -156.13264 626.48083
3275.0000 -161.36317 -156.59592 4.76725 2.17888 -156.52575 603.55288
3280.0000 -161.67763 -157.07890 4.59872 2.16810 -156.70000 587.40805
3285.0000 -163.41849 -157.53354 5.88495 2.15035 -156.98687 613.52534
3290.0000 -162.91615 -156.93387 5.98228 2.14799 -157.02501 634.04652
3295.0000 -162.11020 -156.82381 5.28639 2.14870 -157.01369 609.59751
3300.0000 -160.61748 -155.46132 5.15615 2.22451 -155.78799 642.63451
3305.0000 -158.83186 -153.37961 5.45225 2.34331 -153.86752 689.36010
3310.0000 -159.36830 -154.14304 5.22526 2.30808 -154.43702 659.34705
3315.0000 -160.37081 -155.12349 5.24732 2.30183 -154.53811 646.86039
3320.0000 -159.51964 -153.77464 5.74501 2.29842 -154.59313 687.95581
3325.0000 -160.49058 -155.74359 4.74698 2.31385 -154.34376 684.27285
3330.0000 -159.99870 -154.68498 5.31372 2.24937 -155.38611 643.80066
3335.0000 -160.20729 -155.12547 5.08182 2.25187 -155.34577 634.14032
3340.0000 -160.58425 -154.85387 5.73038 2.25530 -155.29023 650.97937
3345.0000 -160.37623 -154.70925 5.66698 2.28746 -154.77033 630.19231
3350.0000 -160.07933 -153.76836 6.31097 2.29879 -154.58720 685.48216
3355.0000 -159.97539 -154.39381 5.58158 2.27663 -154.94542 648.04113
3360.0000 -160.04438 -154.59452 5.44985 2.31847 -154.26902 668.91801
3365.0000 -161.12720 -155.79433 5.33288 2.25331 -155.32247 656.74838
3370.0000 -161.34885 -156.07230 5.27655 2.23588 -155.60418 623.25728
3375.0000 -160.06418 -154.39953 5.66466 2.21484 -155.94444 617.79496
3380.0000 -160.93114 -155.01267 5.91847 2.24531 -155.45179 641.59038
3385.0000 -160.07153 -155.19407 4.87745 2.27889 -154.90891 664.11590
3390.0000 -161.07354 -155.74947 5.32407 2.22450 -155.78823 621.57850
3395.0000 -161.65786 -156.52828 5.12958 2.19834 -156.21116 617.77921
3400.0000 -161.02237 -155.83430 5.18807 2.22434 -155.79072 612.04226
3405.0000 -161.49973 -156.55940 4.94033 2.22813 -155.72945 632.76228
3410.0000 -161.88668 -155.75429 6.13239 2.16693 -156.71895 585.10825
3415.0000 -161.20099 -155.56144 5.63955 2.23709 -155.58463 649.05709
3420.0000 -160.04259 -155.49349 4.54911 2.25567 -155.28423 633.63076
3425.0000 -161.46277 -156.08148 5.38129 2.23914 -155.55161 625.57773
3430.0000 -161.73375 -156.59545 5.13829 2.17039 -156.66299 576.78333
3435.0000 -161.95159 -156.73149 5.22010 2.19423 -156.27749 593.57160
3440.0000 -160.59729 -155.44965 5.14764 2.20806 -156.05392 607.37451
3445.0000 -160.72717 -154.42829 6.29888 2.24162 -155.51138 630.59462
3450.0000 -160.45161 -154.82284 5.62877 2.27566 -154.96119 670.46255
3455.0000 -159.99000 -154.40360 5.58639 2.27088 -155.03837 665.05297
3460.0000 -161.14810 -155.61119 5.53691 2.26024 -155.21046 652.83705
3465.0000 -161.25545 -155.48244 5.77302 2.23316 -155.64815 617.10450
3470.0000 -160.90673 -155.67816 5.22856 2.20831 -156.04989 622.16768
3475.0000 -159.88208 -155.23358 4.64850 2.27493 -154.97299 662.55031
3480.0000 -160.71887 -155.75184 4.96703 2.28252 -154.85022 636.16719
3485.0000 -162.67413 -158.02463 4.64950 2.16203 -156.79808 555.12704
3490.0000 -160.62117 -156.53995 4.08122 2.15431 -156.92288 574.25069
3495.0000 -161.33130 -156.56023 4.77107 2.20268 -156.14096 588.64121
3500.0000 -161.24638 -157.08328 4.16310 2.17217 -156.63426 561.77865
MELTING PROCESS: loop number 15 T-loop= 657.00000000000000
main_MD> interactions number 15 at Temperature= 657.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.09799 -0.32482 -0.48324
force_rgl> df(natom) -0.38135 -2.58307 -1.10128
3505.0000 -161.04208 -155.09997 5.94211 2.19511 -156.26326 581.79016
3510.0000 -158.97041 -153.07617 5.89424 2.27658 -154.94623 651.08154
3515.0000 -157.49159 -152.26729 5.22430 2.37895 -153.29128 710.60758
3520.0000 -160.55492 -154.73348 5.82144 2.36900 -153.45223 723.58558
3525.0000 -159.57637 -154.39812 5.17824 2.28391 -154.82780 656.81338
3530.0000 -159.68189 -153.85884 5.82305 2.34265 -153.87817 690.70796
3535.0000 -160.10902 -154.94432 5.16470 2.29675 -154.62026 689.46748
3540.0000 -160.65597 -155.17096 5.48501 2.24999 -155.37608 640.75135
3545.0000 -159.62357 -154.28226 5.34131 2.28154 -154.86606 654.69545
3550.0000 -160.46134 -154.40257 6.05877 2.31844 -154.26948 681.55617
3555.0000 -160.96251 -154.89251 6.07000 2.29224 -154.69307 643.38929
3560.0000 -160.44788 -155.04326 5.40463 2.29018 -154.72642 664.14927
3565.0000 -160.42639 -155.45021 4.97618 2.25307 -155.32633 625.21415
3570.0000 -160.55141 -155.55431 4.99710 2.27219 -155.01727 656.69055
3575.0000 -162.38810 -155.93151 6.45659 2.24367 -155.47836 649.83615
3580.0000 -160.59893 -154.87348 5.72545 2.24086 -155.52375 627.27242
3585.0000 -160.93636 -155.13858 5.79778 2.29801 -154.59975 669.44277
3590.0000 -160.99661 -154.46069 6.53592 2.28966 -154.73488 664.90884
3595.0000 -160.49502 -155.00858 5.48644 2.27923 -154.90341 679.94844
3600.0000 -161.16389 -155.98488 5.17901 2.25347 -155.31990 647.09132
3605.0000 -160.58122 -156.00612 4.57509 2.21376 -155.96186 609.72580
3610.0000 -159.73212 -154.73348 4.99864 2.24897 -155.39262 635.39408
3615.0000 -161.25502 -155.08718 6.16784 2.27134 -155.03103 635.17145
3620.0000 -160.53405 -155.29206 5.24199 2.27605 -154.95484 657.09425
3625.0000 -160.62436 -155.10775 5.51661 2.25270 -155.33239 647.99135
3630.0000 -161.73440 -155.40739 6.32701 2.21916 -155.87457 607.94882
3635.0000 -161.18418 -155.89202 5.29216 2.23298 -155.65118 615.62114
3640.0000 -159.77375 -154.43813 5.33562 2.25965 -155.21998 670.04715
3645.0000 -160.41509 -155.08970 5.32540 2.28933 -154.74009 666.41165
3650.0000 -161.70345 -155.93416 5.76929 2.26049 -155.20643 666.87203
3655.0000 -161.64581 -156.17877 5.46704 2.17612 -156.57029 600.58077
3660.0000 -160.81539 -155.38994 5.42545 2.21941 -155.87051 620.52937
3665.0000 -161.42968 -156.62882 4.80086 2.16995 -156.67010 597.69269
3670.0000 -161.04452 -155.40564 5.63888 2.18659 -156.40106 619.88891
3675.0000 -160.63496 -155.32222 5.31274 2.19985 -156.18674 601.92353
3680.0000 -160.94527 -156.37632 4.56896 2.20699 -156.07127 626.64522
3685.0000 -159.67593 -154.03995 5.63597 2.28359 -154.83296 659.82937
3690.0000 -160.82635 -155.45112 5.37524 2.24398 -155.47328 617.59507
3695.0000 -161.85182 -156.37965 5.47217 2.19676 -156.23672 604.70455
3700.0000 -160.83952 -156.39846 4.44106 2.19409 -156.27982 602.70841
3705.0000 -161.15029 -156.14655 5.00374 2.18620 -156.40744 615.32753
3710.0000 -161.08330 -155.67769 5.40561 2.24636 -155.43481 656.96744
3715.0000 -161.03468 -156.15390 4.88078 2.21801 -155.89305 619.49532
3720.0000 -160.78498 -156.40391 4.38107 2.19410 -156.27963 587.47325
3725.0000 -159.60893 -154.08803 5.52090 2.24394 -155.47398 645.90819
3730.0000 -160.84141 -155.30595 5.53546 2.27568 -154.96080 671.96069
3735.0000 -161.16913 -154.94945 6.21968 2.24068 -155.52663 645.74417
3740.0000 -159.62254 -153.30970 6.31284 2.28620 -154.79079 667.15387
3745.0000 -160.58360 -154.86151 5.72209 2.31624 -154.30512 686.29832
3750.0000 -160.99484 -155.34041 5.65443 2.25591 -155.28039 672.55906
MELTING PROCESS: loop number 16 T-loop= 682.00000000000000
main_MD> interactions number 16 at Temperature= 682.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.88318 -0.53636 -1.21734
force_rgl> df(natom) -2.81643 -2.92693 -2.25010
3755.0000 -159.66350 -153.96070 5.70280 2.33452 -154.00962 727.44077
3760.0000 -160.08583 -153.98836 6.09747 2.34867 -153.78083 691.32953
3765.0000 -159.13154 -152.92684 6.20470 2.36776 -153.47224 710.40454
3770.0000 -160.55554 -154.35914 6.19640 2.34734 -153.80228 723.16270
3775.0000 -159.72316 -154.41424 5.30892 2.32989 -154.08439 706.95110
3780.0000 -160.13758 -155.00095 5.13663 2.30861 -154.42848 664.89346
3785.0000 -159.91174 -153.49939 6.41235 2.34160 -153.89510 703.87622
3790.0000 -160.58431 -154.50534 6.07897 2.33224 -154.04649 703.42995
3795.0000 -161.44545 -155.48108 5.96437 2.25493 -155.29630 652.58412
3800.0000 -158.97734 -153.69204 5.28530 2.30518 -154.48393 652.03789
3805.0000 -159.86944 -153.86887 6.00057 2.37461 -153.36148 723.24941
3810.0000 -159.94801 -153.74003 6.20798 2.34421 -153.85289 708.32631
3815.0000 -160.67928 -154.99861 5.68067 2.25859 -155.23709 649.62648
3820.0000 -160.46965 -155.54305 4.92660 2.26987 -155.05469 640.13129
3825.0000 -159.82115 -153.62820 6.19295 2.31737 -154.28679 658.96867
3830.0000 -160.59338 -153.47487 7.11851 2.33679 -153.97283 682.38889
3835.0000 -159.58142 -154.64101 4.94042 2.35702 -153.64592 688.21085
3840.0000 -160.56652 -155.14977 5.41675 2.27569 -154.96061 653.45667
3845.0000 -160.05161 -154.23971 5.81190 2.28056 -154.88188 692.12697
3850.0000 -158.60167 -152.73111 5.87057 2.37254 -153.39489 750.62468
3855.0000 -159.88683 -154.00591 5.88092 2.34436 -153.85052 682.04299
3860.0000 -159.97852 -153.09556 6.88296 2.35024 -153.75542 705.33285
3865.0000 -159.59752 -152.64719 6.95033 2.36310 -153.54757 700.37056
3870.0000 -160.89783 -155.75064 5.14719 2.31256 -154.36466 676.29834
3875.0000 -161.63892 -156.35090 5.28802 2.24736 -155.41872 650.55409
3880.0000 -159.12615 -153.71073 5.41542 2.26913 -155.06676 660.34311
3885.0000 -159.37766 -154.20738 5.17028 2.32868 -154.10406 692.38563
3890.0000 -160.28890 -154.80879 5.48011 2.30737 -154.44855 684.31315
3895.0000 -159.86025 -154.56709 5.29316 2.35331 -153.70576 709.10647
3900.0000 -160.61353 -155.09886 5.51468 2.26536 -155.12771 647.47364
3905.0000 -160.66833 -155.30764 5.36069 2.27181 -155.02335 646.01173
3910.0000 -159.80675 -153.65222 6.15453 2.35473 -153.68290 713.54534
3915.0000 -161.35392 -155.18962 6.16431 2.27717 -154.93667 659.95170
3920.0000 -161.22537 -155.44456 5.78081 2.23881 -155.55694 648.39443
3925.0000 -160.48147 -155.13420 5.34727 2.27820 -154.92015 653.00851
3930.0000 -160.58223 -154.91879 5.66344 2.28142 -154.86801 635.27393
3935.0000 -161.00067 -155.40646 5.59421 2.24029 -155.53287 633.69208
3940.0000 -158.89467 -152.88209 6.01258 2.31486 -154.32749 680.00964
3945.0000 -160.40768 -155.20939 5.19828 2.39888 -152.96910 746.58526
3950.0000 -161.17702 -154.69362 6.48339 2.23465 -155.62416 648.02416
3955.0000 -161.56686 -156.06338 5.50348 2.26900 -155.06885 696.16502
3960.0000 -161.05076 -156.60612 4.44464 2.16850 -156.69344 612.41790
3965.0000 -160.84281 -155.33325 5.50956 2.20460 -156.10990 641.92819
3970.0000 -160.17172 -154.30649 5.86523 2.28505 -154.80933 692.51894
3975.0000 -160.49577 -155.01688 5.47889 2.30216 -154.53269 693.08011
3980.0000 -160.51450 -153.64615 6.86835 2.30480 -154.49002 690.00781
3985.0000 -159.60852 -153.63816 5.97036 2.36325 -153.54520 714.96721
3990.0000 -160.83661 -155.90609 4.93052 2.27814 -154.92109 657.29075
3995.0000 -159.70093 -153.56917 6.13176 2.25891 -155.23193 663.35359
4000.0000 -158.53375 -153.38590 5.14785 2.32444 -154.17251 678.78771
MELTING PROCESS: loop number 17 T-loop= 707.00000000000000
