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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_18/melt.log

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main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_18.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 = 18 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1650
main_MD> Size of nv and nvoiz: 18 1800
main_MD> Size of nv and nvoiz: 18 1800
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 = 18
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> -5.6681428393484938E-002 -0.12542485359665770 -0.20504515858585234 initial drift of cluster / NP1 for coalescence
init> 0.40140276825193366 0.39953459779662603 0.25405657555767963 scaling for velocity /for coalescence NP1
init.f90 > facguy = 2.0172046749983310E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.48732 0.05376 -1.23709
force_rgl> df(natom) 0.16308 0.76037 0.17509
preparo> THERMALIZATION PROCESS AT 353.65418032906905
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -40.710908511822943 0.60399267871536177 -41.314901190538308 4.2295256334681010E-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 33
MELTING PROCESS: loop number 1 T-loop= 378.00000000000000
main_MD> interactions number 1 at Temperature= 378.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.00090 0.45167 -0.41087
force_rgl> df(natom) 0.77671 0.87387 1.53278
5.0000 -42.17223 -41.02953 1.14270 1.74634 -41.10562 426.00074
10.0000 -42.49568 -41.69599 0.79969 1.67406 -41.60206 338.70590
15.0000 -42.08935 -41.46053 0.62882 1.65450 -41.73641 304.06800
20.0000 -42.19796 -41.48949 0.70847 1.68159 -41.55037 343.01781
25.0000 -42.06423 -41.16639 0.89784 1.71621 -41.31258 365.24374
30.0000 -42.14871 -41.40219 0.74652 1.68149 -41.55103 308.97530
35.0000 -42.13711 -41.13401 1.00309 1.70040 -41.42120 359.88394
40.0000 -42.26921 -41.14527 1.12393 1.74310 -41.12787 399.08901
45.0000 -42.23119 -41.30302 0.92817 1.69627 -41.44950 365.99475
50.0000 -42.29806 -41.71886 0.57920 1.68973 -41.49442 343.76141
55.0000 -42.09054 -41.54894 0.54160 1.69501 -41.45817 373.49847
60.0000 -42.42452 -41.67362 0.75090 1.66688 -41.65140 319.05178
65.0000 -42.16683 -41.63957 0.52726 1.69450 -41.46171 362.60364
70.0000 -42.51033 -41.55511 0.95522 1.66973 -41.63183 317.01975
75.0000 -42.33153 -41.45633 0.87520 1.71273 -41.33649 379.87054
80.0000 -42.26609 -41.35485 0.91124 1.69991 -41.42453 402.33806
85.0000 -42.35053 -41.37615 0.97437 1.72827 -41.22972 419.09671
90.0000 -42.33848 -41.64937 0.68911 1.68385 -41.53483 343.94778
95.0000 -42.55290 -41.61879 0.93411 1.69960 -41.42667 370.14026
100.0000 -42.30002 -41.31454 0.98548 1.73843 -41.15997 425.07385
105.0000 -42.39250 -41.68693 0.70557 1.70585 -41.38373 388.48826
110.0000 -42.05507 -41.45379 0.60128 1.68627 -41.51822 355.87861
115.0000 -42.08416 -41.33277 0.75138 1.72648 -41.24205 392.79265
120.0000 -42.08060 -40.83234 1.24825 1.73352 -41.19371 410.89306
125.0000 -42.30184 -41.43379 0.86806 1.74163 -41.13798 421.94098
130.0000 -42.29406 -41.81673 0.47733 1.65644 -41.72311 320.13543
135.0000 -42.47786 -41.82579 0.65207 1.65326 -41.74495 312.26331
140.0000 -42.13623 -41.41135 0.72488 1.71004 -41.35495 405.78139
145.0000 -41.95264 -41.03379 0.91885 1.72910 -41.22404 409.55000
150.0000 -41.83705 -40.72273 1.11432 1.76971 -40.94512 457.40146
155.0000 -41.81621 -40.89174 0.92447 1.77197 -40.92958 444.87755
160.0000 -41.77887 -40.74856 1.03030 1.76727 -40.96192 453.91069
165.0000 -42.25183 -41.31785 0.93397 1.73605 -41.17628 414.19934
170.0000 -42.01458 -41.21637 0.79820 1.71445 -41.32467 376.52079
175.0000 -42.19591 -41.19665 0.99926 1.71923 -41.29187 358.35042
180.0000 -41.75987 -40.46863 1.29124 1.77311 -40.92181 448.29488
185.0000 -42.43055 -41.73509 0.69546 1.74686 -41.10208 421.00211
190.0000 -42.42875 -41.88696 0.54179 1.67093 -41.62358 325.85525
195.0000 -42.53520 -41.58169 0.95351 1.65683 -41.72043 293.67606
200.0000 -42.40829 -41.46870 0.93959 1.69836 -41.43515 360.37511
205.0000 -42.40177 -41.46528 0.93649 1.71658 -41.31002 388.35067
210.0000 -42.13093 -41.17393 0.95700 1.73735 -41.16735 419.56456
215.0000 -42.40982 -41.61640 0.79342 1.67711 -41.58110 336.28185
220.0000 -42.24232 -41.18144 1.06089 1.70461 -41.39226 365.64922
225.0000 -42.27227 -41.48041 0.79186 1.68536 -41.52449 339.02397
230.0000 -42.47485 -41.67425 0.80060 1.66648 -41.65414 321.58287
235.0000 -42.33265 -41.43301 0.89964 1.69174 -41.48065 371.95251
240.0000 -42.28571 -41.38555 0.90015 1.71595 -41.31439 408.72958
245.0000 -42.62382 -41.96561 0.65821 1.64372 -41.81045 298.60909
250.0000 -42.38253 -41.95181 0.43072 1.61930 -41.97816 265.64869
MELTING PROCESS: loop number 2 T-loop= 403.00000000000000
main_MD> interactions number 2 at Temperature= 403.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.28094 0.89638 0.97236
force_rgl> df(natom) 1.79390 2.28652 -0.77443
255.0000 -42.18482 -41.16656 1.01826 1.67530 -41.59356 326.20304
260.0000 -42.06073 -40.77504 1.28569 1.78603 -40.83304 489.28145
265.0000 -42.16620 -41.22771 0.93849 1.75778 -41.02704 457.10298
270.0000 -42.25304 -41.48605 0.76700 1.68796 -41.50660 347.91704
275.0000 -42.21117 -41.30354 0.90763 1.74972 -41.08245 433.61931
280.0000 -42.33470 -41.11608 1.21862 1.74227 -41.13361 451.62554
285.0000 -42.02660 -41.19491 0.83169 1.73623 -41.17506 403.88731
290.0000 -42.23568 -40.99414 1.24155 1.76793 -40.95733 429.66654
295.0000 -41.89795 -40.79156 1.10640 1.76728 -40.96179 427.27860
300.0000 -42.02731 -41.18647 0.84085 1.75800 -41.02553 418.22183
305.0000 -42.45218 -41.56607 0.88611 1.70733 -41.37354 360.10341
310.0000 -42.35382 -41.46005 0.89377 1.70391 -41.39704 353.04746
315.0000 -42.14287 -41.43493 0.70794 1.70784 -41.37004 366.97253
320.0000 -42.34600 -41.60035 0.74565 1.70533 -41.38733 364.33214
325.0000 -41.99508 -41.07635 0.91873 1.69212 -41.47804 335.70809
330.0000 -42.18721 -40.96678 1.22043 1.72347 -41.26270 376.25261
335.0000 -41.97263 -41.11731 0.85532 1.73242 -41.20128 402.37555
340.0000 -42.32695 -41.38175 0.94520 1.70474 -41.39134 361.29112
345.0000 -42.03781 -41.10431 0.93349 1.71401 -41.32767 382.98645
350.0000 -42.32707 -41.02942 1.29766 1.75823 -41.02399 443.22895
355.0000 -42.37635 -41.37771 0.99865 1.72614 -41.24438 404.95371
360.0000 -42.09038 -41.38002 0.71036 1.71465 -41.32330 351.13527
365.0000 -41.80099 -41.04173 0.75926 1.74374 -41.12349 400.72216
370.0000 -42.14756 -41.24853 0.89902 1.74639 -41.10527 427.31243
375.0000 -41.95130 -41.11242 0.83888 1.75568 -41.04148 431.28958
380.0000 -41.84426 -41.07991 0.76435 1.76402 -40.98423 443.53222
385.0000 -41.69148 -40.93253 0.75895 1.77752 -40.89147 456.48554
390.0000 -42.25744 -41.04352 1.21392 1.76964 -40.94563 448.82625
395.0000 -42.13597 -41.25838 0.87758 1.73166 -41.20645 375.49675
400.0000 -41.73670 -40.93037 0.80633 1.75742 -41.02957 427.45819
405.0000 -42.58706 -41.78362 0.80344 1.72723 -41.23689 413.06661
410.0000 -42.04770 -41.00468 1.04302 1.70995 -41.35557 373.84052
415.0000 -42.19399 -41.42888 0.76512 1.73587 -41.17752 412.61169
420.0000 -41.95462 -40.96558 0.98904 1.76041 -41.00898 451.68362
425.0000 -41.85823 -40.88311 0.97512 1.76277 -40.99277 463.34849
430.0000 -42.00320 -41.14677 0.85643 1.75872 -41.02062 436.30170
435.0000 -41.98486 -40.89528 1.08957 1.76550 -40.97405 442.59583
440.0000 -42.08538 -41.15211 0.93327 1.73193 -41.20460 403.82931
445.0000 -42.01960 -41.23833 0.78127 1.74180 -41.13680 418.58942
450.0000 -42.51362 -41.31849 1.19512 1.71296 -41.33491 395.36785
455.0000 -42.26365 -41.29465 0.96900 1.71255 -41.33771 389.29935
460.0000 -42.45648 -41.68478 0.77170 1.69980 -41.42529 351.70155
465.0000 -42.30819 -41.48700 0.82120 1.69321 -41.47057 354.32605
470.0000 -42.24955 -41.26094 0.98861 1.71558 -41.31691 391.29465
475.0000 -42.55458 -41.30836 1.24623 1.73609 -41.17603 405.60246
480.0000 -42.25736 -41.36835 0.88901 1.71629 -41.31200 392.41480
485.0000 -42.07283 -41.24821 0.82461 1.70514 -41.38862 366.25757
490.0000 -42.28045 -41.21474 1.06570 1.72787 -41.23251 396.10974
495.0000 -41.95695 -41.12495 0.83200 1.75606 -41.03885 433.42268
500.0000 -41.90920 -41.05767 0.85153 1.73516 -41.18245 410.66615
MELTING PROCESS: loop number 3 T-loop= 428.00000000000000
main_MD> interactions number 3 at Temperature= 428.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.18443 3.08730 -3.83932