main_MD> interactions number 17 at Temperature= 707.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.04628 -0.26155 0.95302
force_rgl> df(natom) -1.19462 -0.53454 1.51591
4005.0000 -160.16998 -154.45118 5.71880 2.35284 -153.71343 699.54378
4010.0000 -160.14781 -154.85341 5.29439 2.28063 -154.88082 690.22631
4015.0000 -159.54913 -154.65159 4.89754 2.27306 -155.00321 664.08253
4020.0000 -161.02818 -155.31405 5.71413 2.27585 -154.95809 664.19043
4025.0000 -160.16782 -154.42196 5.74586 2.29226 -154.69279 672.58610
4030.0000 -159.37938 -154.02911 5.35027 2.33334 -154.02867 718.07514
4035.0000 -160.84688 -154.59257 6.25431 2.32666 -154.13663 701.94664
4040.0000 -160.80795 -154.59403 6.21391 2.27306 -155.00315 659.07102
4045.0000 -160.07626 -154.20408 5.87218 2.33370 -154.02290 709.22190
4050.0000 -159.58227 -153.55101 6.03126 2.38318 -153.22294 701.55691
4055.0000 -159.78847 -154.37727 5.41120 2.33770 -153.95811 682.18352
4060.0000 -160.24107 -155.80751 4.43357 2.27841 -154.91664 646.14436
4065.0000 -160.86547 -155.04321 5.82226 2.28662 -154.78396 656.42084
4070.0000 -161.19525 -155.32435 5.87090 2.26222 -155.17835 661.30103
4075.0000 -160.41761 -155.12639 5.29122 2.26944 -155.06169 658.37052
4080.0000 -160.13303 -155.49044 4.64259 2.30253 -154.52684 691.99528
4085.0000 -160.91704 -155.34253 5.57451 2.23989 -155.53949 615.58734
4090.0000 -162.01079 -155.17496 6.83583 2.28799 -154.76187 673.81350
4095.0000 -161.94966 -156.10533 5.84433 2.25421 -155.30785 676.76563
4100.0000 -160.63490 -155.85638 4.77852 2.18259 -156.46567 631.99206
4105.0000 -160.77574 -155.47129 5.30445 2.26818 -155.08209 652.69902
4110.0000 -160.96943 -155.52053 5.44890 2.22429 -155.79159 652.54108
4115.0000 -160.85585 -154.27922 6.57663 2.23074 -155.68735 646.82335
4120.0000 -159.34676 -153.58467 5.76210 2.35024 -153.75541 702.32172
4125.0000 -158.55801 -152.61474 5.94327 2.36134 -153.57603 734.52484
4130.0000 -159.94844 -152.69950 7.24894 2.42577 -152.53449 789.34870
4135.0000 -158.18375 -151.77316 6.41060 2.45718 -152.02663 786.28520
4140.0000 -159.15456 -152.79465 6.35991 2.39230 -153.07549 738.99996
4145.0000 -159.20664 -152.40172 6.80492 2.39724 -152.99571 757.81674
4150.0000 -158.82829 -152.48624 6.34205 2.40642 -152.84717 726.06900
4155.0000 -160.10865 -154.95951 5.14914 2.33073 -154.07089 703.77263
4160.0000 -159.56652 -154.03203 5.53449 2.28788 -154.76363 676.11249
4165.0000 -158.22928 -153.01012 5.21917 2.39043 -153.10582 704.98661
4170.0000 -159.11562 -152.82133 6.29429 2.41710 -152.67465 774.01731
4175.0000 -160.14775 -153.77535 6.37240 2.36121 -153.57805 723.44280
4180.0000 -159.66198 -153.70947 5.95251 2.33275 -154.03818 708.10066
4185.0000 -158.92973 -153.19166 5.73807 2.38652 -153.16895 740.03190
4190.0000 -160.33978 -154.48496 5.85482 2.35649 -153.65442 674.24771
4195.0000 -160.02467 -154.81690 5.20777 2.30532 -154.48160 667.97809
4200.0000 -159.74153 -153.47080 6.27073 2.29632 -154.62715 669.15545
4205.0000 -158.89113 -153.22241 5.66871 2.36497 -153.51735 728.78235
4210.0000 -159.95082 -154.94334 5.00748 2.34247 -153.88111 689.87625
4215.0000 -159.49503 -154.44271 5.05232 2.31097 -154.39029 663.41075
4220.0000 -159.94579 -154.42776 5.51803 2.30447 -154.49537 659.80030
4225.0000 -159.53294 -153.64301 5.88993 2.30796 -154.43905 645.76012
4230.0000 -159.51758 -152.92541 6.59216 2.39643 -153.00877 717.10507
4235.0000 -159.06986 -152.90622 6.16363 2.41172 -152.76162 734.46716
4240.0000 -158.88448 -151.73186 7.15262 2.44080 -152.29149 752.89006
4245.0000 -159.67349 -153.83255 5.84094 2.42207 -152.59423 754.41887
4250.0000 -159.32480 -153.01487 6.30994 2.35539 -153.67222 695.37562
MELTING PROCESS: loop number 18 T-loop= 732.00000000000000
main_MD> interactions number 18 at Temperature= 732.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.26991 3.35531 -1.12695
force_rgl> df(natom) 1.60010 3.01022 -0.58208
4255.0000 -159.44087 -152.41585 7.02501 2.39946 -152.95983 748.87007
4260.0000 -159.88935 -153.45656 6.43279 2.39188 -153.08237 753.90369
4265.0000 -160.18247 -154.38608 5.79639 2.34709 -153.80641 712.43104
4270.0000 -160.32510 -153.92590 6.39919 2.27770 -154.92819 656.14931
4275.0000 -159.37414 -154.02343 5.35071 2.39203 -153.07990 737.93968
4280.0000 -159.41639 -154.28128 5.13511 2.34799 -153.79187 687.87944
4285.0000 -158.65796 -153.63427 5.02369 2.33279 -154.03759 679.59315
4290.0000 -160.06586 -153.98205 6.08381 2.36408 -153.53170 701.88978
4295.0000 -158.67402 -153.47967 5.19435 2.34337 -153.86648 706.40045
4300.0000 -157.90248 -151.46466 6.43782 2.46225 -151.94472 791.61808
4305.0000 -159.16133 -154.36305 4.79828 2.38194 -153.24301 703.25316
4310.0000 -158.55619 -152.19742 6.35877 2.34721 -153.80450 691.74828
4315.0000 -159.08306 -153.90970 5.17337 2.35932 -153.60872 698.80210
4320.0000 -159.22375 -153.23954 5.98421 2.38979 -153.11601 762.03914
4325.0000 -159.22472 -152.48599 6.73873 2.37122 -153.41625 733.41584
4330.0000 -158.45790 -151.71114 6.74677 2.46778 -151.85523 788.65784
4335.0000 -159.40758 -153.20752 6.20006 2.40801 -152.82155 777.13090
4340.0000 -159.55484 -153.23042 6.32442 2.41027 -152.78498 730.38024
4345.0000 -160.76332 -155.71134 5.05198 2.29304 -154.68024 678.46524
4350.0000 -160.84728 -154.29557 6.55170 2.27944 -154.89996 644.90101
4355.0000 -159.92050 -153.99810 5.92240 2.32127 -154.22377 700.70009
4360.0000 -158.87301 -152.50568 6.36733 2.40406 -152.88535 758.32682
4365.0000 -159.24748 -153.33185 5.91563 2.40402 -152.88610 758.71048
4370.0000 -159.58653 -153.36255 6.22398 2.41398 -152.72504 755.89177
4375.0000 -158.40279 -152.39990 6.00288 2.42345 -152.57198 758.29083
4380.0000 -158.24858 -152.42944 5.81914 2.45014 -152.14048 766.97110
4385.0000 -159.61825 -153.53090 6.08735 2.43854 -152.32800 762.49276
4390.0000 -158.50152 -152.72811 5.77341 2.41472 -152.71299 761.59582
4395.0000 -158.82215 -152.87720 5.94494 2.41965 -152.63344 737.21541
4400.0000 -158.11841 -152.42997 5.68844 2.44697 -152.19177 767.89430
4405.0000 -159.32360 -152.92356 6.40004 2.46490 -151.90187 776.40701
4410.0000 -159.55740 -153.61875 5.93864 2.38522 -153.19001 731.74813
4415.0000 -159.24331 -153.29570 5.94761 2.37952 -153.28207 714.26642
4420.0000 -159.64302 -154.11411 5.52890 2.40326 -152.89826 751.96516
4425.0000 -160.06572 -154.44997 5.61576 2.32062 -154.23426 699.16489
4430.0000 -160.02747 -153.84747 6.18000 2.31295 -154.35834 695.83810
4435.0000 -158.76709 -152.43905 6.32803 2.38637 -153.17139 716.62010
4440.0000 -160.54048 -153.92106 6.61943 2.39232 -153.07512 721.28999
4445.0000 -160.23659 -153.23977 6.99682 2.34345 -153.86525 714.82149
4450.0000 -160.18072 -154.31722 5.86350 2.34636 -153.81822 718.98909
4455.0000 -158.65051 -153.56490 5.08562 2.35046 -153.75186 692.90101
4460.0000 -159.46801 -152.69548 6.77253 2.36088 -153.58349 709.90305
4465.0000 -159.38891 -153.27166 6.11726 2.44057 -152.29509 765.58330
4470.0000 -158.80738 -152.37090 6.43648 2.43139 -152.44356 762.61578
4475.0000 -159.38859 -152.48419 6.90440 2.43740 -152.34641 771.23638
4480.0000 -158.49227 -151.54187 6.95040 2.41966 -152.63326 755.30260
4485.0000 -159.76096 -153.48045 6.28051 2.45848 -152.00558 772.82480
4490.0000 -157.64692 -151.06454 6.58238 2.38337 -153.21980 726.67266
4495.0000 -159.34761 -152.32202 7.02559 2.46243 -151.94181 750.86265
4500.0000 -159.08794 -154.09149 4.99645 2.38171 -153.24675 720.36778
MELTING PROCESS: loop number 19 T-loop= 757.00000000000000
main_MD> interactions number 19 at Temperature= 757.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.70125 -2.29683 -5.12306
force_rgl> df(natom) -2.26273 -0.17107 4.14940
4505.0000 -160.16531 -153.44648 6.71883 2.37211 -153.40189 707.10129
4510.0000 -158.30286 -151.63215 6.67071 2.41572 -152.69691 739.74878
4515.0000 -157.79184 -151.59750 6.19434 2.45204 -152.10970 770.93349
4520.0000 -158.86588 -152.03301 6.83287 2.47498 -151.73885 814.08799
4525.0000 -157.85883 -151.16529 6.69353 2.44903 -152.15843 779.97434
4530.0000 -158.71557 -152.88975 5.82583 2.43021 -152.46268 753.83932
4535.0000 -158.41434 -152.10017 6.31417 2.47938 -151.66780 790.49291
4540.0000 -159.50705 -152.77445 6.73260 2.38685 -153.16355 723.58319
4545.0000 -159.36824 -153.11713 6.25111 2.36383 -153.53584 701.64920
4550.0000 -159.18077 -153.09040 6.09037 2.38180 -153.24519 739.94565
4555.0000 -158.85899 -152.69050 6.16849 2.36864 -153.45801 726.46295
4560.0000 -160.35955 -153.74250 6.61705 2.37568 -153.34417 731.03856
4565.0000 -158.77696 -152.66332 6.11364 2.41291 -152.74238 747.06026
4570.0000 -158.33268 -151.99932 6.33336 2.43621 -152.36572 747.11978
4575.0000 -159.11903 -153.10449 6.01454 2.39878 -152.97078 709.11540
4580.0000 -160.44071 -153.11116 7.32955 2.38653 -153.16878 733.35837
4585.0000 -158.43429 -152.31303 6.12126 2.41748 -152.66850 766.34657
4590.0000 -159.48616 -153.05955 6.42661 2.43917 -152.31782 800.83277
4595.0000 -159.05578 -153.08760 5.96818 2.36869 -153.45721 717.82463
4600.0000 -158.12859 -153.06893 5.05965 2.34107 -153.90375 690.69348
4605.0000 -158.47281 -152.43708 6.03572 2.38909 -153.12741 746.80302
4610.0000 -159.55910 -152.54482 7.01428 2.40843 -152.81477 727.24162
4615.0000 -158.77037 -151.13574 7.63463 2.42870 -152.48714 768.59743
4620.0000 -159.13448 -152.79372 6.34076 2.43610 -152.36738 745.86600
4625.0000 -159.97080 -153.83679 6.13401 2.37165 -153.40938 732.51294
4630.0000 -160.09988 -154.44236 5.65752 2.31976 -154.24816 696.93360
4635.0000 -159.46286 -153.87297 5.58989 2.31618 -154.30616 683.11427
4640.0000 -159.71767 -153.12795 6.58972 2.39292 -153.06543 763.51895
4645.0000 -158.23359 -151.67359 6.56000 2.43345 -152.41023 796.80385
4650.0000 -159.52499 -153.42620 6.09879 2.44093 -152.28934 806.31973
4655.0000 -158.77604 -152.78994 5.98611 2.36963 -153.44194 738.91428
4660.0000 -159.06066 -153.50551 5.55515 2.38544 -153.18647 733.71124
4665.0000 -158.27983 -152.51274 5.76709 2.39851 -152.97515 758.07771
4670.0000 -159.57770 -152.94888 6.62882 2.42451 -152.55482 788.93876
4675.0000 -159.55982 -152.75324 6.80658 2.40087 -152.93702 734.92570
4680.0000 -159.35562 -153.15232 6.20331 2.38467 -153.19888 716.74974
4685.0000 -159.72153 -152.79455 6.92698 2.41288 -152.74284 728.53390
4690.0000 -159.80295 -152.60799 7.19495 2.41847 -152.65247 770.96359
4695.0000 -158.96954 -152.37977 6.58977 2.44971 -152.14748 790.49280
4700.0000 -158.01260 -152.51289 5.49971 2.44992 -152.14407 800.31221
4705.0000 -159.50854 -153.47009 6.03845 2.38883 -153.13164 710.93026
4710.0000 -159.77273 -154.00465 5.76808 2.33193 -154.05148 701.95882
4715.0000 -160.46408 -155.15623 5.30785 2.29772 -154.60445 682.31808
4720.0000 -160.36778 -153.39329 6.97449 2.26446 -155.14220 645.73516
4725.0000 -157.69870 -151.56889 6.12981 2.41873 -152.64821 738.58294
4730.0000 -158.26004 -151.72686 6.53317 2.50105 -151.31741 795.04403
4735.0000 -158.40331 -152.44738 5.95593 2.47335 -151.76518 787.36561
4740.0000 -158.25999 -151.91216 6.34783 2.48514 -151.57459 762.21358
4745.0000 -158.24132 -152.34622 5.89509 2.44901 -152.15865 776.15357
4750.0000 -158.62337 -152.33894 6.28443 2.44454 -152.23097 780.98608
MELTING PROCESS: loop number 20 T-loop= 782.00000000000000
main_MD> interactions number 20 at Temperature= 782.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.30988 -1.83081 -1.33167
force_rgl> df(natom) 0.68541 -1.65823 1.03405
4755.0000 -159.13509 -152.38486 6.75022 2.41892 -152.64523 744.24716
4760.0000 -158.36938 -153.06972 5.29965 2.40989 -152.79118 737.82951
4765.0000 -158.41250 -153.65129 4.76121 2.39807 -152.98220 713.63027
4770.0000 -158.15741 -151.70706 6.45035 2.39827 -152.97904 722.00284
4775.0000 -158.50698 -152.54742 5.95956 2.49159 -151.47034 804.74342
4780.0000 -159.32362 -151.41258 7.91104 2.49237 -151.45773 806.92783
4785.0000 -158.12867 -151.47861 6.65006 2.55280 -150.48075 839.40162
4790.0000 -156.49650 -149.62911 6.86739 2.56652 -150.25895 833.62130
4795.0000 -157.70060 -150.94073 6.75987 2.58370 -149.98135 870.98101
4800.0000 -157.06074 -150.51069 6.55005 2.54697 -150.57501 853.36544
4805.0000 -156.64652 -148.32933 8.31719 2.63728 -149.11506 872.45840
4810.0000 -156.46575 -149.82381 6.64194 2.63518 -149.14905 881.36214
4815.0000 -157.60742 -150.24493 7.36248 2.59874 -149.73810 872.35595
4820.0000 -158.27145 -150.91033 7.36112 2.56653 -150.25886 829.83944
4825.0000 -158.45054 -152.46536 5.98519 2.48482 -151.57976 782.06066
4830.0000 -158.11284 -150.88748 7.22536 2.50025 -151.33033 814.33386
4835.0000 -159.36496 -152.60231 6.76265 2.50642 -151.23065 817.56563
4840.0000 -158.72733 -152.34412 6.38322 2.42821 -152.49497 770.04351
4845.0000 -159.21235 -153.81670 5.39565 2.37393 -153.37254 728.25189
4850.0000 -159.40854 -153.21666 6.19188 2.36450 -153.52489 710.47658
4855.0000 -159.37465 -153.11528 6.25937 2.42295 -152.58004 785.33443
4860.0000 -159.18609 -153.12104 6.06505 2.37869 -153.29550 726.66579
4865.0000 -159.24507 -153.14362 6.10146 2.40835 -152.81605 750.63176
4870.0000 -159.95460 -153.98408 5.97051 2.35816 -153.62748 720.47434
4875.0000 -157.87361 -153.02063 4.85297 2.37600 -153.33903 718.04296
4880.0000 -158.73320 -152.43714 6.29606 2.44711 -152.18942 754.40410
4885.0000 -158.83029 -153.33884 5.49145 2.44208 -152.27076 766.68991
4890.0000 -158.29515 -151.67515 6.62000 2.38840 -153.13852 724.78068
4895.0000 -157.05468 -151.21436 5.84032 2.51247 -151.13289 800.83546
4900.0000 -157.87633 -151.88615 5.99018 2.51343 -151.11731 799.66182
4905.0000 -157.93993 -150.57139 7.36854 2.47031 -151.81438 775.50446
4910.0000 -157.34630 -151.83716 5.50914 2.51597 -151.07630 839.51905
4915.0000 -158.63241 -152.80969 5.82271 2.45058 -152.13334 791.82059
4920.0000 -159.29345 -153.40028 5.89317 2.33196 -154.05095 724.86964
4925.0000 -157.89511 -152.42032 5.47479 2.40538 -152.86412 740.56910
4930.0000 -158.71924 -152.08222 6.63703 2.44744 -152.18413 762.12421
4935.0000 -158.49677 -152.10380 6.39297 2.44926 -152.15466 777.07399
4940.0000 -159.39052 -152.85344 6.53708 2.43421 -152.39800 775.95820
4945.0000 -159.57677 -152.65369 6.92308 2.42475 -152.55094 756.74854
4950.0000 -158.25281 -152.87693 5.37588 2.41686 -152.67854 771.29632
4955.0000 -159.02174 -152.30036 6.72137 2.41399 -152.72490 724.81131
4960.0000 -157.73383 -151.88283 5.85099 2.46591 -151.88552 784.32134
4965.0000 -158.48690 -151.26881 7.21809 2.45616 -152.04308 800.72168
4970.0000 -159.15296 -151.21643 7.93653 2.50290 -151.28753 816.88476
4975.0000 -157.38342 -149.73850 7.64491 2.55290 -150.47915 845.90648
4980.0000 -156.62226 -149.57454 7.04773 2.57636 -150.09995 849.02727
4985.0000 -157.29699 -149.70443 7.59255 2.61987 -149.39653 864.76303
4990.0000 -158.17295 -151.10472 7.06823 2.58855 -149.90282 853.83748
4995.0000 -158.51417 -150.66390 7.85027 2.52949 -150.85770 839.60879
5000.0000 -157.45305 -150.53599 6.91706 2.53578 -150.75603 834.24924
MELTING PROCESS: loop number 21 T-loop= 807.00000000000000
main_MD> interactions number 21 at Temperature= 807.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.13302 0.04341 1.13690
force_rgl> df(natom) 1.40056 2.87880 -2.79617
5005.0000 -157.27742 -150.59992 6.67750 2.61046 -149.54874 888.17111
5010.0000 -159.48254 -152.93199 6.55055 2.48727 -151.54020 787.72571
5015.0000 -159.24769 -153.08262 6.16507 2.41942 -152.63709 789.15004
5020.0000 -157.36744 -151.66960 5.69784 2.42647 -152.52310 795.13096
5025.0000 -157.57000 -151.75808 5.81192 2.45655 -152.03681 751.53296
5030.0000 -159.72188 -153.54229 6.17960 2.41832 -152.65492 732.63329
5035.0000 -158.99766 -152.81934 6.17832 2.38126 -153.25399 731.49086
5040.0000 -159.48399 -152.57439 6.90961 2.43379 -152.40474 771.60126
5045.0000 -157.46729 -149.85161 7.61568 2.54659 -150.58129 845.54233
5050.0000 -157.05835 -150.55836 6.49999 2.58683 -149.93062 865.35988
5055.0000 -158.19563 -152.09690 6.09873 2.43626 -152.36485 784.38401
5060.0000 -157.53569 -150.27312 7.26257 2.53047 -150.84177 820.92990
5065.0000 -158.46064 -151.82221 6.63843 2.55567 -150.43442 832.24148
5070.0000 -157.69053 -151.85296 5.83758 2.44495 -152.22431 772.06542
5075.0000 -157.04766 -150.35157 6.69609 2.45596 -152.04637 797.64137
5080.0000 -157.44323 -150.57917 6.86406 2.58108 -150.02364 850.70061
5085.0000 -156.81502 -149.97350 6.84152 2.54817 -150.55574 830.66679
5090.0000 -158.28882 -152.09026 6.19856 2.50458 -151.26035 804.51888
5095.0000 -157.60041 -151.93390 5.66651 2.46123 -151.96114 780.75980
5100.0000 -159.00986 -152.57785 6.43202 2.45910 -151.99559 777.14584
5105.0000 -159.68850 -153.40412 6.28438 2.42800 -152.49835 771.30659
5110.0000 -158.05576 -151.67923 6.37653 2.41306 -152.73991 745.60743
5115.0000 -158.11856 -150.24498 7.87357 2.49148 -151.47214 810.44896
5120.0000 -157.26634 -150.69320 6.57315 2.54990 -150.52775 832.83888
5125.0000 -158.24945 -152.40708 5.84237 2.51153 -151.14809 807.06406
5130.0000 -157.83042 -151.26459 6.56583 2.45810 -152.01179 810.81663
5135.0000 -158.84904 -152.37528 6.47376 2.51517 -151.08922 802.06940
5140.0000 -158.76434 -153.25338 5.51096 2.41540 -152.70200 741.38737
5145.0000 -159.61585 -152.57592 7.03992 2.38583 -153.18016 723.94342
5150.0000 -158.07488 -150.96784 7.10704 2.45594 -152.04669 773.19660
5155.0000 -158.03416 -150.81019 7.22397 2.55836 -150.39087 855.53424
5160.0000 -157.94791 -151.07006 6.87785 2.50870 -151.19369 797.69678
5165.0000 -157.07860 -148.96681 8.11178 2.52765 -150.88738 807.15289
5170.0000 -157.65147 -149.66726 7.98422 2.61508 -149.47394 895.24541
5175.0000 -156.93939 -149.89610 7.04329 2.58872 -149.90013 861.02238
5180.0000 -156.98000 -149.82833 7.15166 2.59692 -149.76760 865.97372
5185.0000 -158.47465 -152.11996 6.35469 2.54433 -150.61772 825.98924
5190.0000 -157.90513 -151.60238 6.30276 2.48677 -151.54837 766.19989
5195.0000 -159.44312 -153.39126 6.05186 2.43389 -152.40311 762.46876
5200.0000 -160.36660 -154.85360 5.51299 2.35844 -153.62290 735.93895
5205.0000 -159.35721 -152.77228 6.58494 2.37392 -153.37258 724.53289
5210.0000 -157.42939 -150.41219 7.01720 2.45387 -152.08012 758.45984
5215.0000 -157.73273 -151.07980 6.65294 2.50481 -151.25669 813.15300
5220.0000 -157.59870 -151.36407 6.23463 2.47184 -151.78968 782.30082
5225.0000 -158.03122 -151.17062 6.86060 2.53404 -150.78417 807.92213
5230.0000 -156.01578 -149.55901 6.45677 2.58334 -149.98710 890.40665
5235.0000 -156.11686 -149.78180 6.33506 2.60105 -149.70085 880.81440
5240.0000 -156.33092 -149.40730 6.92362 2.60809 -149.58701 865.37424
5245.0000 -158.65474 -151.61220 7.04254 2.55189 -150.49552 848.42111
5250.0000 -157.42028 -151.56644 5.85385 2.48957 -151.50308 807.37842
MELTING PROCESS: loop number 22 T-loop= 832.00000000000000
main_MD> interactions number 22 at Temperature= 832.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.26847 -0.48146 0.24248
force_rgl> df(natom) 2.57139 -7.30436 -1.74218
5255.0000 -157.53635 -150.44261 7.09374 2.51353 -151.11564 819.63915
5260.0000 -156.36429 -149.21464 7.14965 2.59721 -149.76281 853.54885
5265.0000 -158.26723 -151.15024 7.11699 2.61236 -149.51799 874.10751
5270.0000 -157.22668 -149.96633 7.26035 2.54726 -150.57047 838.42994
5275.0000 -156.66060 -149.01686 7.64374 2.61192 -149.52513 895.76863
5280.0000 -158.32912 -149.35109 8.97803 2.58619 -149.94110 879.17012
5285.0000 -156.66999 -150.31107 6.35891 2.63610 -149.13422 896.30674
5290.0000 -158.04029 -150.83810 7.20220 2.55578 -150.43259 816.64054
5295.0000 -157.05509 -150.47892 6.57617 2.53524 -150.76476 832.22391
5300.0000 -156.42407 -149.31390 7.11017 2.57772 -150.07790 838.82123
5305.0000 -156.57155 -149.58894 6.98261 2.61527 -149.47091 850.33139
5310.0000 -156.31292 -150.19412 6.11880 2.59179 -149.85053 885.59920
5315.0000 -156.65946 -149.44568 7.21379 2.58842 -149.90494 873.56473
5320.0000 -156.17221 -148.80043 7.37177 2.67306 -148.53669 917.72110
5325.0000 -156.36326 -148.39670 7.96656 2.64759 -148.94842 896.98027
5330.0000 -156.26813 -148.27441 7.99371 2.69310 -148.21274 917.49597
5335.0000 -157.26239 -149.88586 7.37654 2.64007 -149.06994 880.59153
5340.0000 -156.97691 -150.16580 6.81111 2.60274 -149.67343 862.69661
5345.0000 -158.21489 -151.42669 6.78820 2.56882 -150.22188 856.78156
5350.0000 -157.78618 -151.97337 5.81280 2.50378 -151.27322 787.73227
5355.0000 -158.66313 -152.19560 6.46753 2.49207 -151.46265 778.57448
5360.0000 -157.78921 -150.44605 7.34316 2.48074 -151.64583 773.29221
5365.0000 -155.77124 -148.97100 6.80024 2.55530 -150.44034 849.87529
5370.0000 -156.58296 -149.11673 7.46623 2.59073 -149.86768 869.66354
5375.0000 -157.77449 -149.06443 8.71006 2.63732 -149.11453 896.86358
5380.0000 -155.65814 -147.91904 7.73910 2.67504 -148.50461 897.04136
5385.0000 -157.84091 -150.46043 7.38048 2.62394 -149.33083 865.90226
5390.0000 -157.84993 -151.34937 6.50056 2.51421 -151.10469 790.60662
5395.0000 -157.75659 -151.20555 6.55105 2.49877 -151.35427 809.00193
5400.0000 -158.34696 -151.78091 6.56605 2.48645 -151.55344 786.97953
5405.0000 -159.34507 -152.00057 7.34450 2.41139 -152.76684 736.50531
5410.0000 -157.98404 -150.45588 7.52817 2.50942 -151.18210 795.35364
5415.0000 -158.14857 -150.85632 7.29225 2.51751 -151.05140 824.87883
5420.0000 -157.98179 -150.91905 7.06274 2.50416 -151.26712 807.94714
5425.0000 -157.62642 -149.99695 7.62946 2.59557 -149.78944 872.22945
5430.0000 -156.80457 -149.64695 7.15762 2.57286 -150.15650 872.75719
5435.0000 -156.82945 -149.70562 7.12383 2.58416 -149.97387 848.88709
5440.0000 -157.48339 -149.55944 7.92394 2.61346 -149.50015 877.62437