force_rgl> df(natom) -2.35211 -0.92745 1.60560
505.0000 -42.17567 -40.82414 1.35153 1.76949 -40.94661 459.24588
510.0000 -41.95909 -41.05949 0.89960 1.76900 -40.94998 460.05845
515.0000 -42.42269 -41.64275 0.77994 1.72473 -41.25409 405.86130
520.0000 -42.36124 -41.27428 1.08696 1.69084 -41.48684 367.01004
525.0000 -42.21890 -41.11885 1.10005 1.73263 -41.19979 401.67366
530.0000 -42.15275 -41.19066 0.96209 1.74161 -41.13810 421.64334
535.0000 -41.96621 -40.96161 1.00460 1.73978 -41.15072 433.31863
540.0000 -42.36287 -41.01954 1.34333 1.71843 -41.29734 405.48773
545.0000 -42.01532 -41.02286 0.99246 1.75486 -41.04714 437.34267
550.0000 -42.33670 -41.00134 1.33535 1.76061 -41.00762 474.23420
555.0000 -42.11681 -41.24962 0.86719 1.75183 -41.06794 434.30993
560.0000 -42.20394 -40.98226 1.22168 1.77350 -40.91908 477.75073
565.0000 -41.83416 -40.96397 0.87019 1.76852 -40.95328 458.81611
570.0000 -42.19913 -41.39998 0.79915 1.73408 -41.18987 399.49532
575.0000 -41.84133 -40.98526 0.85608 1.73818 -41.16165 404.18031
580.0000 -41.96700 -40.91231 1.05469 1.77527 -40.90695 459.76396
585.0000 -41.84501 -40.94920 0.89581 1.76543 -40.97449 451.26432
590.0000 -41.84247 -40.66127 1.18120 1.76552 -40.97389 462.80012
595.0000 -42.25358 -41.11634 1.13724 1.79385 -40.77935 504.14391
600.0000 -42.07914 -40.88906 1.19008 1.77359 -40.91850 478.17658
605.0000 -41.69521 -40.80690 0.88831 1.81122 -40.66005 533.16694
610.0000 -41.96215 -40.99959 0.96256 1.77473 -40.91064 458.25242
615.0000 -42.17596 -41.34590 0.83006 1.76013 -41.01092 417.03475
620.0000 -42.28752 -41.62977 0.65775 1.68370 -41.53589 327.86388
625.0000 -42.27066 -41.41559 0.85507 1.68133 -41.55217 330.91494
630.0000 -42.10890 -41.35637 0.75253 1.69625 -41.44970 371.85476
635.0000 -42.16796 -41.43490 0.73306 1.70743 -41.37288 360.70538
640.0000 -42.18260 -40.92608 1.25653 1.72106 -41.27926 415.77110
645.0000 -41.97622 -41.02336 0.95286 1.75352 -41.05630 431.34259
650.0000 -41.82156 -40.77462 1.04694 1.79288 -40.78599 465.28728
655.0000 -41.79027 -41.02448 0.76579 1.79544 -40.76840 479.99593
660.0000 -41.91186 -40.95347 0.95838 1.78701 -40.82632 470.21407
665.0000 -42.06762 -41.16934 0.89827 1.74606 -41.10755 419.74516
670.0000 -42.17683 -40.80088 1.37595 1.76253 -40.99444 433.45073
675.0000 -42.11649 -41.26806 0.84842 1.79067 -40.80114 463.17407
680.0000 -42.48243 -41.50649 0.97594 1.72081 -41.28096 391.92324
685.0000 -41.84059 -41.09215 0.74844 1.72176 -41.27447 386.98156
690.0000 -41.69137 -40.62483 1.06654 1.81478 -40.63557 502.41667
695.0000 -42.03158 -40.93082 1.10077 1.79774 -40.75261 459.98575
700.0000 -42.15121 -41.09188 1.05933 1.74393 -41.12216 430.30602
705.0000 -41.90314 -40.94810 0.95504 1.75587 -41.04021 421.57939
710.0000 -42.31151 -40.88995 1.42156 1.74067 -41.14460 411.17568
715.0000 -41.94041 -40.84354 1.09687 1.78171 -40.86268 474.40509
720.0000 -42.13349 -40.97893 1.15456 1.76154 -41.00125 430.12033
725.0000 -42.30227 -41.18390 1.11838 1.76633 -40.96835 445.23341
730.0000 -42.24420 -41.34123 0.90297 1.73029 -41.21589 408.57893
735.0000 -42.16347 -41.26735 0.89612 1.71626 -41.31226 388.17612
740.0000 -42.08855 -40.87946 1.20909 1.74649 -41.10459 416.37087
745.0000 -42.06320 -41.00400 1.05921 1.77344 -40.91948 458.53176
750.0000 -42.25818 -41.25437 1.00381 1.76142 -41.00205 427.05020
MELTING PROCESS: loop number 4 T-loop= 453.00000000000000
main_MD> interactions number 4 at Temperature= 453.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.15768 0.63698 -0.25959
force_rgl> df(natom) 1.35619 0.04180 3.02768
755.0000 -42.17809 -41.36622 0.81187 1.74992 -41.08107 433.11637
760.0000 -42.33603 -41.00672 1.32932 1.71257 -41.33761 391.21227
765.0000 -42.21744 -40.90637 1.31107 1.79011 -40.80502 486.12017
770.0000 -42.49174 -41.12072 1.37102 1.78643 -40.83026 476.68915
775.0000 -42.20353 -41.53807 0.66547 1.73877 -41.15766 429.93359
780.0000 -42.34140 -41.15297 1.18843 1.71165 -41.34390 391.00574
785.0000 -42.04720 -41.14086 0.90634 1.74344 -41.12555 423.24870
790.0000 -42.50075 -41.35747 1.14329 1.71324 -41.33300 390.93114
795.0000 -41.88887 -41.08361 0.80526 1.73932 -41.15388 427.63050
800.0000 -41.74924 -40.43184 1.31739 1.78767 -40.82176 492.29142
805.0000 -41.78747 -40.83097 0.95650 1.79707 -40.75718 484.45414
810.0000 -41.67646 -40.68413 0.99232 1.80046 -40.73396 488.12963
815.0000 -41.91320 -40.76808 1.14512 1.83520 -40.49529 552.68053
820.0000 -42.22598 -40.97488 1.25110 1.82797 -40.54497 499.80396
825.0000 -42.23298 -41.17654 1.05644 1.76411 -40.98360 465.16769
830.0000 -42.00652 -40.81285 1.19367 1.74861 -41.09004 445.90465
835.0000 -41.71992 -40.71556 1.00436 1.80878 -40.67679 514.09761
840.0000 -42.28732 -41.49621 0.79112 1.74427 -41.11984 421.18860
845.0000 -42.09692 -40.92860 1.16832 1.71750 -41.30372 376.25998
850.0000 -42.04639 -41.20832 0.83806 1.77377 -40.91723 465.15833
855.0000 -41.50926 -40.27607 1.23319 1.78271 -40.85585 484.60021
860.0000 -41.87489 -40.51155 1.36334 1.82007 -40.59925 517.36200
865.0000 -41.62087 -40.15557 1.46530 1.87856 -40.19750 577.94772
870.0000 -41.38919 -40.55398 0.83521 1.83508 -40.49613 546.33754
875.0000 -42.17018 -40.61548 1.55470 1.82447 -40.56899 526.30043
880.0000 -41.32479 -40.06353 1.26127 1.82939 -40.53524 515.58065
885.0000 -41.83981 -40.55550 1.28431 1.87035 -40.25389 543.97696
890.0000 -41.71210 -40.41338 1.29872 1.81418 -40.63973 506.60333
895.0000 -42.02301 -41.29383 0.72918 1.75936 -41.01623 440.02033
900.0000 -42.06120 -41.12283 0.93837 1.72705 -41.23810 410.15953
905.0000 -42.31980 -41.17908 1.14072 1.74578 -41.10947 438.18858
910.0000 -42.15363 -41.09995 1.05368 1.74600 -41.10798 429.20416
915.0000 -42.08080 -40.61235 1.46846 1.79484 -40.77249 479.82882
920.0000 -42.10332 -41.14499 0.95833 1.79247 -40.78881 490.64644
925.0000 -42.14247 -41.28583 0.85664 1.72208 -41.27228 394.96238
930.0000 -42.45929 -41.53551 0.92379 1.71906 -41.29301 389.46934
935.0000 -41.86121 -40.62804 1.23317 1.75721 -41.03098 447.14208
940.0000 -41.84584 -40.86627 0.97957 1.79785 -40.75185 479.12155
945.0000 -42.18118 -41.22416 0.95702 1.75599 -41.03933 425.84873
950.0000 -42.25580 -41.34111 0.91468 1.75039 -41.07781 426.68277
955.0000 -42.14456 -41.03974 1.10481 1.74068 -41.14449 387.88020
960.0000 -42.35103 -41.01385 1.33718 1.77495 -40.90914 484.42522
965.0000 -42.25875 -41.47006 0.78869 1.74371 -41.12368 426.14418
970.0000 -42.06960 -40.86513 1.20447 1.75437 -41.05048 431.52573
975.0000 -42.11227 -41.06932 1.04295 1.76070 -41.00700 442.82731
980.0000 -41.85644 -40.82059 1.03585 1.75657 -41.03537 427.80642
985.0000 -41.96888 -40.58190 1.38697 1.78527 -40.83828 482.09643
990.0000 -42.08372 -41.37217 0.71155 1.79071 -40.80092 484.75026
995.0000 -41.80314 -40.78703 1.01611 1.73927 -41.15423 430.49374
1000.0000 -41.82277 -40.98375 0.83902 1.79242 -40.78915 485.17476
MELTING PROCESS: loop number 5 T-loop= 478.00000000000000
main_MD> interactions number 5 at Temperature= 478.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.63478 -0.46240 -3.21478
force_rgl> df(natom) -1.56266 -0.47056 1.52309
1005.0000 -42.19739 -41.09345 1.10395 1.75294 -41.06029 435.30652
1010.0000 -42.14465 -40.99946 1.14519 1.76988 -40.94398 470.18874
1015.0000 -41.88933 -40.62500 1.26434 1.74997 -41.08069 416.03624
1020.0000 -41.39283 -40.38637 1.00646 1.81897 -40.60677 539.74305
1025.0000 -41.80427 -40.41173 1.39254 1.86549 -40.28731 602.20696
1030.0000 -41.87202 -40.67554 1.19648 1.84144 -40.45245 542.48360
1035.0000 -41.82596 -40.87300 0.95296 1.81314 -40.64687 517.11233
1040.0000 -42.10392 -41.14385 0.96007 1.74491 -41.11545 444.35400
1045.0000 -42.25824 -41.03216 1.22608 1.74275 -41.13033 432.42524
1050.0000 -41.97040 -40.92998 1.04042 1.74691 -41.10174 422.13167
1055.0000 -42.28930 -41.06098 1.22832 1.76679 -40.96515 453.50219
1060.0000 -42.18281 -40.69332 1.48948 1.83832 -40.47387 555.83574
1065.0000 -41.75402 -40.76204 0.99197 1.77690 -40.89572 481.47702
1070.0000 -41.64677 -40.59017 1.05660 1.80484 -40.70381 502.06911
1075.0000 -42.06265 -41.01504 1.04762 1.79170 -40.79411 483.81717
1080.0000 -42.07076 -40.94728 1.12347 1.78749 -40.82303 462.17627
1085.0000 -42.15171 -40.97512 1.17659 1.76000 -41.01180 437.30228
1090.0000 -41.84419 -40.41761 1.42658 1.79086 -40.79986 482.26975
1095.0000 -41.47664 -40.20352 1.27312 1.87254 -40.23886 587.76100