5445.0000 -157.56505 -150.20171 7.36334 2.61518 -149.47244 891.36009
5450.0000 -158.31138 -151.06005 7.25133 2.49141 -151.47333 795.54796
5455.0000 -158.00600 -150.70856 7.29744 2.51431 -151.10303 797.45777
5460.0000 -157.71266 -150.86029 6.85237 2.50560 -151.24381 795.62630
5465.0000 -159.25099 -151.49411 7.75688 2.51917 -151.02457 789.94962
5470.0000 -158.49514 -152.18463 6.31051 2.46342 -151.92585 760.84714
5475.0000 -159.04787 -152.76262 6.28525 2.40799 -152.82182 748.92889
5480.0000 -159.16962 -152.49276 6.67685 2.43418 -152.39846 745.09799
5485.0000 -157.11932 -149.65564 7.46368 2.51929 -151.02264 815.45210
5490.0000 -157.53434 -149.78771 7.74663 2.60343 -149.66227 885.98905
5495.0000 -158.05387 -150.24090 7.81297 2.59229 -149.84239 863.11200
5500.0000 -157.56521 -151.01682 6.54838 2.55040 -150.51962 842.58876
MELTING PROCESS: loop number 23 T-loop= 857.00000000000000
main_MD> interactions number 23 at Temperature= 857.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.33662 2.55453 2.07722
force_rgl> df(natom) -1.49230 -2.53844 -0.63732
5505.0000 -157.86390 -150.66265 7.20125 2.55873 -150.38493 858.85162
5510.0000 -157.15463 -150.77555 6.37907 2.55093 -150.51114 847.02607
5515.0000 -158.15755 -149.83636 8.32119 2.53697 -150.73673 843.56398
5520.0000 -155.92870 -149.15969 6.76902 2.59759 -149.75671 893.54117
5525.0000 -156.94203 -149.04627 7.89576 2.63843 -149.09645 912.03994
5530.0000 -157.36157 -149.72412 7.63745 2.55842 -150.39000 846.11489
5535.0000 -158.56706 -150.23490 8.33216 2.54710 -150.57298 870.69207
5540.0000 -157.97849 -151.73432 6.24417 2.49509 -151.41378 829.83401
5545.0000 -157.35292 -151.95483 5.39809 2.41046 -152.78191 757.13803
5550.0000 -156.65391 -150.17174 6.48217 2.51383 -151.11084 812.63090
5555.0000 -157.73659 -151.70460 6.03198 2.51450 -151.09997 818.17018
5560.0000 -157.57196 -149.40613 8.16583 2.54390 -150.62475 818.40091
5565.0000 -157.11298 -149.19257 7.92041 2.64657 -148.96492 907.65709
5570.0000 -156.95187 -149.19320 7.75867 2.67144 -148.56279 906.22300
5575.0000 -158.13203 -151.34375 6.78828 2.53528 -150.76410 859.60097
5580.0000 -157.31270 -149.44355 7.86915 2.55870 -150.38549 860.54453
5585.0000 -158.71728 -151.49654 7.22075 2.56038 -150.35837 865.37304
5590.0000 -157.51425 -150.99845 6.51580 2.50667 -151.22651 831.56499
5595.0000 -157.66863 -151.26088 6.40775 2.49356 -151.43851 804.47307
5600.0000 -157.38193 -151.07773 6.30420 2.55182 -150.49674 835.54561
5605.0000 -157.80690 -150.43746 7.36944 2.52067 -151.00023 814.18114
5610.0000 -156.93922 -149.02157 7.91765 2.63792 -149.10475 913.04405
5615.0000 -155.62832 -148.81664 6.81168 2.62650 -149.28945 892.59842
5620.0000 -156.70966 -149.42690 7.28276 2.57112 -150.18469 868.13816
5625.0000 -157.93901 -150.13384 7.80518 2.62706 -149.28033 890.03996
5630.0000 -157.81349 -149.97525 7.83824 2.57384 -150.14066 833.72727
5635.0000 -158.16013 -150.68140 7.47874 2.56884 -150.22146 842.33573
5640.0000 -157.87005 -149.96007 7.90998 2.56971 -150.20751 835.37980
5645.0000 -158.37187 -149.81174 8.56014 2.58104 -150.02434 882.21162
5650.0000 -157.17341 -150.88472 6.28869 2.54693 -150.57574 844.74647
5655.0000 -156.96862 -149.16534 7.80328 2.55941 -150.37393 866.64068
5660.0000 -156.26332 -149.06410 7.19923 2.61765 -149.43243 923.83541
5665.0000 -157.46140 -149.22187 8.23953 2.63917 -149.08458 917.54402
5670.0000 -157.63255 -150.36657 7.26599 2.58239 -150.00246 872.85813
5675.0000 -158.44138 -151.07575 7.36563 2.58495 -149.96106 878.17117
5680.0000 -159.63048 -152.50891 7.12157 2.45913 -151.99508 799.79978
5685.0000 -159.01767 -152.80783 6.20984 2.44893 -152.15999 795.06883
5690.0000 -155.55775 -147.99352 7.56423 2.57205 -150.16959 883.53994
5695.0000 -156.37233 -148.67714 7.69519 2.69594 -148.16679 940.39194
5700.0000 -156.95698 -149.65299 7.30398 2.62744 -149.27418 857.06468
5705.0000 -157.28707 -149.72299 7.56408 2.56884 -150.22146 843.15878
5710.0000 -158.15603 -151.67013 6.48590 2.51076 -151.16039 802.51079
5715.0000 -158.33156 -150.20529 8.12626 2.52832 -150.87663 837.32639
5720.0000 -158.65846 -152.35610 6.30236 2.49395 -151.43214 785.00813
5725.0000 -158.05950 -150.86172 7.19778 2.47055 -151.81059 799.66742
5730.0000 -156.80435 -149.91834 6.88602 2.51511 -151.09019 840.40502
5735.0000 -158.26372 -151.31747 6.94625 2.54553 -150.59834 816.33958
5740.0000 -156.74330 -149.49514 7.24816 2.56992 -150.20412 853.52081
5745.0000 -155.56185 -149.87628 5.68557 2.56263 -150.32193 861.66132
5750.0000 -156.18978 -149.82983 6.35995 2.54962 -150.53232 822.47566
MELTING PROCESS: loop number 24 T-loop= 882.00000000000000
main_MD> interactions number 24 at Temperature= 882.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.03902 -1.60508 1.84155
force_rgl> df(natom) 3.01680 -3.88180 -0.91385
5755.0000 -157.70242 -151.40416 6.29826 2.53743 -150.72933 821.58911
5760.0000 -158.07899 -151.06072 7.01827 2.52184 -150.98134 843.70544
5765.0000 -157.48744 -150.45304 7.03440 2.48911 -151.51043 793.05271
5770.0000 -158.57479 -151.24013 7.33466 2.56366 -150.30530 854.54812
5775.0000 -155.19942 -147.61869 7.58074 2.62321 -149.34262 894.89911
5780.0000 -157.34810 -150.15624 7.19186 2.64560 -148.98059 921.02735
5785.0000 -156.94260 -149.39635 7.54625 2.56606 -150.26641 849.46224
5790.0000 -157.30022 -150.88390 6.41632 2.64647 -148.96660 905.31808
5795.0000 -157.80202 -150.86432 6.93770 2.55793 -150.39797 807.85162
5800.0000 -158.29112 -150.62922 7.66189 2.58621 -149.94077 868.31517
5805.0000 -158.28186 -151.18791 7.09395 2.51866 -151.03282 829.58241
5810.0000 -159.27025 -150.52830 8.74195 2.49472 -151.41978 816.85211
5815.0000 -157.75330 -150.53168 7.22161 2.54340 -150.63279 856.72111
5820.0000 -158.56394 -151.70037 6.86357 2.50894 -151.18990 848.68929
5825.0000 -158.58084 -152.90929 5.67154 2.45567 -152.05105 780.74428
5830.0000 -158.68650 -150.73141 7.95509 2.44102 -152.28788 746.30933
5835.0000 -157.01024 -149.90393 7.10631 2.59734 -149.76074 904.91249
5840.0000 -155.98598 -147.65853 8.32745 2.63462 -149.15808 887.17830
5845.0000 -156.58926 -149.25740 7.33186 2.68752 -148.30297 945.65385
5850.0000 -156.16486 -148.77306 7.39180 2.65206 -148.87617 916.24156
5855.0000 -157.55326 -149.55062 8.00264 2.65311 -148.85913 893.90486
5860.0000 -155.41472 -147.89688 7.51784 2.66477 -148.67073 927.65178
5865.0000 -155.88313 -149.15650 6.72663 2.62873 -149.25330 907.05052
5870.0000 -155.20916 -147.68939 7.51977 2.71585 -147.84493 950.97033
5875.0000 -155.53695 -148.37256 7.16439 2.64220 -149.03557 893.97868
5880.0000 -157.51006 -149.69717 7.81288 2.64052 -149.06265 908.38317
5885.0000 -157.60924 -149.20111 8.40812 2.61215 -149.52144 860.00600
5890.0000 -158.16374 -150.80632 7.35742 2.61527 -149.47090 914.92639
5895.0000 -155.88852 -149.18437 6.70414 2.58650 -149.93596 885.75146
5900.0000 -156.23173 -149.20121 7.03052 2.62494 -149.31462 884.06045
5905.0000 -156.60280 -149.75249 6.85031 2.62628 -149.29287 924.55756
5910.0000 -156.98594 -149.52271 7.46323 2.62479 -149.31701 892.09122
5915.0000 -157.26491 -150.12203 7.14288 2.62636 -149.29168 923.91310
5920.0000 -157.53859 -150.46414 7.07445 2.49534 -151.40971 798.09127
5925.0000 -158.03044 -151.02789 7.00255 2.58236 -150.00301 884.91145
5930.0000 -156.66388 -150.28543 6.37846 2.54155 -150.66263 814.74582
5935.0000 -155.96899 -149.31052 6.65847 2.64541 -148.98362 883.93652
5940.0000 -156.60006 -148.13607 8.46399 2.65645 -148.80527 869.76234
5945.0000 -156.61240 -149.62108 6.99132 2.62226 -149.35785 857.93572
5950.0000 -156.83931 -150.34442 6.49489 2.54266 -150.64481 801.82742
5955.0000 -158.70799 -150.25182 8.45617 2.57521 -150.11856 861.71069
5960.0000 -159.15405 -151.96526 7.18879 2.50017 -151.33167 813.42437
5965.0000 -158.34558 -151.74402 6.60156 2.47075 -151.80735 799.05015
5970.0000 -158.18793 -149.88632 8.30161 2.55590 -150.43077 834.00970
5975.0000 -156.66801 -149.72536 6.94264 2.61429 -149.48669 874.39346
5980.0000 -157.37524 -150.07755 7.29769 2.56222 -150.32856 871.09363
5985.0000 -157.69828 -150.56395 7.13432 2.61237 -149.51780 889.33186
5990.0000 -157.54869 -150.09094 7.45775 2.58239 -150.00248 880.93875
5995.0000 -157.73218 -150.77940 6.95278 2.54437 -150.61709 827.16213
6000.0000 -158.31990 -150.94761 7.37229 2.54383 -150.62585 839.15869
MELTING PROCESS: loop number 25 T-loop= 907.00000000000000
main_MD> interactions number 25 at Temperature= 907.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.23642 1.93057 -1.75231
force_rgl> df(natom) -0.67043 -1.51123 0.83720
6005.0000 -157.28012 -150.60697 6.67314 2.56128 -150.34378 821.97646
6010.0000 -156.60815 -149.87482 6.73333 2.59839 -149.74388 890.79337
6015.0000 -156.91233 -149.88512 7.02721 2.58848 -149.90395 853.77582
6020.0000 -157.94556 -150.17555 7.77001 2.57377 -150.14178 840.36089
6025.0000 -156.42850 -148.75227 7.67623 2.62375 -149.33378 907.16155
6030.0000 -158.20675 -150.80576 7.40099 2.55291 -150.47910 841.73095
6035.0000 -156.66835 -150.11456 6.55379 2.58975 -149.88346 874.79063
6040.0000 -156.29152 -148.91656 7.37496 2.65086 -148.89560 903.34478
6045.0000 -155.92687 -147.82675 8.10013 2.64237 -149.03286 915.12577
6050.0000 -155.76539 -147.53796 8.22743 2.68346 -148.36863 934.07162
6055.0000 -156.66240 -148.20693 8.45548 2.72202 -147.74511 993.73725
6060.0000 -157.28672 -150.14489 7.14184 2.63741 -149.11309 875.07992
6065.0000 -157.36537 -148.69472 8.67066 2.62059 -149.38487 881.35424
6070.0000 -154.83088 -147.41279 7.41809 2.71807 -147.80903 948.76669
6075.0000 -154.41368 -145.91660 8.49708 2.78872 -146.66692 980.67985
6080.0000 -156.70727 -148.58896 8.11831 2.72098 -147.76196 967.71414
6085.0000 -155.44983 -148.96115 6.48869 2.65958 -148.75457 912.10576
6090.0000 -155.76869 -147.98377 7.78492 2.69811 -148.13166 998.18355
6095.0000 -156.78345 -149.24834 7.53510 2.66296 -148.69997 917.60395
6100.0000 -156.90832 -150.36250 6.54582 2.58212 -150.00681 870.32999
6105.0000 -156.34423 -147.86581 8.47842 2.64788 -148.94371 917.84487
6110.0000 -156.40655 -149.21288 7.19367 2.64380 -149.00967 909.88120
6115.0000 -155.17520 -145.87350 9.30169 2.70502 -148.02003 945.46019
6120.0000 -154.56476 -146.10650 8.45826 2.82683 -146.05076 997.42683
6125.0000 -155.50234 -147.94392 7.55842 2.74839 -147.31892 970.70270
6130.0000 -155.67581 -147.68381 7.99199 2.71743 -147.81945 959.49682
6135.0000 -157.29034 -148.32578 8.96456 2.63562 -149.14190 899.04320
6140.0000 -155.99742 -147.81118 8.18624 2.70237 -148.06290 946.04042
6145.0000 -155.65129 -148.14853 7.50276 2.71281 -147.89402 960.85455
6150.0000 -156.94652 -148.30670 8.63983 2.64859 -148.93233 882.17367
6155.0000 -157.28455 -149.20994 8.07461 2.66228 -148.71090 926.75405