1100.0000 -42.26071 -41.21693 1.04378 1.77715 -40.89403 458.22244
1105.0000 -42.27909 -41.31430 0.96479 1.72051 -41.28306 381.98243
1110.0000 -41.83952 -41.00802 0.83150 1.73046 -41.21473 392.70670
1115.0000 -41.73695 -40.23606 1.50089 1.84329 -40.43979 560.23442
1120.0000 -41.70310 -40.24608 1.45702 1.86793 -40.27051 573.49027
1125.0000 -42.25939 -41.20190 1.05750 1.81680 -40.62167 520.60818
1130.0000 -41.83378 -40.70101 1.13277 1.73997 -41.14939 417.54453
1135.0000 -42.01603 -41.03668 0.97935 1.77648 -40.89863 462.03669
1140.0000 -42.16302 -41.09824 1.06478 1.76971 -40.94514 480.17492
1145.0000 -41.91421 -41.02577 0.88845 1.75711 -41.03169 435.64568
1150.0000 -42.11248 -40.84538 1.26710 1.74223 -41.13388 413.49184
1155.0000 -41.69749 -40.73233 0.96517 1.79462 -40.77403 516.11410
1160.0000 -41.87325 -40.74221 1.13104 1.77544 -40.90574 470.91369
1165.0000 -42.14668 -41.13070 1.01599 1.77886 -40.88229 478.76650
1170.0000 -42.09424 -41.26985 0.82439 1.74784 -41.09536 432.42716
1175.0000 -42.18089 -41.11033 1.07056 1.73168 -41.20630 402.19877
1180.0000 -41.79047 -40.93519 0.85528 1.76349 -40.98785 452.14177
1185.0000 -41.73942 -40.83448 0.90494 1.79787 -40.75173 487.42593
1190.0000 -41.93267 -40.49637 1.43630 1.83633 -40.48759 562.58848
1195.0000 -41.49041 -40.42409 1.06632 1.81748 -40.61700 522.33348
1200.0000 -41.92442 -40.78442 1.14000 1.82460 -40.56809 496.80045
1205.0000 -41.95660 -40.68821 1.26839 1.80992 -40.66896 532.01886
1210.0000 -42.25924 -40.89306 1.36618 1.79670 -40.75975 516.09028
1215.0000 -42.39164 -41.08650 1.30515 1.75470 -41.04821 426.27716
1220.0000 -42.03681 -40.97270 1.06411 1.77036 -40.94068 454.24603
1225.0000 -41.96583 -40.82764 1.13819 1.77011 -40.94237 476.52463
1230.0000 -41.61460 -40.10992 1.50468 1.83809 -40.47544 548.58659
1235.0000 -41.56549 -40.01801 1.54748 1.88190 -40.17455 605.76953
1240.0000 -41.76310 -40.37213 1.39096 1.86275 -40.30607 563.28096
1245.0000 -41.72478 -40.57802 1.14676 1.86008 -40.32445 576.65603
1250.0000 -41.81784 -40.68388 1.13396 1.80350 -40.71303 515.94930
MELTING PROCESS: loop number 6 T-loop= 503.00000000000000
main_MD> interactions number 6 at Temperature= 503.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.50972 5.14929 0.37626
force_rgl> df(natom) 1.65889 -1.45957 1.97162
1255.0000 -41.75428 -40.64127 1.11301 1.82986 -40.53199 523.23412
1260.0000 -42.02540 -41.13086 0.89454 1.76080 -41.00631 414.70267
1265.0000 -41.94618 -40.58009 1.36609 1.79762 -40.75344 487.02718
1270.0000 -41.27630 -40.24042 1.03588 1.83681 -40.48430 553.58888
1275.0000 -41.48597 -40.00503 1.48094 1.92344 -39.88926 626.33488
1280.0000 -42.00432 -40.70114 1.30318 1.83348 -40.50717 532.12349
1285.0000 -41.51875 -40.65692 0.86184 1.76140 -41.00218 449.46987
1290.0000 -41.84890 -40.84118 1.00772 1.80684 -40.69008 513.43067
1295.0000 -41.95687 -40.97136 0.98551 1.77135 -40.93389 470.26141
1300.0000 -42.00821 -40.89764 1.11058 1.75594 -41.03973 432.13212
1305.0000 -41.87859 -40.76162 1.11697 1.78488 -40.84091 491.00932
1310.0000 -42.12737 -41.11790 1.00947 1.76161 -41.00075 443.20373
1315.0000 -42.38847 -41.22425 1.16422 1.74656 -41.10412 419.95634
1320.0000 -41.85630 -40.83132 1.02498 1.77684 -40.89614 475.64056
1325.0000 -41.66284 -40.46090 1.20194 1.82560 -40.56125 521.63530
1330.0000 -41.67269 -40.02017 1.65252 1.85991 -40.32564 557.52052
1335.0000 -41.99216 -40.67929 1.31288 1.87357 -40.23181 585.84058
1340.0000 -42.13819 -40.88772 1.25048 1.81193 -40.65518 513.99066
1345.0000 -42.11596 -40.72586 1.39010 1.74747 -41.09789 443.66332
1350.0000 -41.80305 -40.83413 0.96892 1.79028 -40.80382 495.22189
1355.0000 -42.08249 -40.96563 1.11686 1.78176 -40.86237 465.15899
1360.0000 -41.74406 -40.27002 1.47404 1.81968 -40.60193 496.39764
1365.0000 -41.76994 -40.45197 1.31797 1.84702 -40.41414 538.36298
1370.0000 -41.56036 -40.37386 1.18650 1.84774 -40.40919 536.76113
1375.0000 -42.18278 -40.87325 1.30954 1.79684 -40.75881 502.88373
1380.0000 -42.03129 -41.04449 0.98679 1.76025 -41.01011 466.08750
1385.0000 -41.72256 -40.01091 1.71165 1.81438 -40.63830 520.68096
1390.0000 -41.15153 -39.65763 1.49390 1.92796 -39.85824 642.94489
1395.0000 -41.31330 -39.84073 1.47257 1.93192 -39.83100 692.90418
1400.0000 -41.69096 -40.32218 1.36877 1.84190 -40.44929 559.40941
1405.0000 -42.36375 -41.14345 1.22030 1.79834 -40.74850 476.79186
1410.0000 -41.42638 -40.00370 1.42268 1.81570 -40.62925 527.45473
1415.0000 -41.69094 -40.12842 1.56253 1.89450 -40.08807 601.43451
1420.0000 -41.62649 -40.69318 0.93331 1.84076 -40.45715 523.96067
1425.0000 -41.53212 -40.62636 0.90576 1.80928 -40.67338 493.17578
1430.0000 -41.65447 -40.15184 1.50262 1.82558 -40.56137 523.71024
1435.0000 -41.27655 -40.10030 1.17625 1.87679 -40.20967 578.18380
1440.0000 -41.39881 -40.00915 1.38967 1.90058 -40.04630 559.86010
1445.0000 -41.47105 -40.41607 1.05498 1.86304 -40.30410 581.35249
1450.0000 -41.52580 -40.21878 1.30702 1.88585 -40.14747 576.68587
1455.0000 -41.67269 -40.38077 1.29193 1.84669 -40.41643 546.09054
1460.0000 -41.96173 -41.02560 0.93613 1.75402 -41.05289 426.97067
1465.0000 -42.08328 -40.83462 1.24866 1.81682 -40.62158 501.60967
1470.0000 -41.86009 -40.85540 1.00469 1.75508 -41.04564 393.08996
1475.0000 -41.67204 -40.38817 1.28387 1.82198 -40.58609 509.55165
1480.0000 -41.12268 -39.85841 1.26427 1.86976 -40.25792 576.71163
1485.0000 -41.69412 -40.33407 1.36006 1.87998 -40.18779 594.89235
1490.0000 -41.26838 -40.11139 1.15698 1.83175 -40.51903 526.27292
1495.0000 -41.69883 -40.46314 1.23570 1.85637 -40.34991 605.19834
1500.0000 -41.58239 -40.46885 1.11355 1.87009 -40.25566 560.98167
MELTING PROCESS: loop number 7 T-loop= 528.00000000000000
main_MD> interactions number 7 at Temperature= 528.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.40579 0.21354 -2.74260
force_rgl> df(natom) 4.41304 0.65605 2.96254
1505.0000 -41.44274 -40.01354 1.42921 1.87889 -40.19525 562.53734
1510.0000 -41.63448 -40.52553 1.10895 1.90513 -40.01502 612.84733
1515.0000 -41.34983 -40.01504 1.33479 1.88017 -40.18647 592.88171
1520.0000 -41.58891 -40.39970 1.18921 1.84086 -40.45647 545.76004
1525.0000 -41.80677 -40.71354 1.09323 1.85306 -40.37267 585.08091
1530.0000 -41.89730 -40.51365 1.38365 1.81431 -40.63882 552.76794
1535.0000 -41.98551 -41.00707 0.97844 1.81646 -40.62406 534.85461
1540.0000 -41.95299 -40.97572 0.97727 1.80331 -40.71433 503.37132
1545.0000 -41.35780 -40.35022 1.00758 1.83564 -40.49231 533.00579
1550.0000 -41.74269 -40.36066 1.38203 1.87716 -40.20714 625.71266
1555.0000 -41.33276 -40.12289 1.20987 1.90414 -40.02180 602.78500
1560.0000 -40.65412 -39.55336 1.10076 1.92855 -39.85414 668.71856
1565.0000 -41.44284 -39.93471 1.50813 1.92238 -39.89654 608.01957
1570.0000 -41.98941 -40.22274 1.76668 1.88724 -40.13792 595.36208
1575.0000 -41.83860 -40.30285 1.53576 1.85246 -40.37677 594.47530
1580.0000 -41.92233 -40.23333 1.68900 1.88566 -40.14876 620.74603
1585.0000 -41.99823 -40.90018 1.09805 1.80234 -40.72098 494.12438
1590.0000 -41.94670 -40.61540 1.33130 1.78622 -40.83170 506.39458
1595.0000 -41.39856 -39.93704 1.46152 1.84443 -40.43192 556.73621
1600.0000 -41.19222 -39.75339 1.43883 1.92530 -39.87647 639.83963
1605.0000 -41.33934 -40.30350 1.03584 1.90632 -40.00688 612.80839
1610.0000 -41.68043 -40.34660 1.33383 1.84929 -40.39853 552.98952
1615.0000 -41.63578 -40.67374 0.96204 1.79896 -40.74420 469.97156
1620.0000 -41.79034 -40.55484 1.23550 1.82106 -40.59245 511.46654
1625.0000 -41.52609 -40.15364 1.37245 1.87396 -40.22913 576.53221
1630.0000 -41.37598 -40.08496 1.29103 1.85104 -40.38655 572.79099
1635.0000 -41.53756 -40.27368 1.26388 1.88106 -40.18032 581.75613
1640.0000 -41.24633 -39.75677 1.48955 1.92910 -39.85040 644.82385
1645.0000 -40.97699 -39.32736 1.64964 1.98143 -39.49094 712.97496
1650.0000 -41.65425 -40.39352 1.26073 1.96445 -39.60758 680.99857
1655.0000 -41.84546 -40.89182 0.95365 1.80921 -40.67385 478.39434
1660.0000 -41.66924 -40.26766 1.40158 1.81586 -40.62815 447.34933
1665.0000 -41.70195 -40.46625 1.23570 1.85390 -40.36686 568.80665
1670.0000 -41.94841 -40.78585 1.16256 1.81477 -40.63566 551.94433
1675.0000 -41.71067 -40.18792 1.52275 1.83168 -40.51950 549.00549
1680.0000 -41.97139 -40.55750 1.41389 1.85750 -40.34216 572.12442
1685.0000 -41.25781 -40.28779 0.97002 1.86280 -40.30573 593.66371
1690.0000 -41.92841 -40.46662 1.46178 1.84999 -40.39374 545.78694