6160.0000 -155.70416 -147.80363 7.90053 2.69814 -148.13116 938.79531
6165.0000 -157.47218 -148.97075 8.50143 2.64666 -148.96354 894.68022
6170.0000 -157.63748 -150.60016 7.03731 2.57846 -150.06594 871.47443
6175.0000 -158.79319 -151.07278 7.72041 2.52784 -150.88428 808.11017
6180.0000 -157.54845 -149.34775 8.20070 2.54951 -150.53398 843.06093
6185.0000 -154.56660 -147.30501 7.26159 2.73921 -147.46727 932.65327
6190.0000 -155.14127 -146.63376 8.50751 2.76426 -147.06240 972.44445
6195.0000 -156.40229 -148.77299 7.62930 2.69647 -148.15828 928.06226
6200.0000 -155.65607 -148.77420 6.88187 2.64621 -148.97076 915.19140
6205.0000 -156.40652 -148.77709 7.62943 2.59453 -149.80624 883.74816
6210.0000 -154.73306 -147.13298 7.60008 2.73093 -147.60118 986.05089
6215.0000 -155.89705 -148.05964 7.83741 2.69184 -148.23308 961.92173
6220.0000 -157.04365 -149.75888 7.28477 2.65307 -148.85988 914.60671
6225.0000 -156.37676 -149.42312 6.95364 2.61500 -149.47527 880.64056
6230.0000 -155.69689 -148.50650 7.19040 2.62330 -149.34115 905.04732
6235.0000 -157.09209 -148.87278 8.21930 2.63874 -149.09151 892.32880
6240.0000 -157.54937 -150.25247 7.29691 2.58682 -149.93087 837.05084
6245.0000 -157.59481 -149.91931 7.67550 2.59714 -149.76400 869.56490
6250.0000 -156.20134 -148.75494 7.44640 2.60677 -149.60842 839.20133
MELTING PROCESS: loop number 26 T-loop= 932.00000000000000
main_MD> interactions number 26 at Temperature= 932.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.28231 1.73054 0.00281
force_rgl> df(natom) -0.65001 -0.56659 -3.27039
6255.0000 -157.36139 -150.00466 7.35672 2.59650 -149.77431 882.24447
6260.0000 -158.24516 -149.83767 8.40748 2.57972 -150.04570 837.49764
6265.0000 -156.04504 -148.00646 8.03858 2.70123 -148.08135 958.36754
6270.0000 -156.27879 -149.86672 6.41207 2.63787 -149.10563 882.56975
6275.0000 -156.33073 -149.35544 6.97529 2.63056 -149.22380 892.50273
6280.0000 -156.34080 -148.65328 7.68752 2.62102 -149.37803 905.56044
6285.0000 -155.37078 -147.71168 7.65910 2.65544 -148.82145 948.24454
6290.0000 -156.94199 -147.96880 8.97319 2.71093 -147.92453 961.29220
6295.0000 -155.20794 -146.70117 8.50676 2.73049 -147.60820 988.85112
6300.0000 -156.03298 -148.92277 7.11021 2.64020 -149.06786 923.48989
6305.0000 -157.19607 -150.17718 7.01888 2.64062 -149.06114 904.50695
6310.0000 -155.97999 -148.63764 7.34235 2.66106 -148.73065 940.36516
6315.0000 -155.92181 -149.11371 6.80809 2.66641 -148.64415 932.98868
6320.0000 -156.70927 -148.41823 8.29104 2.65374 -148.84900 883.15466
6325.0000 -155.59305 -147.59434 7.99871 2.68383 -148.36258 940.51845
6330.0000 -157.02684 -148.41874 8.60810 2.62567 -149.30279 873.28115
6335.0000 -155.09883 -148.50457 6.59426 2.68382 -148.36280 931.76838
6340.0000 -156.41521 -147.25914 9.15607 2.68975 -148.26694 917.40806
6345.0000 -155.65136 -147.38237 8.26899 2.76678 -147.02151 1022.68380
6350.0000 -154.90012 -147.91807 6.98205 2.72976 -147.62013 1006.76378
6355.0000 -155.35612 -148.27451 7.08161 2.74109 -147.43687 930.50360
6360.0000 -154.55145 -146.96145 7.58999 2.71397 -147.87537 937.07776
6365.0000 -156.20331 -148.57686 7.62645 2.66501 -148.66688 928.72662
6370.0000 -155.57525 -148.49533 7.07993 2.70524 -148.01650 942.78017
6375.0000 -155.42186 -147.79336 7.62850 2.68720 -148.30806 919.03356
6380.0000 -153.87353 -146.50883 7.36470 2.69563 -148.17180 898.37816
6385.0000 -154.85882 -146.05709 8.80172 2.83218 -145.96434 1025.16671
6390.0000 -154.70878 -146.35649 8.35229 2.84962 -145.68234 1022.17837
6395.0000 -152.61898 -144.61052 8.00845 2.86412 -145.44790 1058.50758
6400.0000 -158.36201 -149.58534 8.77667 2.72139 -147.75542 950.28713
6405.0000 -156.44528 -147.21216 9.23312 2.64248 -149.03104 909.05630
6410.0000 -154.98736 -146.75643 8.23094 2.73394 -147.55254 971.49455
6415.0000 -155.94397 -147.81391 8.13005 2.74418 -147.38691 973.27091
6420.0000 -155.54484 -147.77660 7.76824 2.74324 -147.40212 964.48471
6425.0000 -157.57253 -151.11364 6.45889 2.68384 -148.36235 921.75323
6430.0000 -158.19308 -150.82780 7.36528 2.54509 -150.60556 848.63576
6435.0000 -158.98982 -151.02864 7.96118 2.53457 -150.77558 861.21911
6440.0000 -156.78231 -150.36010 6.42221 2.60030 -149.71288 888.13862
6445.0000 -154.39852 -146.89748 7.50105 2.68409 -148.35841 928.67852
6450.0000 -156.67009 -148.65479 8.01530 2.70421 -148.03310 951.31579
6455.0000 -156.57712 -147.82671 8.75041 2.70594 -148.00508 945.08939
6460.0000 -158.07265 -150.32320 7.74945 2.63607 -149.13464 879.08604
6465.0000 -156.22016 -149.45141 6.76874 2.57969 -150.04619 818.22890
6470.0000 -155.82543 -147.79732 8.02811 2.67070 -148.57485 876.99504
6475.0000 -155.72573 -147.30092 8.42480 2.75855 -147.15459 941.75219
6480.0000 -153.92480 -144.16714 9.75766 2.82132 -146.13993 1040.04608
6485.0000 -154.90117 -145.05254 9.84863 2.88295 -145.14348 1074.40559
6490.0000 -155.10075 -147.41882 7.68193 2.74936 -147.30324 991.15634
6495.0000 -158.12699 -148.03185 10.09513 2.74356 -147.39690 969.70847
6500.0000 -156.52539 -149.02833 7.49705 2.64485 -148.99275 866.24231
MELTING PROCESS: loop number 27 T-loop= 957.00000000000000
main_MD> interactions number 27 at Temperature= 957.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.32662 0.46322 1.08335
force_rgl> df(natom) -0.70416 -1.04726 -3.62079
6505.0000 -156.68236 -148.76640 7.91596 2.70854 -147.96308 918.56617
6510.0000 -155.89498 -148.35542 7.53956 2.62031 -149.38938 876.43348
6515.0000 -154.95058 -146.73771 8.21287 2.70804 -147.97121 939.49464
6520.0000 -156.71967 -147.08144 9.63823 2.79786 -146.51910 1016.99480
6525.0000 -155.24548 -147.89807 7.34741 2.69426 -148.19394 955.76990
6530.0000 -156.58996 -149.79150 6.79846 2.70840 -147.96545 960.63669
6535.0000 -156.30756 -147.16107 9.14648 2.67524 -148.50146 942.84824
6540.0000 -156.86115 -148.93035 7.93080 2.72736 -147.65890 970.73185
6545.0000 -157.31515 -148.53997 8.77518 2.67515 -148.50297 934.46804
6550.0000 -155.33805 -146.17822 9.15983 2.69907 -148.11621 967.87447
6555.0000 -154.55259 -147.38899 7.16361 2.76902 -146.98536 981.99023
6560.0000 -157.31772 -149.27584 8.04188 2.71485 -147.86110 943.04040
6565.0000 -153.78371 -147.16632 6.61738 2.68504 -148.34296 944.85157
6570.0000 -155.55287 -147.63843 7.91444 2.72113 -147.75959 947.67387
6575.0000 -155.09730 -148.31087 6.78643 2.69693 -148.15071 970.36933
6580.0000 -155.37533 -148.92872 6.44661 2.66330 -148.69445 896.74903
6585.0000 -154.56091 -146.89330 7.66761 2.76400 -147.06656 987.71661
6590.0000 -155.64085 -147.47999 8.16086 2.77708 -146.85511 979.99126
6595.0000 -153.54259 -144.61658 8.92601 2.81874 -146.18154 1025.27203
6600.0000 -153.96524 -146.03373 7.93151 2.83337 -145.94505 1027.28731
6605.0000 -154.63478 -145.37024 9.26454 2.81855 -146.18472 1011.96225
6610.0000 -156.77771 -147.24287 9.53484 2.79515 -146.56302 987.14845
6615.0000 -154.63541 -146.93651 7.69890 2.79060 -146.63650 982.33631
6620.0000 -156.72322 -149.80239 6.92083 2.71089 -147.92508 942.71274
6625.0000 -155.08981 -146.56711 8.52270 2.68899 -148.27913 946.01891
6630.0000 -157.09950 -147.72375 9.37575 2.73992 -147.45575 943.09352
6635.0000 -154.48939 -146.35703 8.13236 2.79501 -146.56521 994.29513
6640.0000 -156.20288 -148.62019 7.58268 2.73219 -147.58082 963.98278
6645.0000 -156.34640 -147.97006 8.37635 2.67286 -148.53993 928.13503
6650.0000 -155.87717 -147.85986 8.01732 2.73791 -147.48833 963.89226
6655.0000 -156.64173 -149.22354 7.41819 2.70361 -148.04288 934.25017
6660.0000 -156.51978 -148.80291 7.71687 2.70836 -147.96609 956.66737
6665.0000 -156.90353 -148.80335 8.10018 2.64121 -149.05166 908.92340
6670.0000 -156.72619 -147.98313 8.74306 2.67568 -148.49441 945.78210
6675.0000 -156.53163 -148.22008 8.31155 2.72102 -147.76128 979.84021
6680.0000 -155.79364 -147.48554 8.30809 2.70801 -147.97166 946.00186
6685.0000 -155.52936 -147.34518 8.18418 2.71994 -147.77887 959.06364
6690.0000 -156.15429 -147.62128 8.53301 2.69121 -148.24329 933.32350
6695.0000 -154.81710 -145.24230 9.57480 2.76786 -147.00418 1010.19278
6700.0000 -156.24086 -145.59917 10.64168 2.85398 -145.61196 1059.48918
6705.0000 -156.10184 -148.18300 7.91883 2.71470 -147.86352 959.38756
6710.0000 -155.71236 -148.31857 7.39380 2.65963 -148.75385 897.52326
6715.0000 -156.99953 -149.80346 7.19607 2.63185 -149.20290 903.33472
6720.0000 -155.40096 -146.99552 8.40544 2.66881 -148.60546 924.78088
6725.0000 -154.39775 -146.71740 7.68035 2.74728 -147.33687 973.49989
6730.0000 -155.99526 -147.26438 8.73088 2.76463 -147.05639 1000.65713
6735.0000 -156.11628 -145.89237 10.22392 2.77994 -146.80888 991.38580
6740.0000 -154.79062 -146.78486 8.00576 2.79579 -146.55259 1019.22535
6745.0000 -154.80118 -146.94929 7.85190 2.79612 -146.54734 983.58229
6750.0000 -154.59645 -145.51213 9.08432 2.78558 -146.71762 1005.25223
MELTING PROCESS: loop number 28 T-loop= 982.00000000000000
main_MD> interactions number 28 at Temperature= 982.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.55514 -1.71996 -1.66033
force_rgl> df(natom) 3.12959 1.58983 5.15409
6755.0000 -156.07874 -147.66512 8.41362 2.80274 -146.44018 1009.38264
6760.0000 -156.07001 -147.64967 8.42033 2.73657 -147.50990 971.82071
6765.0000 -155.09779 -147.38533 7.71246 2.75721 -147.17635 953.94073
6770.0000 -155.26817 -147.01476 8.25341 2.73407 -147.55041 933.64453
6775.0000 -156.38999 -147.46979 8.92020 2.76002 -147.13087 988.51625
6780.0000 -154.78359 -147.10021 7.68338 2.73894 -147.47170 969.32325
6785.0000 -154.81054 -147.57343 7.23711 2.72842 -147.64176 945.53194
6790.0000 -155.11686 -146.82387 8.29299 2.77898 -146.82442 986.95933
6795.0000 -156.82560 -148.43345 8.39215 2.75530 -147.20711 1018.90052
6800.0000 -154.43146 -147.86227 6.56919 2.61656 -149.45001 936.96417
6805.0000 -156.76117 -149.15942 7.60175 2.67906 -148.43968 933.93530
6810.0000 -156.45944 -148.06023 8.39921 2.70983 -147.94228 942.59717
6815.0000 -156.64710 -147.97014 8.67697 2.73221 -147.58053 985.10969
6820.0000 -156.02501 -148.52520 7.49981 2.70382 -148.03947 974.28292
6825.0000 -156.08743 -146.25655 9.83088 2.69846 -148.12602 941.87943
6830.0000 -156.95140 -149.11366 7.83774 2.70391 -148.03798 936.40768
6835.0000 -155.47375 -147.08510 8.38865 2.64269 -149.02763 886.57439
6840.0000 -156.75087 -147.62964 9.12123 2.78584 -146.71340 996.23494
6845.0000 -156.29397 -149.09024 7.20372 2.70028 -148.09657 946.45299
6850.0000 -155.90800 -147.66768 8.24032 2.62099 -149.37849 916.36278
6855.0000 -153.96957 -145.58828 8.38129 2.81151 -146.29853 1019.27059
6860.0000 -154.78071 -145.56215 9.21857 2.81248 -146.28274 1011.84102
6865.0000 -155.79471 -146.19463 9.60008 2.81478 -146.24556 1008.46322
6870.0000 -155.48322 -145.60256 9.88066 2.79744 -146.52589 1008.38973
6875.0000 -156.25159 -148.24756 8.00403 2.75643 -147.18887 989.96978