1695.0000 -41.02682 -39.40319 1.62363 1.92745 -39.86174 605.34896
1700.0000 -41.15944 -39.74258 1.41686 1.97455 -39.53820 665.08201
1705.0000 -42.34228 -40.96462 1.37766 1.88262 -40.16960 584.07958
1710.0000 -41.99511 -40.45746 1.53765 1.79543 -40.76849 496.45578
1715.0000 -41.98087 -40.95362 1.02725 1.80694 -40.68940 528.88882
1720.0000 -41.67191 -40.65334 1.01857 1.77361 -40.91835 473.91654
1725.0000 -41.82653 -40.70164 1.12489 1.80604 -40.69562 519.39021
1730.0000 -41.88621 -40.65828 1.22793 1.79877 -40.74556 500.42769
1735.0000 -41.73110 -40.64163 1.08947 1.84844 -40.40435 571.65264
1740.0000 -41.77641 -40.72466 1.05175 1.81901 -40.60655 488.13222
1745.0000 -41.83285 -40.39244 1.44041 1.83826 -40.47433 554.00185
1750.0000 -41.73933 -40.80689 0.93244 1.86028 -40.32307 620.56056
MELTING PROCESS: loop number 8 T-loop= 553.00000000000000
main_MD> interactions number 8 at Temperature= 553.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.55578 -1.10099 0.03132
force_rgl> df(natom) 3.28044 4.51736 0.73889
1755.0000 -41.86391 -40.74057 1.12334 1.79582 -40.76577 507.75079
1760.0000 -41.76383 -40.48277 1.28106 1.78671 -40.82839 477.55884
1765.0000 -41.92518 -40.73173 1.19345 1.80492 -40.70331 511.34235
1770.0000 -42.10474 -40.76083 1.34390 1.80375 -40.71130 526.69741
1775.0000 -41.49076 -40.36793 1.12283 1.80576 -40.69752 546.84159
1780.0000 -42.39934 -41.46366 0.93568 1.80417 -40.70845 504.61257
1785.0000 -41.87782 -41.08443 0.79339 1.74300 -41.12859 420.80147
1790.0000 -41.25485 -40.37711 0.87774 1.81727 -40.61848 533.47106
1795.0000 -41.20549 -39.90516 1.30033 1.88490 -40.15400 623.57488
1800.0000 -41.84066 -40.56501 1.27564 1.88081 -40.18209 601.12333
1805.0000 -41.91629 -40.47714 1.43915 1.86757 -40.27302 569.62411
1810.0000 -41.98106 -40.21455 1.76651 1.85830 -40.33665 552.71207
1815.0000 -41.75550 -40.48319 1.27232 1.84420 -40.43348 550.32630
1820.0000 -41.86331 -40.97730 0.88601 1.81497 -40.63428 508.51944
1825.0000 -41.56808 -40.00156 1.56653 1.77347 -40.91932 457.41495
1830.0000 -41.51924 -39.72328 1.79596 1.91201 -39.96775 638.54146
1835.0000 -41.14154 -39.66915 1.47239 1.92878 -39.85260 648.05570
1840.0000 -40.72625 -39.59462 1.13164 1.95853 -39.64823 647.55146
1845.0000 -41.36106 -39.75891 1.60215 1.92718 -39.86358 685.55857
1850.0000 -41.46290 -40.07686 1.38605 1.90737 -39.99966 639.84779
1855.0000 -41.58705 -40.69650 0.89055 1.83608 -40.48929 547.91449
1860.0000 -41.50381 -40.37311 1.13070 1.82505 -40.56506 515.85241
1865.0000 -41.83164 -40.49797 1.33367 1.84787 -40.40832 558.22888
1870.0000 -41.85947 -41.00713 0.85234 1.77968 -40.87665 479.53064
1875.0000 -42.24807 -41.38792 0.86015 1.74132 -41.14013 407.24673
1880.0000 -41.62236 -40.58314 1.03922 1.78448 -40.84367 479.57407
1885.0000 -41.70579 -40.26311 1.44268 1.84471 -40.43003 573.31775
1890.0000 -41.47457 -40.32955 1.14501 1.83661 -40.48566 533.05939
1895.0000 -41.51729 -40.44175 1.07555 1.82265 -40.58153 482.65644
1900.0000 -41.26919 -39.55951 1.70969 1.93579 -39.80442 630.76456
1905.0000 -41.99270 -40.54120 1.45150 1.91683 -39.93465 648.39523
1910.0000 -41.84267 -41.11456 0.72811 1.77011 -40.94237 468.86965
1915.0000 -41.58253 -40.61855 0.96397 1.75438 -41.05042 426.89039
1920.0000 -41.70682 -40.83375 0.87307 1.81943 -40.60364 513.45952
1925.0000 -41.53749 -40.16402 1.37347 1.81497 -40.63428 503.45301
1930.0000 -41.93163 -40.38501 1.54661 1.83496 -40.49695 517.52364
1935.0000 -41.90250 -40.99023 0.91226 1.81549 -40.63069 506.62907
1940.0000 -41.39461 -40.04193 1.35268 1.82943 -40.53496 507.48266
1945.0000 -41.71477 -40.16383 1.55094 1.88448 -40.15684 597.53424
1950.0000 -42.06789 -40.53431 1.53359 1.86837 -40.26753 596.82525
1955.0000 -41.85134 -40.16076 1.69058 1.89140 -40.10934 610.68452
1960.0000 -40.99923 -39.54862 1.45061 1.94471 -39.74319 686.89298
1965.0000 -41.27130 -39.59486 1.67644 1.93343 -39.82062 644.18991
1970.0000 -41.47932 -40.04154 1.43778 1.95816 -39.65082 670.31667
1975.0000 -41.32285 -39.82896 1.49388 1.91894 -39.92020 699.01658
1980.0000 -41.71176 -40.57358 1.13817 1.85623 -40.35090 563.09938
1985.0000 -41.83824 -40.73831 1.09992 1.81828 -40.61154 511.63275
1990.0000 -41.41925 -39.85840 1.56084 1.87786 -40.20233 549.54205
1995.0000 -42.03958 -39.98972 2.04986 1.90962 -39.98417 647.74145
2000.0000 -41.21944 -39.92658 1.29286 1.87509 -40.22134 577.50467
MELTING PROCESS: loop number 9 T-loop= 578.00000000000000
main_MD> interactions number 9 at Temperature= 578.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.82403 0.46857 1.68753
force_rgl> df(natom) -1.06218 2.37845 -1.37827
2005.0000 -41.21798 -39.79251 1.42548 1.90832 -39.99312 621.97917
2010.0000 -40.85170 -39.43084 1.42086 1.99667 -39.38627 705.32904
2015.0000 -41.21405 -39.88989 1.32417 1.94705 -39.72708 652.84805
2020.0000 -41.43073 -40.63095 0.79978 1.89397 -40.09167 622.10098
2025.0000 -41.02395 -39.87090 1.15305 1.86241 -40.30844 553.90512
2030.0000 -41.34009 -40.05574 1.28435 1.92508 -39.87799 643.53394
2035.0000 -41.42220 -40.22197 1.20023 1.87526 -40.22016 581.49016
2040.0000 -41.39656 -40.25758 1.13898 1.88265 -40.16942 593.56717
2045.0000 -41.70443 -40.76748 0.93695 1.81101 -40.66148 521.89647
2050.0000 -42.02394 -40.72012 1.30382 1.81257 -40.65074 503.57443
2055.0000 -41.79074 -40.48386 1.30688 1.82823 -40.54320 522.71916
2060.0000 -41.76609 -40.38634 1.37975 1.84334 -40.43940 529.97990
2065.0000 -41.77139 -40.48176 1.28962 1.83261 -40.51313 545.49912
2070.0000 -41.82627 -40.57724 1.24903 1.83719 -40.48169 527.76850
2075.0000 -41.99626 -41.10148 0.89478 1.81944 -40.60354 537.46937
2080.0000 -41.75649 -40.40746 1.34903 1.80658 -40.69192 536.51560
2085.0000 -41.81019 -40.77364 1.03656 1.86182 -40.31252 578.21190
2090.0000 -41.14095 -39.27149 1.86946 1.88377 -40.16170 625.75651
2095.0000 -41.38766 -39.59149 1.79617 1.98322 -39.47867 737.34020
2100.0000 -41.50301 -39.92575 1.57726 1.97236 -39.55326 709.31104
2105.0000 -40.59235 -39.27752 1.31483 1.93551 -39.80635 631.94102
2110.0000 -40.98865 -39.19840 1.79025 2.09981 -38.67792 785.77274
2115.0000 -41.12951 -39.29254 1.83697 1.98542 -39.46354 657.72172
2120.0000 -42.06467 -40.72132 1.34335 1.94910 -39.71305 661.99043
2125.0000 -41.74918 -40.30623 1.44295 1.86480 -40.29202 549.54287
2130.0000 -42.13180 -40.93931 1.19250 1.82020 -40.59836 505.14910
2135.0000 -41.15289 -40.08385 1.06904 1.80827 -40.68027 520.80692
2140.0000 -41.36950 -39.80616 1.56335 1.93614 -39.80207 620.51006
2145.0000 -41.17188 -39.48079 1.69110 1.94396 -39.74830 639.13024
2150.0000 -41.47841 -39.65289 1.82553 2.00903 -39.30144 780.93755
2155.0000 -41.46955 -40.50441 0.96514 1.88118 -40.17950 595.71698
2160.0000 -41.45309 -39.78676 1.66633 1.88926 -40.12402 588.15688
2165.0000 -41.51329 -40.24440 1.26889 1.88853 -40.12902 627.79349
2170.0000 -42.10768 -40.76409 1.34359 1.85069 -40.38890 563.50935
2175.0000 -41.79826 -40.24112 1.55714 1.86362 -40.30010 575.56084
2180.0000 -41.74347 -39.93092 1.81255 1.93091 -39.83793 637.74276
2185.0000 -41.94280 -40.75827 1.18453 1.86298 -40.30453 576.79383
2190.0000 -41.63249 -40.52313 1.10936 1.82898 -40.53805 500.17489
2195.0000 -41.63907 -40.22521 1.41386 1.83388 -40.50442 548.25075
2200.0000 -41.36972 -39.86357 1.50615 1.91894 -39.92017 636.90062
2205.0000 -41.58045 -40.26832 1.31213 1.86674 -40.27867 579.95750
2210.0000 -41.45599 -40.24592 1.21008 1.86007 -40.32452 564.67462
2215.0000 -41.37612 -39.88712 1.48900 1.88371 -40.16217 618.64269
2220.0000 -41.70873 -40.10686 1.60187 1.92219 -39.89785 648.25651
2225.0000 -41.47270 -40.04845 1.42426 1.90711 -40.00141 603.42837
2230.0000 -41.41102 -40.05241 1.35860 1.91364 -39.95656 615.89334
2235.0000 -41.50121 -40.10073 1.40048 1.90821 -39.99389 586.87485
2240.0000 -41.68271 -40.27772 1.40499 1.90182 -40.03773 611.12369
2245.0000 -41.61751 -40.16553 1.45198 1.86569 -40.28588 576.52159
2250.0000 -41.68028 -40.07080 1.60948 1.91334 -39.95864 622.96544
MELTING PROCESS: loop number 10 T-loop= 603.00000000000000
main_MD> interactions number 10 at Temperature= 603.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.16287 -3.36263 1.16176
force_rgl> df(natom) -0.81056 1.63401 -1.99007
2255.0000 -40.83278 -39.37649 1.45630 1.93653 -39.79938 637.67222
2260.0000 -41.61996 -39.69317 1.92679 1.95524 -39.67083 691.53586
2265.0000 -41.13705 -40.01713 1.11992 1.89650 -40.07429 598.83127