6880.0000 -155.16922 -146.73915 8.43007 2.70240 -148.06233 959.82369
6885.0000 -155.37586 -146.62827 8.74759 2.79306 -146.59680 984.99329
6890.0000 -155.30142 -146.13705 9.16437 2.79756 -146.52399 1028.09107
6895.0000 -156.78586 -147.17300 9.61285 2.82251 -146.12061 1030.46699
6900.0000 -155.30521 -147.50422 7.80099 2.78767 -146.68379 1004.75540
6905.0000 -156.82353 -148.08332 8.74021 2.71046 -147.93214 944.36094
6910.0000 -155.00189 -147.52249 7.47940 2.71276 -147.89481 913.93275
6915.0000 -153.86627 -145.22034 8.64593 2.85932 -145.52558 1028.30984
6920.0000 -153.99887 -146.73533 7.26354 2.83556 -145.90968 983.86829
6925.0000 -154.86290 -146.17714 8.68576 2.79382 -146.58453 1025.61074
6930.0000 -155.16076 -146.30203 8.85873 2.90663 -144.76068 1085.88517
6935.0000 -153.62433 -144.85034 8.77400 2.85141 -145.65347 1036.67230
6940.0000 -154.86385 -146.70878 8.15507 2.81677 -146.21338 1004.75399
6945.0000 -155.03415 -147.87860 7.15555 2.74678 -147.34491 959.26491
6950.0000 -154.85265 -146.89928 7.95337 2.80540 -146.39729 986.29760
6955.0000 -156.11670 -147.82846 8.28824 2.77615 -146.87011 1008.32416
6960.0000 -156.14965 -147.44507 8.70458 2.65288 -148.86294 925.46663
6965.0000 -153.84160 -147.26865 6.57295 2.77726 -146.85221 983.75398
6970.0000 -155.56054 -147.39185 8.16869 2.76611 -147.03234 986.37132
6975.0000 -153.08665 -144.49502 8.59163 2.83662 -145.89258 1036.19145
6980.0000 -153.81619 -145.33107 8.48512 2.89933 -144.87878 1069.64475
6985.0000 -158.08268 -150.13953 7.94315 2.72297 -147.72988 941.48347
6990.0000 -155.64489 -148.52473 7.12016 2.63407 -149.16708 906.43618
6995.0000 -155.36262 -146.48445 8.87817 2.75890 -147.14894 963.70752
7000.0000 -154.36818 -144.87564 9.49253 2.86908 -145.36774 1095.31736
MELTING PROCESS: loop number 29 T-loop= 1007.0000000000000
main_MD> interactions number 29 at Temperature= 1007.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.98660 2.37528 1.45770
force_rgl> df(natom) -1.20700 -1.48777 -2.81897
7005.0000 -154.43466 -146.09925 8.33541 2.84953 -145.68388 1080.32912
7010.0000 -153.20398 -144.75027 8.45371 2.85703 -145.56254 1066.08071
7015.0000 -154.82590 -146.59029 8.23561 2.88381 -145.12965 1063.02305
7020.0000 -155.20549 -146.99839 8.20710 2.73324 -147.56375 968.08247
7025.0000 -155.89098 -147.94414 7.94684 2.72301 -147.72922 963.45002
7030.0000 -157.33504 -149.74472 7.59032 2.63380 -149.17140 883.64292
7035.0000 -156.17948 -145.37310 10.80637 2.78416 -146.74058 1029.24178
7040.0000 -156.80711 -149.37531 7.43181 2.71972 -147.78229 942.36365
7045.0000 -154.27315 -146.47179 7.80136 2.75312 -147.24244 994.17437
7050.0000 -154.48867 -145.34775 9.14092 2.81591 -146.22738 1018.91816
7055.0000 -154.45805 -144.96489 9.49316 2.84098 -145.82201 1017.31817
7060.0000 -155.73202 -146.40836 9.32366 2.87967 -145.19656 1047.28993
7065.0000 -154.96178 -147.45702 7.50476 2.76162 -147.10499 966.46537
7070.0000 -154.11335 -146.54693 7.56642 2.76413 -147.06444 960.69626
7075.0000 -154.00984 -146.09015 7.91969 2.82560 -146.07063 1035.46219
7080.0000 -154.15152 -145.41405 8.73746 2.85448 -145.60379 1033.05253
7085.0000 -154.55646 -143.66249 10.89397 2.91251 -144.66572 1107.65080
7090.0000 -154.16669 -144.30208 9.86461 2.90323 -144.81562 1093.12845
7095.0000 -153.27331 -145.63589 7.63742 2.89134 -145.00799 1057.49297
7100.0000 -154.35793 -145.43285 8.92507 2.88223 -145.15512 1045.22243
7105.0000 -153.91828 -146.04475 7.87352 2.84797 -145.70911 1025.08956
7110.0000 -153.58853 -145.35726 8.23127 2.78071 -146.79641 1007.30037
7115.0000 -153.91183 -145.67459 8.23724 2.80478 -146.40723 993.65022
7120.0000 -155.05712 -147.50371 7.55341 2.80616 -146.38493 1005.74107
7125.0000 -156.85884 -148.83967 8.01917 2.70976 -147.94339 963.93019
7130.0000 -154.29751 -146.62796 7.66955 2.76305 -147.08188 1005.66129
7135.0000 -155.42647 -147.01590 8.41057 2.80524 -146.39982 1022.84485
7140.0000 -156.12933 -148.50016 7.62917 2.68939 -148.27263 935.10497
7145.0000 -156.75531 -148.68028 8.07504 2.67971 -148.42910 924.26628
7150.0000 -155.37827 -147.65439 7.72388 2.66946 -148.59492 943.59672
7155.0000 -156.81350 -147.85503 8.95847 2.66942 -148.59555 929.06336
7160.0000 -156.57662 -147.78434 8.79228 2.78171 -146.78021 1008.30496
7165.0000 -154.35566 -146.30893 8.04674 2.83618 -145.89963 1033.28979
7170.0000 -156.87785 -147.87737 9.00048 2.81234 -146.28509 1023.01779
7175.0000 -155.74297 -146.67777 9.06520 2.78056 -146.79880 983.71333
7180.0000 -156.70149 -146.95500 9.74649 2.81231 -146.28558 1017.87558
7185.0000 -154.89404 -146.45723 8.43681 2.78071 -146.79635 1045.08198
7190.0000 -153.47031 -145.72068 7.74963 2.82563 -146.07014 1032.55316
7195.0000 -153.53391 -145.46453 8.06938 2.86857 -145.37600 1035.93841
7200.0000 -154.47327 -143.59619 10.87708 2.91768 -144.58217 1090.00025
7205.0000 -154.41355 -146.63496 7.77859 2.83183 -145.97002 1021.60412
7210.0000 -155.54578 -147.12016 8.42562 2.79793 -146.51794 988.84956
7215.0000 -156.92434 -149.42150 7.50284 2.65015 -148.90702 893.33520
7220.0000 -156.17601 -147.69667 8.47934 2.70779 -147.97523 932.69157
7225.0000 -157.13702 -147.94560 9.19141 2.70967 -147.94481 962.08576
7230.0000 -155.25812 -146.95530 8.30282 2.73562 -147.52532 982.59796
7235.0000 -156.10586 -146.75928 9.34658 2.71337 -147.88508 960.26213
7240.0000 -157.49073 -149.65227 7.83846 2.67318 -148.53478 907.22008
7245.0000 -155.49299 -146.17173 9.32126 2.73805 -147.48605 985.18988
7250.0000 -154.67370 -145.78406 8.88965 2.89878 -144.88769 1068.50283
MELTING PROCESS: loop number 30 T-loop= 1032.0000000000000
main_MD> interactions number 30 at Temperature= 1032.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.07918 0.77214 0.00280
force_rgl> df(natom) 1.53373 2.73907 1.12959
7255.0000 -153.35519 -145.48553 7.86966 2.87714 -145.23753 1053.73292
7260.0000 -154.36852 -145.85463 8.51389 2.91225 -144.66986 1073.28021
7265.0000 -152.59698 -143.93613 8.66085 2.83896 -145.85462 1065.95662
7270.0000 -154.98236 -147.40894 7.57342 2.88474 -145.11465 1078.35753
7275.0000 -155.04471 -147.08800 7.95671 2.74310 -147.40439 967.60496
7280.0000 -154.96520 -146.23768 8.72752 2.77786 -146.84247 983.54350
7285.0000 -155.51785 -145.47060 10.04725 2.81283 -146.27711 1028.47015
7290.0000 -155.38985 -147.58213 7.80771 2.84669 -145.72969 1069.61981
7295.0000 -157.27927 -150.33524 6.94403 2.60374 -149.65725 880.60679
7300.0000 -156.81007 -148.54267 8.26741 2.60949 -149.56431 881.13742
7305.0000 -154.90606 -146.57925 8.32681 2.78601 -146.71068 986.14681
7310.0000 -154.84540 -146.14308 8.70232 2.81455 -146.24926 1025.79055
7315.0000 -155.04309 -147.58037 7.46272 2.80240 -146.44573 1025.34677
7320.0000 -156.08205 -148.13909 7.94296 2.66149 -148.72378 928.42779
7325.0000 -155.52219 -148.09381 7.42839 2.73649 -147.51124 945.16899
7330.0000 -155.28948 -146.14138 9.14810 2.75116 -147.27412 1002.99628
7335.0000 -157.40607 -150.11376 7.29231 2.75475 -147.21605 957.07533
7340.0000 -157.25012 -148.06379 9.18633 2.64124 -149.05108 914.37748
7345.0000 -156.52776 -148.66641 7.86135 2.66467 -148.67239 903.68330
7350.0000 -155.76471 -148.15902 7.60569 2.68220 -148.38899 918.15791
7355.0000 -155.80221 -147.57808 8.22412 2.72985 -147.61868 989.41838
7360.0000 -154.68442 -146.89491 7.78951 2.77572 -146.87707 1016.48985
7365.0000 -155.08209 -145.18882 9.89328 2.83687 -145.88851 1058.37969
7370.0000 -154.31644 -145.98677 8.32967 2.82277 -146.11636 1033.37910
7375.0000 -156.16031 -146.54201 9.61830 2.76753 -147.00946 993.32769
7380.0000 -156.06745 -148.65131 7.41614 2.77046 -146.96202 1005.94521
7385.0000 -153.86981 -145.24648 8.62332 2.80970 -146.32779 1025.25194
7390.0000 -152.96763 -143.95013 9.01750 2.84486 -145.75933 1045.05936
7395.0000 -154.27711 -146.09092 8.18619 2.86780 -145.38853 1038.45480
7400.0000 -155.55027 -147.59096 7.95931 2.77010 -146.96784 982.54544
7405.0000 -155.71498 -148.36272 7.35226 2.77147 -146.94583 992.06749
7410.0000 -156.14609 -147.35361 8.79248 2.71794 -147.81114 931.69636
7415.0000 -153.93040 -144.90560 9.02481 2.86671 -145.40604 1056.24423
7420.0000 -152.01338 -142.96863 9.04474 2.91511 -144.62359 1070.66209
7425.0000 -154.17993 -145.40713 8.77280 2.93632 -144.28074 1117.87928
7430.0000 -156.13017 -147.29338 8.83679 2.78505 -146.72626 990.29068
7435.0000 -154.32834 -145.92207 8.40627 2.80851 -146.34695 1018.75661
7440.0000 -154.47835 -145.21416 9.26419 2.90572 -144.77539 1082.54685
7445.0000 -150.55510 -143.16005 7.39505 2.89310 -144.97944 1069.80490
7450.0000 -152.05641 -143.34841 8.70800 3.01004 -143.08894 1151.48712
7455.0000 -153.45576 -143.59125 9.86451 3.01046 -143.08217 1170.37856
7460.0000 -154.30095 -144.38207 9.91888 2.86041 -145.50797 1049.29897
7465.0000 -156.50418 -147.82975 8.67444 2.82697 -146.04850 1040.04096
7470.0000 -154.46960 -146.33685 8.13275 2.80014 -146.48220 1015.13141
7475.0000 -154.61449 -146.15534 8.45916 2.86680 -145.40469 1041.36293
7480.0000 -153.89911 -146.28394 7.61518 2.83342 -145.94425 1044.42486
7485.0000 -154.70881 -147.12759 7.58122 2.81978 -146.16471 1014.49782
7490.0000 -155.66480 -146.52824 9.13656 2.82460 -146.08685 1052.49393
7495.0000 -155.34241 -146.30652 9.03589 2.80406 -146.41887 1011.77015
7500.0000 -155.76283 -147.82231 7.94052 2.81188 -146.29244 1024.69397
MELTING PROCESS: loop number 31 T-loop= 1057.0000000000000
main_MD> interactions number 31 at Temperature= 1057.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.23542 -0.07033 -0.01669
force_rgl> df(natom) 2.28090 4.24105 -0.88285
7505.0000 -157.29225 -147.08476 10.20749 2.71909 -147.79251 963.69281
7510.0000 -156.30192 -147.88630 8.41562 2.70155 -148.07608 987.56719
7515.0000 -155.83077 -147.33752 8.49325 2.68908 -148.27769 960.97726
7520.0000 -154.79497 -146.84471 7.95026 2.79589 -146.55097 1002.76045
7525.0000 -154.11326 -145.30208 8.81118 2.81510 -146.24050 1023.54675
7530.0000 -154.02588 -143.85992 10.16596 2.94418 -144.15365 1108.23554
7535.0000 -152.99174 -143.88979 9.10195 2.97604 -143.63869 1137.17061
7540.0000 -153.27045 -146.26182 7.00863 2.94715 -144.10574 1100.98424
7545.0000 -154.64803 -146.22581 8.42222 2.83522 -145.91509 1027.08385
7550.0000 -153.72879 -145.09703 8.63176 2.82263 -146.11869 1003.88246
7555.0000 -155.47963 -145.57759 9.90204 2.81647 -146.21830 1039.76424
7560.0000 -154.52933 -145.70735 8.82198 2.87864 -145.21325 1090.64297
7565.0000 -153.88344 -144.60943 9.27400 2.90493 -144.78826 1082.82221
7570.0000 -153.35278 -144.36396 8.98882 2.91902 -144.56047 1109.28647
7575.0000 -155.13929 -144.83535 10.30393 2.89634 -144.92709 1093.00653
7580.0000 -154.19249 -145.74813 8.44436 2.90043 -144.86104 1086.76995
7585.0000 -154.65095 -145.92302 8.72793 2.78353 -146.75079 1024.52686