2270.0000 -41.50723 -40.65039 0.85684 1.84573 -40.42302 537.24361
2275.0000 -41.65874 -40.76843 0.89032 1.80061 -40.73292 484.59826
2280.0000 -41.62297 -40.37814 1.24483 1.82936 -40.53543 524.34048
2285.0000 -42.00729 -40.91565 1.09164 1.84111 -40.45475 544.84462
2290.0000 -41.57955 -40.56579 1.01377 1.80602 -40.69577 499.59463
2295.0000 -42.01231 -40.01992 1.99238 1.85748 -40.34232 574.78002
2300.0000 -42.15924 -40.83647 1.32277 1.86082 -40.31936 620.98274
2305.0000 -41.42475 -40.09552 1.32923 1.81902 -40.60645 517.10369
2310.0000 -41.42377 -40.22148 1.20230 1.86823 -40.26844 578.57782
2315.0000 -42.02331 -40.10582 1.91749 1.85753 -40.34193 566.75635
2320.0000 -41.19466 -39.74926 1.44540 1.94048 -39.77224 681.77346
2325.0000 -42.05347 -40.32527 1.72820 1.88024 -40.18597 619.20367
2330.0000 -41.55255 -39.91987 1.63268 1.87297 -40.23590 578.04840
2335.0000 -41.33353 -40.34500 0.98853 1.90969 -39.98372 590.48202
2340.0000 -41.54134 -40.49833 1.04301 1.85070 -40.38883 553.50741
2345.0000 -41.68148 -40.38813 1.29335 1.84113 -40.45457 545.10809
2350.0000 -41.33272 -40.21592 1.11681 1.86446 -40.29434 572.76510
2355.0000 -41.77399 -40.68311 1.09088 1.83874 -40.47099 525.53301
2360.0000 -41.41543 -40.42911 0.98632 1.83174 -40.51909 565.46767
2365.0000 -41.29535 -40.18328 1.11207 1.84374 -40.43664 549.89958
2370.0000 -41.80146 -39.88597 1.91549 1.93346 -39.82043 653.51932
2375.0000 -41.33619 -39.79126 1.54493 1.92588 -39.87252 639.18846
2380.0000 -41.21083 -39.92141 1.28942 1.88444 -40.15711 577.30306
2385.0000 -41.66690 -39.87266 1.79424 1.91922 -39.91825 695.19433
2390.0000 -41.88894 -39.92644 1.96251 1.94312 -39.75409 676.65061
2395.0000 -41.37597 -39.66667 1.70930 1.93125 -39.83560 637.66951
2400.0000 -41.89863 -40.29943 1.59920 1.94535 -39.73876 672.60234
2405.0000 -41.87336 -40.93482 0.93854 1.82372 -40.57416 524.66213
2410.0000 -41.89937 -40.68092 1.21846 1.79913 -40.74304 486.53824
2415.0000 -41.75259 -40.28897 1.46362 1.82504 -40.56507 530.93469
2420.0000 -41.38115 -39.34804 2.03311 1.89168 -40.10739 625.34626
2425.0000 -41.59768 -40.13514 1.46254 1.93722 -39.79465 685.37723
2430.0000 -41.85124 -40.40675 1.44449 1.92083 -39.90721 634.15167
2435.0000 -41.97635 -40.57889 1.39746 1.83346 -40.50727 545.24438
2440.0000 -41.53305 -40.37180 1.16125 1.83966 -40.46468 530.59679
2445.0000 -41.56914 -40.43028 1.13886 1.87601 -40.21502 604.38766
2450.0000 -41.75343 -40.66368 1.08975 1.84707 -40.41382 566.97485
2455.0000 -41.62580 -40.38467 1.24112 1.83873 -40.47109 511.57018
2460.0000 -41.32313 -39.92075 1.40238 1.89594 -40.07817 610.15148
2465.0000 -41.30079 -40.40754 0.89325 1.87921 -40.19303 608.02373
2470.0000 -42.13572 -40.73307 1.40265 1.87157 -40.24552 579.51839
2475.0000 -41.60702 -40.37040 1.23662 1.80048 -40.73380 498.03015
2480.0000 -41.48413 -40.52296 0.96117 1.81781 -40.61476 528.52413
2485.0000 -41.60684 -40.30208 1.30475 1.84800 -40.40738 549.20667
2490.0000 -42.12823 -41.09340 1.03484 1.83007 -40.53058 554.12221
2495.0000 -41.62945 -40.59797 1.03148 1.79046 -40.80260 479.08319
2500.0000 -42.13974 -40.61458 1.52516 1.82485 -40.56643 529.10657
MELTING PROCESS: loop number 11 T-loop= 628.00000000000000
main_MD> interactions number 11 at Temperature= 628.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.28687 0.34809 0.77122
force_rgl> df(natom) 2.45275 -1.53722 -1.67192
2505.0000 -41.40350 -40.18228 1.22122 1.87909 -40.19388 582.21778
2510.0000 -41.99665 -39.91582 2.08082 1.85632 -40.35023 586.12036
2515.0000 -41.26755 -39.70816 1.55939 1.95104 -39.69972 680.22514
2520.0000 -41.02357 -38.91039 2.11318 1.99395 -39.40500 707.93370
2525.0000 -41.35604 -39.59900 1.75704 2.04124 -39.08021 753.04325
2530.0000 -41.16771 -39.96395 1.20376 1.96010 -39.63748 673.76941
2535.0000 -41.82114 -40.47532 1.34582 1.86972 -40.25822 494.54871
2540.0000 -41.87693 -40.11658 1.76035 1.85797 -40.33896 578.97310
2545.0000 -41.67065 -39.92820 1.74245 1.88566 -40.14877 596.38905
2550.0000 -42.01206 -40.40828 1.60377 1.86953 -40.25952 606.72949
2555.0000 -41.41401 -40.25810 1.15592 1.85937 -40.32935 603.42771
2560.0000 -41.51788 -40.19060 1.32728 1.90267 -40.03192 592.53615
2565.0000 -41.67300 -39.97860 1.69440 1.87203 -40.24234 594.94717
2570.0000 -41.22497 -39.58491 1.64005 1.97304 -39.54857 735.28589
2575.0000 -40.92605 -39.35031 1.57574 1.96714 -39.58909 701.63161
2580.0000 -41.29113 -39.76776 1.52337 1.98709 -39.45211 716.75086
2585.0000 -41.70499 -40.71639 0.98860 1.92018 -39.91163 634.12091
2590.0000 -41.58695 -40.03047 1.55649 1.84703 -40.41407 546.90337
2595.0000 -41.82591 -40.37195 1.45395 1.89146 -40.10894 611.68763
2600.0000 -41.43793 -39.84102 1.59691 1.90031 -40.04809 623.80053
2605.0000 -41.36009 -40.28611 1.07399 1.95572 -39.66756 698.68500
2610.0000 -41.15618 -39.79030 1.36588 1.92825 -39.85624 632.00921
2615.0000 -42.18093 -40.74983 1.43110 1.88109 -40.18011 586.00953
2620.0000 -41.58064 -40.52207 1.05857 1.81031 -40.66625 506.10721
2625.0000 -41.44045 -39.99649 1.44397 1.87277 -40.23726 572.97875
2630.0000 -41.98636 -40.65598 1.33039 1.86440 -40.29474 581.33031
2635.0000 -42.00193 -40.48062 1.52130 1.81106 -40.66109 511.68308
2640.0000 -41.98296 -40.99153 0.99143 1.83508 -40.49614 572.52219
2645.0000 -42.07275 -40.80131 1.27145 1.78897 -40.81284 472.09876
2650.0000 -41.83234 -40.75330 1.07904 1.80271 -40.71851 543.39907
2655.0000 -41.58389 -40.06615 1.51774 1.84655 -40.41735 558.45279
2660.0000 -40.41131 -39.07946 1.33185 2.00360 -39.33867 751.80682
2665.0000 -41.37976 -40.25378 1.12597 1.88613 -40.14552 574.28891
2670.0000 -41.47259 -39.84833 1.62426 1.90351 -40.02613 641.28898
2675.0000 -41.70734 -40.76661 0.94073 1.88941 -40.12298 606.83647
2680.0000 -41.64217 -40.17202 1.47016 1.86128 -40.31617 583.33096
2685.0000 -42.01532 -40.69898 1.31634 1.85194 -40.38032 550.10000
2690.0000 -41.64373 -40.36783 1.27589 1.82922 -40.53642 514.97972
2695.0000 -41.08301 -38.88887 2.19414 1.94772 -39.72249 644.55210
2700.0000 -40.66659 -39.41448 1.25212 2.03046 -39.15424 761.36613
2705.0000 -40.80456 -39.31997 1.48459 1.97555 -39.53135 684.75874
2710.0000 -41.14463 -39.81516 1.32947 1.98208 -39.48650 705.89538
2715.0000 -41.36091 -39.63036 1.73055 1.93236 -39.82800 691.23143
2720.0000 -41.19238 -39.38136 1.81102 1.93919 -39.78106 699.06180
2725.0000 -41.11056 -39.65712 1.45345 1.99409 -39.40405 722.47262
2730.0000 -41.29846 -39.75744 1.54101 1.94263 -39.75744 660.02936
2735.0000 -41.01292 -39.37595 1.63697 1.96976 -39.57114 699.16176
2740.0000 -41.13048 -39.62708 1.50341 1.95827 -39.65007 666.51433
2745.0000 -40.92265 -39.59763 1.32502 1.92598 -39.87180 639.18157
2750.0000 -40.76388 -39.19643 1.56746 1.99761 -39.37987 673.89110
MELTING PROCESS: loop number 12 T-loop= 653.00000000000000
main_MD> interactions number 12 at Temperature= 653.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.51769 0.20632 -4.59074
force_rgl> df(natom) 4.40783 6.26547 4.58763
2755.0000 -40.74194 -39.35181 1.39014 2.00367 -39.33820 697.89621
2760.0000 -41.17843 -39.49596 1.68247 1.98468 -39.46868 728.62334
2765.0000 -41.43903 -40.10096 1.33807 1.91944 -39.91677 662.83993
2770.0000 -41.67022 -40.28832 1.38190 1.88873 -40.12769 587.03353
2775.0000 -41.37607 -39.66392 1.71215 1.87551 -40.21849 595.85642
2780.0000 -40.86992 -39.12227 1.74765 1.96929 -39.57438 654.33749
2785.0000 -41.63115 -40.06239 1.56876 1.97733 -39.51913 754.36262
2790.0000 -41.49212 -39.82410 1.66802 1.95765 -39.65427 696.60462
2795.0000 -41.47828 -40.02126 1.45702 1.95944 -39.64200 655.47632
2800.0000 -41.55367 -39.77776 1.77591 1.95892 -39.64557 689.69611
2805.0000 -41.42193 -39.96048 1.46144 1.93947 -39.77920 700.54044
2810.0000 -41.74632 -39.91112 1.83520 1.90659 -40.00499 651.70551
2815.0000 -41.48887 -40.25485 1.23403 1.89784 -40.06509 578.35635
2820.0000 -41.64622 -40.19350 1.45272 1.88389 -40.16089 588.51981
2825.0000 -41.68489 -40.40151 1.28338 1.86147 -40.31488 551.26270
2830.0000 -41.76720 -40.39990 1.36730 1.85432 -40.36401 534.37287
2835.0000 -41.98376 -40.21660 1.76717 1.84687 -40.41516 569.76800
2840.0000 -41.45065 -40.18113 1.26951 1.86067 -40.32039 581.56484
2845.0000 -41.05977 -39.87472 1.18506 1.89768 -40.06620 605.66297
2850.0000 -41.29636 -39.55906 1.73731 1.96377 -39.61225 758.21685
2855.0000 -41.27197 -39.79895 1.47302 1.93905 -39.78203 639.00483
2860.0000 -40.81706 -39.25152 1.56553 1.94662 -39.73004 626.60926
2865.0000 -41.63030 -40.17845 1.45185 1.93349 -39.82023 670.21468
2870.0000 -41.73628 -40.44274 1.29354 1.85743 -40.34263 599.02015
2875.0000 -41.72456 -40.50563 1.21894 1.86063 -40.32066 594.56058
2880.0000 -41.88499 -40.69320 1.19179 1.78943 -40.80969 488.03446
2885.0000 -41.69202 -40.19239 1.49963 1.87466 -40.22428 618.86923
2890.0000 -41.39404 -39.45413 1.93991 1.94568 -39.73653 657.84118
2895.0000 -41.10837 -40.07317 1.03520 1.96905 -39.57597 671.84693
2900.0000 -41.42339 -39.84869 1.57471 1.93929 -39.78043 634.60730
2905.0000 -41.04610 -39.74834 1.29776 1.89002 -40.11879 594.92654
2910.0000 -41.57609 -39.90093 1.67516 1.92470 -39.88058 654.49718
2915.0000 -41.16921 -39.55529 1.61392 1.97595 -39.52864 696.31490
2920.0000 -41.15866 -39.97895 1.17971 1.95442 -39.67650 684.47887
2925.0000 -41.71204 -40.33001 1.38203 1.87113 -40.24858 577.45058
2930.0000 -41.13716 -39.76485 1.37231 1.92377 -39.88697 614.30283
2935.0000 -41.36382 -39.49031 1.87351 1.96163 -39.62700 682.95619
2940.0000 -41.81838 -40.16280 1.65558 1.92157 -39.90213 643.48610
2945.0000 -41.57896 -39.96699 1.61196 1.91731 -39.93134 609.68566
2950.0000 -41.58864 -39.80554 1.78310 1.88804 -40.13241 621.87399
2955.0000 -41.50489 -40.16017 1.34472 1.89186 -40.10616 582.21239
2960.0000 -40.60596 -38.96749 1.63847 1.96718 -39.58881 693.08134
2965.0000 -40.52040 -39.29800 1.22240 2.01679 -39.24809 765.02593
2970.0000 -41.01509 -39.05706 1.95803 1.99079 -39.42669 686.98679
2975.0000 -41.05749 -39.61014 1.44735 1.99700 -39.38404 692.40535
2980.0000 -40.98094 -39.30750 1.67344 1.98110 -39.49321 689.77384
2985.0000 -40.91218 -39.72100 1.19118 1.98541 -39.46366 682.82142
2990.0000 -40.82166 -38.94661 1.87505 2.01992 -39.22663 752.48481
2995.0000 -40.28632 -38.64538 1.64094 2.12148 -38.52905 872.41375
3000.0000 -41.15715 -38.90337 2.25377 2.08950 -38.74869 869.81770
MELTING PROCESS: loop number 13 T-loop= 678.00000000000000
main_MD> interactions number 13 at Temperature= 678.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.23177 2.23083 1.51335
force_rgl> df(natom) -1.62449 0.60776 0.54488
3005.0000 -41.48193 -38.92433 2.55760 2.05148 -39.00988 805.94302
3010.0000 -41.51590 -39.79809 1.71781 1.92172 -39.90111 605.39043
3015.0000 -41.01066 -38.90128 2.10937 1.98362 -39.47593 713.38710
3020.0000 -41.46882 -40.21736 1.25147 1.97097 -39.56279 721.77594
3025.0000 -40.96686 -39.74258 1.22428 1.90668 -40.00441 622.34091
3030.0000 -41.14596 -39.31687 1.82910 1.97243 -39.55281 699.14761
3035.0000 -41.60785 -40.08909 1.51876 1.96353 -39.61392 701.38440
3040.0000 -41.58838 -40.27231 1.31607 1.93145 -39.83424 640.52751
3045.0000 -41.43248 -40.43116 1.00132 1.87172 -40.24451 550.55432
3050.0000 -41.33354 -39.57750 1.75604 1.93041 -39.84139 649.62964
3055.0000 -41.62394 -39.77642 1.84752 1.89763 -40.06656 637.00165
3060.0000 -41.40973 -40.04796 1.36177 1.94039 -39.77286 683.31857
3065.0000 -41.05988 -39.49261 1.56727 1.95656 -39.66182 647.05648
3070.0000 -41.34137 -39.72102 1.62035 1.97304 -39.54859 688.05207
3075.0000 -41.35252 -39.49392 1.85860 1.95707 -39.65831 751.44889
3080.0000 -41.41588 -39.97165 1.44423 1.92784 -39.85906 659.12939
3085.0000 -41.51384 -39.70695 1.80689 1.91205 -39.96749 635.68623
3090.0000 -41.65328 -39.69171 1.96157 1.94694 -39.72787 720.00943
3095.0000 -41.38017 -39.91570 1.46447 1.94927 -39.71188 688.30869
3100.0000 -41.99977 -40.56604 1.43373 1.87509 -40.22135 602.29491
3105.0000 -41.43538 -40.20112 1.23426 1.87258 -40.23856 593.15444
3110.0000 -41.72619 -40.03898 1.68721 1.90980 -39.98297 652.45926
3115.0000 -41.35652 -40.28961 1.06691 1.90688 -40.00298 605.81266
3120.0000 -41.54587 -39.74902 1.79684 1.93097 -39.83758 713.63457
3125.0000 -41.27303 -39.94504 1.32799 1.91538 -39.94461 626.55881
3130.0000 -41.37732 -40.01154 1.36578 1.88827 -40.13080 553.08172
3135.0000 -41.66885 -39.84455 1.82429 1.90772 -39.99727 630.10627
3140.0000 -41.42141 -39.71508 1.70633 1.93705 -39.79578 630.70833
3145.0000 -41.12721 -39.89530 1.23191 1.91826 -39.92482 666.69813
3150.0000 -41.02165 -39.78371 1.23793 1.89812 -40.06320 616.47609
3155.0000 -41.62464 -40.27106 1.35358 1.94049 -39.77219 666.10195
3160.0000 -41.73293 -40.10917 1.62376 1.85713 -40.34468 582.32033
3165.0000 -41.61999 -39.98690 1.63309 1.91259 -39.96376 614.06040
3170.0000 -41.60712 -40.33066 1.27645 1.89732 -40.06863 624.03974
3175.0000 -41.56595 -39.98134 1.58462 1.88187 -40.17481 615.59019
3180.0000 -41.01758 -39.70314 1.31444 1.92786 -39.85890 691.60045
3185.0000 -41.42889 -39.45388 1.97501 1.99770 -39.37924 734.43729
3190.0000 -40.48035 -38.83291 1.64744 2.02906 -39.16385 747.96906
3195.0000 -41.42696 -39.33796 2.08900 2.09555 -38.70720 847.45280
3200.0000 -40.96608 -39.18992 1.77616 1.99707 -39.38355 726.60244
3205.0000 -40.67861 -39.08966 1.58896 2.01205 -39.28064 766.10802
3210.0000 -41.50994 -39.53166 1.97828 2.00934 -39.29931 719.99364
3215.0000 -40.92509 -39.57821 1.34688 1.93998 -39.77569 666.25851
3220.0000 -41.98505 -40.34972 1.63533 1.93736 -39.79367 682.33487
3225.0000 -40.61261 -39.18122 1.43139 1.95729 -39.65677 660.43948
3230.0000 -40.88990 -39.38780 1.50211 1.98984 -39.43320 705.63269
3235.0000 -41.02074 -39.54259 1.47815 1.99961 -39.36609 733.17443
3240.0000 -40.93837 -39.06191 1.87646 2.01272 -39.27606 769.53251
3245.0000 -40.43501 -38.66890 1.76611 2.07192 -38.86945 805.34479
3250.0000 -40.57798 -38.30531 2.27267 2.07690 -38.83525 793.18595
MELTING PROCESS: loop number 14 T-loop= 703.00000000000000
main_MD> interactions number 14 at Temperature= 703.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.19371 0.12052 -2.68685
force_rgl> df(natom) 0.46079 -0.13367 -3.84750
3255.0000 -39.99509 -37.89855 2.09654 2.17583 -38.15576 886.42605
3260.0000 -41.06112 -38.81883 2.24229 2.13597 -38.42953 850.74356
3265.0000 -41.36719 -39.68682 1.68037 2.00255 -39.34593 728.55295
3270.0000 -41.21515 -39.79514 1.42001 1.98411 -39.47259 719.69231
3275.0000 -41.51282 -39.87540 1.63742 1.95453 -39.67574 693.46060
3280.0000 -41.49874 -40.27532 1.22342 1.93489 -39.81066 659.73673
3285.0000 -40.62999 -39.40029 1.22970 1.91450 -39.95065 619.68219
3290.0000 -41.09748 -39.77858 1.31890 1.97374 -39.54376 699.18341
3295.0000 -41.45666 -39.48509 1.97157 1.92934 -39.84872 626.03374
3300.0000 -40.85693 -39.51641 1.34052 1.98375 -39.47507 727.95462
3305.0000 -41.13791 -38.90988 2.22803 2.03122 -39.14900 766.99078
3310.0000 -40.75522 -38.81068 1.94454 2.08492 -38.78015 839.63739
3315.0000 -41.11594 -39.45679 1.65915 1.98754 -39.44900 712.44052
3320.0000 -41.32059 -39.97055 1.35004 1.95065 -39.70235 684.34309
3325.0000 -41.03673 -39.14869 1.88803 2.00284 -39.34389 770.66481
3330.0000 -40.54813 -38.50917 2.03897 2.07251 -38.86540 807.31036
3335.0000 -40.02352 -38.31710 1.70642 2.14819 -38.34563 833.85951
3340.0000 -40.65051 -39.01123 1.63928 2.08825 -38.75728 816.63107
3345.0000 -40.93376 -38.70492 2.22884 2.10314 -38.65502 821.70622
3350.0000 -40.69536 -39.50868 1.18668 2.02177 -39.21391 760.01632
3355.0000 -41.31084 -39.54259 1.76826 1.98576 -39.46126 737.30254
3360.0000 -41.29340 -39.47760 1.81581 1.91149 -39.97134 611.03028
3365.0000 -41.23495 -39.21956 2.01539 1.98560 -39.46231 711.23733
3370.0000 -41.78107 -39.77233 2.00875 1.95387 -39.68028 735.01108
3375.0000 -40.87659 -39.07743 1.79916 1.98885 -39.43999 755.44537
3380.0000 -41.12056 -39.47499 1.64557 1.97604 -39.52801 729.14619
3385.0000 -41.52078 -39.67510 1.84568 1.90515 -40.01490 614.29019
3390.0000 -41.60253 -39.57753 2.02499 1.94770 -39.72262 682.36877
3395.0000 -40.93642 -39.41196 1.52447 1.95328 -39.68432 682.50077
3400.0000 -40.95330 -39.47619 1.47712 1.99225 -39.41668 687.22236
3405.0000 -41.01187 -38.71671 2.29516 2.05689 -38.97269 803.15560
3410.0000 -40.56498 -38.23950 2.32549 2.13160 -38.45956 796.53288
3415.0000 -40.76415 -38.78433 1.97982 2.10127 -38.66785 836.05440
3420.0000 -40.82413 -39.04060 1.78353 2.07155 -38.87203 838.67529
3425.0000 -41.35564 -39.46188 1.89376 2.04214 -39.07399 774.11547
3430.0000 -41.55251 -40.28036 1.27214 1.92533 -39.87631 642.69113
3435.0000 -41.19421 -39.95392 1.24030 1.88604 -40.14613 589.57200
3440.0000 -41.43621 -39.49736 1.93885 1.98021 -39.49932 724.19780
3445.0000 -39.79893 -38.32515 1.47379 2.06587 -38.91099 772.85421
3450.0000 -41.24326 -39.55167 1.69158 2.04802 -39.03361 803.72473