7590.0000 -153.17048 -143.90903 9.26145 2.89831 -144.89519 1069.77814
7595.0000 -153.64198 -144.17800 9.46399 2.90452 -144.79480 1104.10275
7600.0000 -152.81902 -144.44894 8.37008 2.88729 -145.07343 1051.69068
7605.0000 -156.76127 -146.88560 9.87568 2.86267 -145.47140 1053.95252
7610.0000 -154.43211 -144.47177 9.96035 2.90612 -144.76903 1084.08729
7615.0000 -152.13988 -143.76402 8.37586 2.94030 -144.21641 1084.63049
7620.0000 -154.91405 -144.98125 9.93280 2.91765 -144.58258 1079.94812
7625.0000 -153.96981 -145.97152 7.99828 2.85721 -145.55974 1101.86187
7630.0000 -151.87687 -143.69022 8.18666 2.96546 -143.80966 1106.94925
7635.0000 -153.66451 -143.54381 10.12070 2.88888 -145.04772 1071.29872
7640.0000 -154.12146 -145.26728 8.85418 2.91677 -144.59675 1114.30903
7645.0000 -154.48195 -145.90093 8.58102 2.86200 -145.48218 1061.17055
7650.0000 -153.23583 -144.28673 8.94911 2.91302 -144.65739 1086.26027
7655.0000 -156.60106 -149.67070 6.93036 2.82550 -146.07226 1049.31790
7660.0000 -156.76049 -148.68731 8.07318 2.67069 -148.57495 947.10632
7665.0000 -153.80556 -145.44779 8.35777 2.78681 -146.69775 1004.49030
7670.0000 -155.06880 -144.67224 10.39656 2.87964 -145.19706 1051.86536
7675.0000 -154.52264 -145.59351 8.92913 2.88856 -145.05280 1099.60730
7680.0000 -155.88270 -147.55178 8.33091 2.84655 -145.73199 1042.88993
7685.0000 -153.91520 -144.30502 9.61019 2.80600 -146.38753 1011.22543
7690.0000 -153.62241 -144.85985 8.76256 2.92789 -144.41702 1117.55979
7695.0000 -156.85086 -146.55648 10.29439 2.86717 -145.39866 1048.08612
7700.0000 -154.84688 -146.93614 7.91075 2.80824 -146.35125 1008.55143
7705.0000 -155.60870 -147.71139 7.89732 2.69829 -148.12880 936.22985
7710.0000 -154.86938 -145.98938 8.88000 2.73301 -147.56756 971.69957
7715.0000 -156.40173 -149.59900 6.80273 2.76319 -147.07969 1013.09975
7720.0000 -155.83447 -146.90493 8.92953 2.68809 -148.29376 931.65861
7725.0000 -155.63127 -147.49844 8.13283 2.82052 -146.15276 1035.57479
7730.0000 -154.04332 -143.58606 10.45727 2.78033 -146.80253 997.05646
7735.0000 -153.21691 -145.27990 7.93701 2.93201 -144.35045 1134.15604
7740.0000 -154.12515 -144.96777 9.15738 2.88265 -145.14842 1093.48871
7745.0000 -155.24575 -146.22545 9.02030 2.89292 -144.98233 1076.63129
7750.0000 -154.41411 -145.15072 9.26338 2.79444 -146.57436 1006.76572
MELTING PROCESS: loop number 32 T-loop= 1082.0000000000000
main_MD> interactions number 32 at Temperature= 1082.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.76586 -0.96697 1.42402
force_rgl> df(natom) -0.37354 -3.20569 0.70312
7755.0000 -154.04809 -144.38742 9.66068 2.92815 -144.41277 1133.78106
7760.0000 -154.11492 -144.71194 9.40298 2.88375 -145.13059 1064.85806
7765.0000 -154.02607 -143.46640 10.55967 2.85648 -145.57155 1044.60527
7770.0000 -152.13331 -143.96264 8.17067 2.96214 -143.86335 1123.05974
7775.0000 -154.04506 -145.46648 8.57858 2.80857 -146.34604 1016.87888
7780.0000 -151.90998 -144.42830 7.48169 2.91212 -144.67201 1072.78731
7785.0000 -153.95221 -144.01943 9.93278 2.89008 -145.02830 1072.19827
7790.0000 -153.04845 -143.77244 9.27600 2.96951 -143.74417 1115.75407
7795.0000 -153.40909 -143.76029 9.64880 2.99987 -143.25332 1123.15092
7800.0000 -151.88233 -142.18285 9.69949 3.03809 -142.63557 1167.29650
7805.0000 -152.54287 -144.86675 7.67612 3.02096 -142.91249 1108.99085
7810.0000 -153.32038 -144.24811 9.07227 2.99413 -143.34621 1108.15280
7815.0000 -153.88828 -144.22703 9.66124 2.92302 -144.49585 1094.39588
7820.0000 -152.98581 -142.65746 10.32834 2.93460 -144.30849 1103.88256
7825.0000 -156.62059 -147.65902 8.96158 2.91426 -144.63735 1078.43013
7830.0000 -156.14778 -147.57885 8.56893 2.77245 -146.92991 982.23964
7835.0000 -154.31430 -146.54889 7.76540 2.74180 -147.42540 969.70147
7840.0000 -153.72338 -145.49858 8.22480 2.81542 -146.23523 1015.06735
7845.0000 -154.59100 -148.25977 6.33122 2.78281 -146.76252 1018.21284
7850.0000 -152.65284 -143.54343 9.10941 2.84446 -145.76577 1044.02363
7855.0000 -153.23291 -144.20667 9.02625 2.99812 -143.28170 1125.21851
7860.0000 -152.87980 -144.11715 8.76265 2.98402 -143.50964 1119.40409
7865.0000 -152.39110 -143.59743 8.79366 2.97717 -143.62038 1147.10571
7870.0000 -155.16324 -146.78723 8.37601 2.93259 -144.34105 1087.17789
7875.0000 -156.03444 -146.24647 9.78796 2.85430 -145.60669 1061.55238
7880.0000 -155.41679 -146.24715 9.16964 2.81434 -146.25270 1041.94137
7885.0000 -154.74433 -146.64127 8.10305 2.79364 -146.58730 1009.71140
7890.0000 -156.01292 -147.21985 8.79307 2.74045 -147.44727 1029.48035
7895.0000 -155.80958 -146.91152 8.89806 2.80242 -146.44537 1007.44786
7900.0000 -155.71609 -147.09010 8.62599 2.77854 -146.83148 986.49094
7905.0000 -154.86057 -145.48764 9.37294 2.87705 -145.23888 1058.73828
7910.0000 -155.50548 -146.37899 9.12650 2.80503 -146.40316 1023.81493
7915.0000 -154.47733 -146.16488 8.31245 2.78899 -146.66255 1008.33774
7920.0000 -154.00059 -145.20748 8.79311 2.82801 -146.03170 1058.83470
7925.0000 -152.82045 -143.84276 8.97769 2.87949 -145.19953 1054.01435
7930.0000 -152.56651 -143.86342 8.70309 2.91981 -144.54764 1094.24765
7935.0000 -153.59026 -144.76380 8.82646 2.92139 -144.52206 1089.92122
7940.0000 -154.89331 -146.98763 7.90568 2.87068 -145.34194 1040.93018
7945.0000 -153.04186 -144.56363 8.47823 2.86045 -145.50730 1015.98169
7950.0000 -153.38428 -144.33920 9.04507 2.91724 -144.58915 1055.61190
7955.0000 -152.61629 -142.71109 9.90520 2.99213 -143.37844 1132.68338
7960.0000 -154.46172 -144.96417 9.49754 2.87461 -145.27834 1036.07187
7965.0000 -155.38217 -146.09343 9.28875 2.80547 -146.39607 996.08951
7970.0000 -155.09418 -146.45459 8.63959 2.83154 -145.97458 1055.21243
7975.0000 -154.84468 -144.58156 10.26312 2.87760 -145.23001 1065.73816
7980.0000 -154.91016 -146.05797 8.85219 2.88884 -145.04830 1100.31298
7985.0000 -155.50183 -146.35719 9.14465 2.87862 -145.21351 1063.31968
7990.0000 -153.67425 -146.00896 7.66529 2.83341 -145.94446 1035.92085
7995.0000 -153.48724 -145.35136 8.13588 2.85312 -145.62586 1033.13288
8000.0000 -153.39507 -145.60962 7.78545 2.83202 -145.96689 1022.91634
MELTING PROCESS: loop number 33 T-loop= 1107.0000000000000
main_MD> interactions number 33 at Temperature= 1107.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.20549 4.48450 -1.45154
force_rgl> df(natom) 1.75435 -0.77004 -0.67545
8005.0000 -155.01613 -145.81962 9.19651 2.88497 -145.11089 1074.70537
8010.0000 -153.53749 -144.14661 9.39088 2.85784 -145.54950 1054.43034
8015.0000 -154.78597 -144.51749 10.26847 2.95870 -143.91896 1126.81993
8020.0000 -154.65768 -145.33546 9.32222 2.94079 -144.20848 1109.92530
8025.0000 -155.53467 -146.58884 8.94583 2.81353 -146.26582 1037.13108
8030.0000 -154.17480 -146.00303 8.17177 2.78763 -146.68445 998.29797
8035.0000 -153.03999 -145.19105 7.84894 2.84449 -145.76534 1033.20690
8040.0000 -154.92586 -145.63775 9.28811 2.90004 -144.86721 1056.81303
8045.0000 -153.42795 -143.52437 9.90359 2.94527 -144.13609 1135.59546
8050.0000 -154.47132 -144.72475 9.74657 2.97078 -143.72371 1147.45999
8055.0000 -154.08300 -144.83559 9.24741 2.94006 -144.22031 1097.64419
8060.0000 -153.78753 -145.12890 8.65862 2.86987 -145.35506 1042.39091
8065.0000 -152.30597 -142.68114 9.62483 2.97701 -143.62302 1126.12733
8070.0000 -155.03065 -146.82474 8.20591 2.89982 -144.87075 1083.05310
8075.0000 -154.08565 -146.22919 7.85646 2.83275 -145.95511 1019.19066
8080.0000 -155.58809 -146.46340 9.12470 2.82138 -146.13893 1034.63064
8085.0000 -154.21837 -145.24853 8.96984 2.86034 -145.50901 1047.57213
8090.0000 -154.17744 -144.78886 9.38858 2.92944 -144.39205 1064.94055
8095.0000 -151.57869 -142.37228 9.20640 3.02071 -142.91645 1187.74766
8100.0000 -153.69987 -145.76659 7.93328 2.87974 -145.19549 1091.06648
8105.0000 -154.69944 -144.44797 10.25147 2.95059 -144.05008 1123.28638
8110.0000 -152.72613 -144.48309 8.24304 2.99672 -143.30432 1125.56045
8115.0000 -154.05393 -145.32292 8.73101 2.89520 -144.94547 1080.95266
8120.0000 -151.96216 -141.93642 10.02574 2.91722 -144.58949 1110.59178
8125.0000 -154.49690 -145.87927 8.61763 2.94882 -144.07870 1104.11711
8130.0000 -154.72288 -145.64085 9.08204 2.84586 -145.74323 1024.38564
8135.0000 -153.51006 -144.90765 8.60242 2.88334 -145.13730 1050.61462
8140.0000 -150.66246 -142.92049 7.74197 2.98398 -143.51028 1119.00763
8145.0000 -154.05270 -143.72006 10.33265 2.95736 -143.94054 1115.25392
8150.0000 -152.49694 -144.61130 7.88564 2.99439 -143.34193 1140.88998
8155.0000 -152.76555 -142.25594 10.50961 3.01405 -143.02417 1175.59950
8160.0000 -153.22798 -143.79975 9.42823 3.01706 -142.97545 1198.17940
8165.0000 -154.12127 -145.10109 9.02018 2.87033 -145.34757 1045.55059
8170.0000 -154.41120 -145.39371 9.01749 2.86867 -145.37439 1084.67656
8175.0000 -155.49367 -146.67045 8.82322 2.86271 -145.47070 1092.18097
8180.0000 -155.61198 -147.66343 7.94856 2.76366 -147.07195 992.10232
8185.0000 -154.29338 -145.26294 9.03044 2.85344 -145.62054 1053.06551
8190.0000 -153.71530 -145.71742 7.99788 2.85436 -145.60569 1036.05430
8195.0000 -153.30689 -144.92362 8.38327 2.88688 -145.08003 1063.86657
8200.0000 -154.69489 -145.90229 8.79260 2.84765 -145.71426 1047.71643
8205.0000 -155.99561 -147.13677 8.85884 2.83519 -145.91557 1066.66704
8210.0000 -153.66766 -145.22338 8.44428 2.84112 -145.81972 1039.02027
8215.0000 -154.31963 -145.76059 8.55903 2.89452 -144.95647 1084.79727
8220.0000 -153.82275 -145.47904 8.34371 2.82786 -146.03416 1035.47502
8225.0000 -153.63967 -143.94498 9.69469 2.90487 -144.78922 1076.64322
8230.0000 -153.11874 -143.86441 9.25433 2.95233 -144.02199 1127.15103
8235.0000 -154.14520 -143.78817 10.35703 2.98022 -143.57101 1117.28254
8240.0000 -152.15408 -142.06054 10.09354 3.06061 -142.27140 1184.99442
8245.0000 -151.07948 -141.06213 10.01736 3.10225 -141.59825 1241.24131
8250.0000 -152.15642 -143.12725 9.02917 3.07341 -142.06457 1212.56498
MELTING PROCESS: loop number 34 T-loop= 1132.0000000000000
main_MD> interactions number 34 at Temperature= 1132.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.44525 0.42389 3.23141
force_rgl> df(natom) -3.18254 -0.39651 0.82533
8255.0000 -152.75374 -143.63625 9.11749 3.00056 -143.24229 1167.24212
8260.0000 -155.49523 -146.19317 9.30205 2.87490 -145.27373 1052.61232
8265.0000 -152.85541 -142.18127 10.67415 2.95031 -144.05464 1120.51697
8270.0000 -154.20361 -144.67834 9.52527 2.99270 -143.36927 1144.72766
8275.0000 -153.91445 -144.64681 9.26763 2.86801 -145.38503 1031.89032
8280.0000 -155.50892 -145.90993 9.59899 2.89435 -144.95924 1068.27475
8285.0000 -154.13791 -143.99585 10.14205 2.91516 -144.62277 1077.06565
8290.0000 -154.33021 -143.81719 10.51302 2.96161 -143.87193 1143.01642