3455.0000 -41.13350 -39.36505 1.76845 1.96450 -39.60725 709.81385
3460.0000 -41.00398 -39.16666 1.83732 1.98105 -39.49360 775.61423
3465.0000 -40.77855 -38.97215 1.80640 1.99378 -39.40615 740.57132
3470.0000 -41.42319 -39.48378 1.93941 1.99922 -39.36880 725.33764
3475.0000 -41.71849 -40.41426 1.30423 1.95184 -39.69419 723.59076
3480.0000 -41.61504 -39.79066 1.82438 1.92325 -39.89056 675.54318
3485.0000 -41.95544 -40.68892 1.26652 1.81087 -40.66244 537.77126
3490.0000 -41.12914 -40.01475 1.11439 1.85052 -40.39013 550.84731
3495.0000 -41.29856 -39.78948 1.50908 1.91460 -39.94999 606.13578
3500.0000 -41.01167 -39.54470 1.46697 1.90762 -39.99790 596.88430
MELTING PROCESS: loop number 15 T-loop= 728.00000000000000
main_MD> interactions number 15 at Temperature= 728.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.20259 1.77924 -1.06207
force_rgl> df(natom) -3.45260 -2.59433 1.50620
3505.0000 -40.59012 -39.08695 1.50317 1.96638 -39.59433 670.63654
3510.0000 -40.37020 -38.91633 1.45387 2.07852 -38.82411 808.51832
3515.0000 -41.47008 -39.89283 1.57725 1.96818 -39.58199 663.03465
3520.0000 -41.55005 -40.02954 1.52051 1.91579 -39.94182 656.76775
3525.0000 -40.97732 -39.77525 1.20207 1.94506 -39.74075 677.12414
3530.0000 -40.79213 -39.26727 1.52485 2.03624 -39.11451 774.42842
3535.0000 -40.84654 -39.21305 1.63349 2.07549 -38.84493 819.46173
3540.0000 -39.91642 -38.39280 1.52362 2.06024 -38.94969 797.43658
3545.0000 -40.93206 -38.92423 2.00784 2.13418 -38.44183 882.86092
3550.0000 -41.68808 -39.85366 1.83442 2.02884 -39.16534 774.23006
3555.0000 -41.60886 -40.37735 1.23151 1.90257 -40.03263 628.18269
3560.0000 -41.01467 -39.31154 1.70312 1.92133 -39.90374 652.61469
3565.0000 -41.02255 -39.64654 1.37600 1.94915 -39.71266 723.42737
3570.0000 -41.19245 -39.21463 1.97782 1.99303 -39.41132 741.80555
3575.0000 -41.41936 -39.48693 1.93243 1.99573 -39.39276 743.61827
3580.0000 -40.98194 -38.96198 2.01996 2.01017 -39.29361 759.73455
3585.0000 -40.66578 -38.75600 1.90977 2.06468 -38.91919 823.96628
3590.0000 -40.91473 -39.22254 1.69219 2.05287 -39.00028 859.55165
3595.0000 -41.17184 -39.92178 1.25006 1.94963 -39.70937 656.61517
3600.0000 -41.17091 -39.29343 1.87748 1.96256 -39.62060 667.34805
3605.0000 -41.74396 -40.33291 1.41105 1.93405 -39.81639 669.28034
3610.0000 -41.64011 -40.31111 1.32900 1.89892 -40.05769 611.39484
3615.0000 -41.56640 -39.84447 1.72193 1.89990 -40.05095 593.81898
3620.0000 -41.14614 -40.26736 0.87878 1.93374 -39.81854 683.58285
3625.0000 -41.69832 -40.20639 1.49193 1.92869 -39.85322 624.43413
3630.0000 -41.09329 -39.32930 1.76399 1.92954 -39.84736 670.15128
3635.0000 -40.51249 -38.89073 1.62176 2.01525 -39.25868 811.39173
3640.0000 -41.24165 -39.53318 1.70847 2.02864 -39.16675 762.54248
3645.0000 -40.45305 -39.42261 1.03044 1.97920 -39.50632 672.67875
3650.0000 -41.46070 -39.13982 2.32087 2.01185 -39.28205 728.26367
3655.0000 -41.16741 -39.15994 2.00748 2.01813 -39.23890 767.70357
3660.0000 -40.83694 -39.23459 1.60235 2.02963 -39.15995 797.33579
3665.0000 -41.35052 -39.57672 1.77380 1.98735 -39.45032 709.16390
3670.0000 -41.57814 -40.03492 1.54322 1.87943 -40.19152 599.63044
3675.0000 -41.56929 -40.35152 1.21777 1.90003 -40.05004 632.79577
3680.0000 -41.10881 -39.63822 1.47060 1.91386 -39.95503 645.61396
3685.0000 -41.14126 -39.75270 1.38856 1.99992 -39.36400 722.42765
3690.0000 -41.28645 -40.05894 1.22751 1.91985 -39.91393 650.87025
3695.0000 -41.31735 -39.67397 1.64337 1.93962 -39.77814 671.84456
3700.0000 -41.44071 -40.06344 1.37727 1.93861 -39.78509 672.33948
3705.0000 -40.56716 -39.10073 1.46643 1.96012 -39.63734 679.49194
3710.0000 -41.52275 -39.64287 1.87988 1.96543 -39.60089 705.48553
3715.0000 -40.84853 -39.33284 1.51570 2.01407 -39.26677 789.99644
3720.0000 -41.14974 -39.65679 1.49295 1.98508 -39.46590 767.18513
3725.0000 -41.47830 -39.47324 2.00506 1.97274 -39.55065 702.27046
3730.0000 -41.40154 -39.59653 1.80501 1.92619 -39.87037 644.27177
3735.0000 -40.81087 -39.49308 1.31779 1.97490 -39.53584 729.69493
3740.0000 -41.35855 -39.71264 1.64591 1.96499 -39.60390 689.45335
3745.0000 -40.54838 -39.17623 1.37215 2.02670 -39.18005 816.18800
3750.0000 -40.68323 -39.16898 1.51425 2.04390 -39.06189 766.71335
MELTING PROCESS: loop number 16 T-loop= 753.00000000000000
main_MD> interactions number 16 at Temperature= 753.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.01371 1.16455 5.04005
force_rgl> df(natom) -0.64080 0.33074 -1.78823
3755.0000 -40.62291 -39.00472 1.61819 2.00162 -39.35233 760.83523
3760.0000 -41.00031 -39.41681 1.58350 2.01475 -39.26215 726.49459
3765.0000 -40.84994 -39.17376 1.67618 1.98035 -39.49839 713.22763
3770.0000 -41.41938 -39.51600 1.90338 2.01116 -39.28681 755.84559
3775.0000 -41.81970 -39.78932 2.03039 1.97218 -39.55453 731.26801
3780.0000 -42.05258 -41.17765 0.87493 1.84697 -40.41445 572.82598
3785.0000 -41.08664 -40.11851 0.96813 1.87754 -40.20454 616.95329
3790.0000 -41.88456 -39.96024 1.92431 1.89718 -40.06962 632.09811
3795.0000 -41.24705 -39.24484 2.00221 1.96639 -39.59429 694.52020
3800.0000 -39.78430 -38.08281 1.70149 2.14187 -38.38900 851.92680
3805.0000 -40.57297 -38.57437 1.99860 2.09028 -38.74337 868.80224
3810.0000 -40.84939 -39.15407 1.69531 2.06545 -38.91387 833.75516
3815.0000 -40.96879 -39.21904 1.74976 2.04534 -39.05201 799.23171
3820.0000 -40.89735 -39.56205 1.33531 2.00816 -39.30738 744.10399
3825.0000 -40.17864 -38.22731 1.95133 2.12887 -38.47833 869.27409
3830.0000 -40.73092 -39.22825 1.50267 2.06121 -38.94301 761.35769
3835.0000 -41.33491 -39.55806 1.77685 1.98901 -39.43892 708.10077
3840.0000 -40.75573 -39.25710 1.49863 1.99070 -39.42729 707.58707
3845.0000 -41.19476 -39.78960 1.40516 1.99897 -39.37051 698.85568
3850.0000 -39.98058 -38.33294 1.64764 2.02968 -39.15960 724.96936
3855.0000 -40.37727 -38.33973 2.03755 2.11772 -38.55492 860.70861
3860.0000 -40.73649 -38.79115 1.94533 2.12502 -38.50475 817.81727
3865.0000 -40.95977 -39.19445 1.76533 2.05436 -38.99007 759.53647
3870.0000 -40.22234 -38.42493 1.79741 2.05599 -38.97886 755.37389
3875.0000 -40.50139 -39.00340 1.49799 2.08822 -38.75752 796.63032
3880.0000 -40.60877 -38.86136 1.74741 2.08168 -38.80243 839.82204
3885.0000 -41.39387 -39.13748 2.25639 2.01817 -39.23865 762.20219
3890.0000 -41.22100 -39.61069 1.61031 1.95826 -39.65008 739.62422
3895.0000 -41.22768 -39.72018 1.50750 2.03010 -39.15670 766.52991
3900.0000 -41.14247 -39.21158 1.93089 1.96903 -39.57612 728.80417
3905.0000 -41.21108 -39.36631 1.84477 1.99819 -39.37589 741.35152
3910.0000 -41.00053 -39.31506 1.68547 2.02892 -39.16481 780.50035
3915.0000 -41.33144 -39.78646 1.54497 2.01469 -39.26256 728.02778
3920.0000 -40.93853 -39.59414 1.34439 1.96644 -39.59393 658.56155
3925.0000 -40.88519 -39.25735 1.62785 1.99030 -39.43006 711.10753
3930.0000 -41.60537 -39.73990 1.86547 1.94213 -39.76089 695.19071
3935.0000 -41.73695 -39.56521 2.17174 1.93259 -39.82644 669.07349
3940.0000 -41.00327 -39.09930 1.90397 1.99991 -39.36408 775.03707
3945.0000 -40.80998 -39.37486 1.43512 2.01671 -39.24866 752.88564
3950.0000 -41.27859 -39.12264 2.15595 2.04230 -39.07293 768.82840
3955.0000 -41.54659 -39.56489 1.98170 2.03519 -39.12176 807.34009
3960.0000 -41.31551 -39.79800 1.51751 1.99955 -39.36649 777.06183
3965.0000 -40.85390 -39.25319 1.60071 1.94462 -39.74378 702.38608
3970.0000 -40.96507 -38.81719 2.14787 1.99371 -39.40665 738.63475
3975.0000 -40.88870 -39.49778 1.39092 2.05539 -38.98298 756.69275
3980.0000 -41.59772 -39.70893 1.88879 1.93597 -39.80322 654.14099
3985.0000 -41.24129 -39.70816 1.53313 1.94807 -39.72009 640.43854
3990.0000 -41.99058 -39.74193 2.24864 1.92805 -39.85759 644.28717
3995.0000 -40.80837 -38.84404 1.96433 1.98954 -39.43524 751.83081
4000.0000 -41.09608 -39.30649 1.78958 2.04030 -39.08663 789.20616
MELTING PROCESS: loop number 17 T-loop= 778.00000000000000
main_MD> interactions number 17 at Temperature= 778.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.44708 -1.20907 -0.48605
force_rgl> df(natom) 1.90925 1.85333 3.45620
4005.0000 -41.13861 -39.52875 1.60986 1.96806 -39.58277 713.64456
4010.0000 -41.02834 -39.22979 1.79855 1.99340 -39.40877 717.02487
4015.0000 -40.42898 -37.99566 2.43332 2.10473 -38.64414 867.31313
4020.0000 -40.69182 -38.69146 2.00037 2.17512 -38.16067 909.10725
4025.0000 -40.15576 -38.43348 1.72228 2.10262 -38.65863 796.60269