8295.0000 -155.38503 -146.31609 9.06894 2.90167 -144.84089 1106.52462
8300.0000 -153.75475 -143.27918 10.47557 2.88561 -145.10051 1097.82224
8305.0000 -152.67273 -143.52718 9.14555 2.98868 -143.43427 1126.91279
8310.0000 -153.91489 -144.52494 9.38995 2.98574 -143.48182 1144.98342
8315.0000 -153.15948 -141.31614 11.84334 3.05491 -142.36363 1172.20158
8320.0000 -152.39671 -141.31210 11.08461 3.16505 -140.58313 1288.60052
8325.0000 -152.98963 -144.44395 8.54568 3.02410 -142.86169 1168.17670
8330.0000 -155.13462 -146.97330 8.16132 2.84347 -145.78184 1050.17976
8335.0000 -151.67433 -143.42810 8.24623 2.92555 -144.45484 1120.95934
8340.0000 -151.99632 -142.08424 9.91208 3.01960 -142.93445 1184.20153
8345.0000 -152.38826 -142.78455 9.60371 3.05199 -142.41081 1181.47851
8350.0000 -151.48409 -144.07535 7.40874 3.04123 -142.58474 1180.39183
8355.0000 -153.35967 -144.15883 9.20085 3.01261 -143.04749 1173.83188
8360.0000 -151.53017 -142.11921 9.41096 2.95805 -143.92948 1130.99287
8365.0000 -151.47904 -142.38131 9.09773 3.09043 -141.78936 1216.45507
8370.0000 -154.04320 -143.16212 10.88108 3.00017 -143.24861 1138.48909
8375.0000 -153.14227 -143.77297 9.36930 2.93442 -144.31152 1128.29718
8380.0000 -151.91899 -143.20005 8.71894 3.00487 -143.17257 1141.10441
8385.0000 -154.59764 -145.63689 8.96074 2.85477 -145.59905 1017.28825
8390.0000 -154.64488 -146.25271 8.39216 2.86573 -145.42187 1053.41436
8395.0000 -153.94104 -142.82547 11.11557 2.96184 -143.86818 1106.65100
8400.0000 -152.61276 -144.78578 7.82698 2.99931 -143.26241 1107.11704
8405.0000 -153.51855 -145.62230 7.89624 2.90234 -144.83010 1087.38684
8410.0000 -153.96771 -143.99564 9.97207 2.88862 -145.05191 1047.85380
8415.0000 -153.47709 -143.64255 9.83454 2.94605 -144.12339 1105.35690
8420.0000 -155.09405 -145.28785 9.80620 2.95550 -143.97068 1155.56138
8425.0000 -154.88469 -144.39362 10.49107 2.94553 -144.13189 1086.10645
8430.0000 -152.56842 -143.72913 8.83929 2.95997 -143.89840 1108.82202
8435.0000 -152.70868 -143.63301 9.07567 2.96365 -143.83896 1108.80597
8440.0000 -154.45929 -144.78229 9.67700 2.96280 -143.85274 1146.70521
8445.0000 -153.64921 -146.07828 7.57093 2.86399 -145.45012 1024.07913
8450.0000 -152.66245 -144.11425 8.54821 2.85020 -145.67307 1031.75267
8455.0000 -152.27661 -142.05061 10.22600 3.04505 -142.52296 1163.28456
8460.0000 -153.25639 -143.99008 9.26631 2.96867 -143.75783 1128.90704
8465.0000 -152.15825 -140.63084 11.52741 3.06027 -142.27695 1183.20617
8470.0000 -151.41744 -142.67274 8.74470 3.10644 -141.53051 1187.66549
8475.0000 -153.45559 -145.13237 8.32322 2.94109 -144.20365 1089.13812
8480.0000 -153.99784 -145.25165 8.74619 2.91269 -144.66280 1066.77495
8485.0000 -154.60104 -144.39510 10.20594 2.92371 -144.48462 1099.06033
8490.0000 -152.39703 -142.18894 10.20809 2.98252 -143.53389 1131.05791
8495.0000 -150.82257 -140.63068 10.19189 3.13290 -141.10276 1278.47407
8500.0000 -153.74992 -143.54419 10.20572 3.06514 -142.19817 1239.54478
MELTING PROCESS: loop number 35 T-loop= 1157.0000000000000
main_MD> interactions number 35 at Temperature= 1157.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.49468 -1.27415 2.36030
force_rgl> df(natom) 0.80477 1.40561 -0.60715
8505.0000 -151.49213 -141.28276 10.20937 3.03284 -142.72040 1181.25631
8510.0000 -151.47843 -141.33030 10.14814 3.06070 -142.26998 1187.28289
8515.0000 -150.44779 -139.37344 11.07435 3.18377 -140.28049 1275.54378
8520.0000 -152.51920 -142.46693 10.05227 3.11657 -141.36677 1252.51768
8525.0000 -152.70243 -143.88894 8.81349 3.04173 -142.57671 1199.62670
8530.0000 -154.06269 -143.85996 10.20273 2.98099 -143.55863 1116.79147
8535.0000 -153.42919 -144.23532 9.19387 2.90824 -144.73476 1072.92565
8540.0000 -152.37564 -143.35919 9.01645 2.98661 -143.46778 1138.98807
8545.0000 -155.60091 -146.87337 8.72755 2.91404 -144.64089 1149.89135
8550.0000 -153.22458 -143.39616 9.82842 2.84469 -145.76214 1068.66123
8555.0000 -152.49741 -140.33555 12.16186 3.05705 -142.32898 1223.70490
8560.0000 -154.80123 -146.70383 8.09740 3.00104 -143.23449 1141.45926
8565.0000 -153.81149 -143.65713 10.15436 2.91941 -144.55413 1076.61458
8570.0000 -151.29563 -143.04311 8.25252 3.00798 -143.12225 1146.41444
8575.0000 -152.98896 -142.33039 10.65857 3.06013 -142.27916 1168.16690
8580.0000 -151.92798 -143.01372 8.91426 3.06692 -142.16951 1207.40100
8585.0000 -152.55139 -142.22430 10.32710 3.01696 -142.97713 1156.10278
8590.0000 -150.85358 -139.92263 10.93096 3.11000 -141.47297 1225.76812
8595.0000 -151.20217 -141.47209 9.73008 3.17297 -140.45503 1292.81569
8600.0000 -152.15363 -142.50243 9.65120 3.04538 -142.51773 1202.64507
8605.0000 -155.15308 -144.72528 10.42780 2.97047 -143.72869 1134.74996
8610.0000 -154.91453 -144.87686 10.03766 3.02750 -142.80678 1189.49825
8615.0000 -153.95308 -145.35709 8.59599 2.88880 -145.04894 1103.31691
8620.0000 -153.83613 -144.01927 9.81685 2.87827 -145.21922 1078.56088
8625.0000 -154.02004 -143.64681 10.37323 2.91771 -144.58155 1138.48890
8630.0000 -152.08088 -141.80453 10.27635 3.02501 -142.84691 1149.47261
8635.0000 -154.07804 -142.80420 11.27384 3.01760 -142.96680 1185.21590
8640.0000 -152.11686 -142.98908 9.12778 3.02313 -142.87740 1181.19226
8645.0000 -151.10428 -142.45983 8.64446 3.06727 -142.16371 1214.72595
8650.0000 -155.13605 -144.28653 10.84951 2.99713 -143.29768 1156.21514
8655.0000 -152.51825 -143.70318 8.81507 3.01315 -143.03871 1164.31909
8660.0000 -153.74334 -144.07940 9.66394 2.93215 -144.34825 1086.57548
8665.0000 -151.52796 -141.49147 10.03649 3.01075 -143.07755 1127.58815
8670.0000 -153.49559 -143.92115 9.57444 3.05117 -142.42415 1152.59910
8675.0000 -149.55860 -141.16546 8.39313 2.99615 -143.31347 1128.95706
8680.0000 -154.30763 -144.36669 9.94095 3.06863 -142.14181 1163.23375
8685.0000 -153.82735 -145.00518 8.82217 2.87455 -145.27927 1069.95180
8690.0000 -152.57533 -143.14254 9.43278 2.97766 -143.61242 1109.95363
8695.0000 -155.82833 -146.20304 9.62528 2.97609 -143.63776 1143.88433
8700.0000 -153.20539 -144.03863 9.16675 2.89349 -144.97321 1070.86354
8705.0000 -152.28109 -141.65444 10.62666 3.05360 -142.38474 1149.03604
8710.0000 -152.72068 -143.47219 9.24849 3.00573 -143.15874 1156.01823
8715.0000 -152.61103 -143.01435 9.59668 2.96480 -143.82035 1150.50210
8720.0000 -152.95191 -142.97413 9.97779 2.97680 -143.62641 1134.18234
8725.0000 -151.81700 -142.87894 8.93806 3.04520 -142.52063 1179.68861
8730.0000 -152.61138 -142.55280 10.05857 3.00219 -143.21593 1186.93377
8735.0000 -152.67642 -142.45609 10.22033 3.02571 -142.83560 1166.12952
8740.0000 -153.16424 -143.47506 9.68918 3.01810 -142.95867 1142.13812
8745.0000 -149.53315 -139.83411 9.69904 3.07780 -141.99348 1171.84211
8750.0000 -151.66096 -142.65446 9.00650 3.13831 -141.01539 1238.80381
MELTING PROCESS: loop number 36 T-loop= 1182.0000000000000
main_MD> interactions number 36 at Temperature= 1182.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.58815 -0.83283 -0.49343
force_rgl> df(natom) -1.78897 -0.66438 0.64817
8755.0000 -153.23098 -142.84907 10.38191 3.04878 -142.46268 1199.12752
8760.0000 -153.35341 -144.59722 8.75620 3.00862 -143.11188 1181.09548
8765.0000 -152.45842 -143.54749 8.91093 3.02657 -142.82183 1188.08259
8770.0000 -153.01407 -143.33367 9.68040 3.07851 -141.98203 1170.84746
8775.0000 -152.38713 -141.55673 10.83041 3.03331 -142.71287 1175.73461
8780.0000 -152.72031 -142.67031 10.05000 3.08645 -141.85370 1203.47848
8785.0000 -153.22772 -143.30230 9.92542 3.08891 -141.81395 1196.16615
8790.0000 -152.72001 -140.62599 12.09403 3.07919 -141.97106 1214.55942
8795.0000 -151.79138 -142.33683 9.45454 3.17014 -140.50069 1244.76848
8800.0000 -150.53975 -139.42514 11.11461 3.13028 -141.14517 1258.72392
8805.0000 -150.67894 -140.30904 10.36990 3.22674 -139.58584 1324.78607
8810.0000 -151.74009 -142.84837 8.89171 3.12654 -141.20555 1195.27268
8815.0000 -152.76114 -143.69371 9.06743 2.97466 -143.66094 1113.21153
8820.0000 -152.32397 -143.00300 9.32097 3.00108 -143.23391 1113.86418
8825.0000 -152.23855 -143.40719 8.83136 3.01256 -143.04818 1114.25020
8830.0000 -151.56816 -142.76998 8.79818 2.99719 -143.29676 1152.87783
8835.0000 -152.46049 -141.63074 10.82975 3.09991 -141.63606 1214.89887
8840.0000 -151.21943 -140.86498 10.35445 3.16290 -140.61786 1286.08001
8845.0000 -152.54067 -141.16663 11.37404 3.09385 -141.73406 1208.13571
8850.0000 -152.96855 -143.11142 9.85713 3.03182 -142.73683 1159.25507
8855.0000 -153.59406 -143.97092 9.62315 2.99949 -143.25950 1154.10713
8860.0000 -153.19330 -142.98432 10.20897 2.96925 -143.74838 1137.70998
8865.0000 -152.35530 -141.62692 10.72839 3.10237 -141.59640 1195.01107
8870.0000 -151.06067 -140.87284 10.18783 3.15192 -140.79529 1241.34656
8875.0000 -151.02951 -142.24589 8.78361 3.08187 -141.92784 1184.20720
8880.0000 -152.82604 -142.44073 10.38530 3.07518 -142.03592 1147.98926
8885.0000 -155.59569 -143.41263 12.18306 2.99817 -143.28092 1136.75571
8890.0000 -154.62547 -144.51326 10.11221 2.91913 -144.55871 1097.09612
8895.0000 -151.93788 -140.77782 11.16006 3.02842 -142.79190 1159.91241
8900.0000 -153.73916 -144.07850 9.66066 3.02902 -142.78207 1176.66859
8905.0000 -153.07779 -142.41429 10.66350 2.98537 -143.48787 1157.85838
8910.0000 -153.39844 -143.18685 10.21159 3.03193 -142.73503 1150.45630
8915.0000 -154.28959 -144.69276 9.59684 2.91354 -144.64906 1076.18676
8920.0000 -151.92434 -142.18207 9.74227 3.09857 -141.65772 1199.47469
8925.0000 -153.43325 -143.55858 9.87467 3.01793 -142.96139 1155.62125
8930.0000 -153.41013 -143.83930 9.57083 2.98689 -143.46327 1126.69231
8935.0000 -153.91283 -144.58495 9.32788 2.97675 -143.62716 1112.38865
8940.0000 -152.89735 -143.04292 9.85443 3.00607 -143.15324 1153.80005
8945.0000 -153.90365 -146.25132 7.65232 2.89821 -144.89689 1027.99422
8950.0000 -153.12226 -143.21896 9.90330 2.91095 -144.69085 1068.65199
8955.0000 -152.04467 -140.90655 11.13812 3.10701 -141.52128 1222.25883
8960.0000 -151.23398 -139.56539 11.66859 3.11604 -141.37543 1256.66710
8965.0000 -151.54752 -141.26480 10.28272 3.27929 -138.73625 1328.40821
8970.0000 -153.10523 -142.88632 10.21891 3.07467 -142.04409 1220.09772
8975.0000 -149.52412 -139.82606 9.69806 3.13082 -141.13645 1195.34102
8980.0000 -150.03890 -140.39790 9.64100 3.19729 -140.06180 1254.17595
8985.0000 -152.70325 -142.72897 9.97428 3.09828 -141.66255 1215.27395
8990.0000 -152.53173 -142.22262 10.30911 3.02030 -142.92308 1193.59447
8995.0000 -152.76522 -141.79246 10.97277 3.14209 -140.95418 1250.41749
9000.0000 -151.68034 -141.25792 10.42243 3.10548 -141.54608 1245.66636
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 14 [min], 37.3886861 [s].
main_MD> Deallocating global variables
Reference in New Issue View Git Blame Copy Permalink