4030.0000 -40.86010 -38.90931 1.95079 2.09169 -38.73367 851.21835
4035.0000 -41.87254 -39.36404 2.50851 1.97544 -39.53213 734.36350
4040.0000 -41.77660 -39.93843 1.83817 1.94752 -39.72389 622.58771
4045.0000 -41.34536 -39.50634 1.83902 1.98809 -39.44525 712.40820
4050.0000 -40.92197 -38.65205 2.26992 2.02943 -39.16128 775.15507
4055.0000 -40.77410 -38.25730 2.51680 2.18385 -38.10071 903.13823
4060.0000 -41.45934 -39.83593 1.62340 1.98315 -39.47913 755.13624
4065.0000 -41.10117 -39.23397 1.86720 1.98879 -39.44040 766.62822
4070.0000 -40.76032 -39.21328 1.54705 2.02160 -39.21506 752.32938
4075.0000 -40.26256 -38.37330 1.88927 2.03068 -39.15273 743.34164
4080.0000 -40.45868 -38.65455 1.80413 2.13404 -38.44282 892.29966
4085.0000 -40.47844 -38.71522 1.76323 2.06261 -38.93343 801.86860
4090.0000 -41.17395 -39.37234 1.80162 2.02837 -39.16855 772.32026
4095.0000 -41.35491 -39.50794 1.84697 1.99197 -39.41857 766.34532
4100.0000 -41.48340 -39.82210 1.66130 1.96624 -39.59531 696.96613
4105.0000 -41.19826 -39.37949 1.81877 1.98029 -39.49882 669.93579
4110.0000 -40.96450 -39.36335 1.60115 2.02457 -39.19468 759.58604
4115.0000 -40.59016 -38.58705 2.00311 2.05589 -38.97958 746.48010
4120.0000 -40.19522 -38.57491 1.62031 2.14618 -38.35945 816.04556
4125.0000 -40.63621 -39.23592 1.40028 2.04905 -39.02653 787.40309
4130.0000 -41.10037 -39.14019 1.96018 2.04558 -39.05039 792.73465
4135.0000 -41.24369 -39.68071 1.56298 1.98284 -39.48132 724.16170
4140.0000 -40.99886 -39.32214 1.67672 1.98443 -39.47038 746.04137
4145.0000 -40.52440 -39.59858 0.92582 2.01124 -39.28626 732.43915
4150.0000 -41.15910 -39.51867 1.64043 1.97542 -39.53223 719.97965
4155.0000 -40.51805 -39.16168 1.35638 2.03877 -39.09715 756.72040
4160.0000 -40.60883 -39.44404 1.16479 1.93022 -39.84268 615.37898
4165.0000 -41.16693 -39.92995 1.23699 1.98227 -39.48524 695.28640
4170.0000 -41.05537 -39.10399 1.95138 1.95601 -39.66558 680.15717
4175.0000 -40.32213 -38.37496 1.94717 2.07392 -38.85576 818.89575
4180.0000 -40.65292 -39.04143 1.61149 2.08627 -38.77091 806.11171
4185.0000 -40.72727 -39.29293 1.43434 2.01948 -39.22963 731.72527
4190.0000 -41.28554 -39.58471 1.70082 1.95334 -39.68393 706.62177
4195.0000 -41.86533 -40.45723 1.40811 1.95683 -39.65991 686.21727
4200.0000 -41.10391 -39.55669 1.54722 1.92075 -39.90776 648.16634
4205.0000 -41.33685 -39.57360 1.76325 1.93744 -39.79311 631.83012
4210.0000 -41.47597 -39.71757 1.75839 1.93571 -39.80502 653.33602
4215.0000 -40.89323 -39.34541 1.54782 1.99246 -39.41522 746.99547
4220.0000 -40.99116 -39.65079 1.34037 2.02028 -39.22411 764.41467
4225.0000 -41.05749 -39.43333 1.62416 1.96090 -39.63199 701.49033
4230.0000 -39.77898 -38.00312 1.77586 2.07461 -38.85100 836.78961
4235.0000 -39.82758 -38.88708 0.94050 2.09373 -38.71968 836.50350
4240.0000 -40.32195 -38.51846 1.80349 2.13987 -38.40276 841.63316
4245.0000 -40.68001 -39.10924 1.57078 2.11037 -38.60537 818.32920
4250.0000 -40.93595 -38.87561 2.06034 2.04479 -39.05579 767.47866
MELTING PROCESS: loop number 18 T-loop= 803.00000000000000
main_MD> interactions number 18 at Temperature= 803.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.26245 -0.39576 2.75750
force_rgl> df(natom) -1.73237 -0.00262 0.01548
4255.0000 -40.68700 -39.08783 1.59917 2.06102 -38.94434 777.25964
4260.0000 -40.63195 -38.83428 1.79767 1.99208 -39.41785 760.44677
4265.0000 -40.41008 -38.39918 2.01090 2.14160 -38.39090 912.70549
4270.0000 -40.20932 -38.26834 1.94098 2.12693 -38.49165 901.70744
4275.0000 -40.16197 -38.76877 1.39321 2.13285 -38.45099 879.27498
4280.0000 -41.01311 -38.96419 2.04893 2.08977 -38.74683 814.83243
4285.0000 -40.98435 -39.15807 1.82628 2.05389 -38.99331 812.20538
4290.0000 -40.44380 -38.41275 2.03105 2.08601 -38.77271 809.05334
4295.0000 -40.99373 -39.60372 1.39000 2.01711 -39.24589 718.01639
4300.0000 -41.52959 -39.46348 2.06611 1.95095 -39.70032 691.12175
4305.0000 -40.88899 -39.06750 1.82149 2.01297 -39.27437 802.33756
4310.0000 -41.65203 -39.92567 1.72636 1.97859 -39.51045 700.85110
4315.0000 -41.77689 -39.62916 2.14773 1.92593 -39.87217 668.76692
4320.0000 -41.15437 -39.33111 1.82326 1.95082 -39.70120 685.97778
4325.0000 -40.11747 -38.72088 1.39660 2.01307 -39.27366 744.81359
4330.0000 -41.66704 -39.53741 2.12963 2.06698 -38.90339 783.23014
4335.0000 -40.55842 -39.24387 1.31455 2.01507 -39.25995 676.17265
4340.0000 -41.70919 -40.23671 1.47248 1.96107 -39.63083 655.00188
4345.0000 -40.89103 -39.15950 1.73152 1.93871 -39.78438 688.29289
4350.0000 -40.71782 -38.87701 1.84082 2.00988 -39.29560 725.08810
4355.0000 -41.53143 -39.90295 1.62847 2.00661 -39.31802 711.74148
4360.0000 -41.17766 -39.22996 1.94769 1.97980 -39.50220 699.61802
4365.0000 -40.80584 -39.05460 1.75124 2.01931 -39.23081 743.43283
4370.0000 -41.16364 -39.36768 1.79596 1.98338 -39.47758 682.03313
4375.0000 -40.27989 -38.96129 1.31860 2.02675 -39.17973 773.17017
4380.0000 -41.49138 -39.96817 1.52321 2.02317 -39.20432 774.30880
4385.0000 -41.04415 -39.22622 1.81794 1.97467 -39.53744 706.86782
4390.0000 -40.98338 -39.60794 1.37544 1.98345 -39.47712 656.09332
4395.0000 -41.36345 -39.51964 1.84382 2.04916 -39.02581 828.12837
4400.0000 -40.96828 -38.91586 2.05242 1.99231 -39.41625 721.17169
4405.0000 -41.41310 -39.50888 1.90423 2.04044 -39.08568 723.47292
4410.0000 -40.90954 -39.24384 1.66570 2.00486 -39.33004 694.66954
4415.0000 -41.20213 -40.11357 1.08856 1.95100 -39.69999 687.81536
4420.0000 -40.81394 -39.44448 1.36947 1.95377 -39.68097 646.14104
4425.0000 -41.14501 -39.34333 1.80168 1.99697 -39.38422 737.08496
4430.0000 -41.32090 -39.85100 1.46989 1.97941 -39.50484 718.87631
4435.0000 -41.35910 -39.59779 1.76131 1.91959 -39.91570 663.13319
4440.0000 -40.47950 -38.61428 1.86522 2.00610 -39.32150 788.32889
4445.0000 -40.19091 -37.96608 2.22483 2.12702 -38.49099 862.20659
4450.0000 -40.83852 -39.12932 1.70919 2.08124 -38.80547 854.04104
4455.0000 -40.69189 -39.32049 1.37139 2.01550 -39.25694 759.91580
4460.0000 -41.02540 -38.94711 2.07829 2.04838 -39.03113 793.25747
4465.0000 -41.53855 -40.09955 1.43900 1.99772 -39.37911 710.72634
4470.0000 -41.29458 -40.04685 1.24773 1.89503 -40.08442 611.21992
4475.0000 -41.23853 -39.58970 1.64883 1.97995 -39.50117 660.67103
4480.0000 -40.66732 -38.84396 1.82336 2.04478 -39.05585 808.73026
4485.0000 -40.42405 -38.75895 1.66510 2.08561 -38.77545 794.42590
4490.0000 -40.88770 -39.23585 1.65185 2.03221 -39.14217 788.05708
4495.0000 -41.68811 -40.12269 1.56542 1.96263 -39.62010 707.40319
4500.0000 -40.89241 -39.68530 1.20711 1.95318 -39.68499 673.98521
MELTING PROCESS: loop number 19 T-loop= 828.00000000000000
main_MD> interactions number 19 at Temperature= 828.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.80243 -1.34767 -1.87146
force_rgl> df(natom) -1.81984 -1.32056 3.85220
4505.0000 -41.33659 -40.19792 1.13867 1.91001 -39.98148 581.34646
4510.0000 -40.57643 -38.79105 1.78538 1.94727 -39.72561 682.54238
4515.0000 -40.70572 -38.80523 1.90049 2.05562 -38.98145 873.22123
4520.0000 -41.26603 -39.70255 1.56347 2.07022 -38.88114 832.59019
4525.0000 -41.24489 -39.54155 1.70334 1.97848 -39.51120 712.90911
4530.0000 -41.40591 -39.41959 1.98632 1.98529 -39.46446 768.60213
4535.0000 -41.26521 -39.46658 1.79862 1.97353 -39.54522 714.28221
4540.0000 -40.61071 -38.33889 2.27183 2.03079 -39.15197 771.53120
4545.0000 -39.84830 -37.70518 2.14312 2.23215 -37.76898 1008.71433
4550.0000 -40.90061 -38.69125 2.20936 2.16018 -38.26328 882.13012
4555.0000 -41.17145 -40.03919 1.13226 2.03003 -39.15716 820.35034
4560.0000 -41.53136 -39.03331 2.49805 1.96387 -39.61159 757.96362
4565.0000 -40.37250 -38.61784 1.75466 2.11352 -38.58375 836.06299
4570.0000 -40.66859 -38.60427 2.06432 2.04082 -39.08309 778.74424
4575.0000 -40.73090 -39.11037 1.62053 2.08013 -38.81307 793.08006
4580.0000 -40.62420 -38.12703 2.49716 2.07640 -38.83872 854.08096
4585.0000 -39.95574 -37.71434 2.24140 2.17736 -38.14525 844.09442
4590.0000 -40.46107 -38.30427 2.15681 2.12712 -38.49031 865.02264
4595.0000 -40.11577 -37.93392 2.18185 2.16129 -38.25567 893.74870
4600.0000 -40.52420 -38.52708 1.99712 2.13382 -38.44429 878.81211
4605.0000 -40.22285 -38.49063 1.73222 2.06421 -38.92241 812.88212
4610.0000 -39.54436 -37.53155 2.01282 2.19432 -38.02879 867.47041
4615.0000 -40.83928 -38.85598 1.98330 2.15617 -38.29084 888.64262
4620.0000 -40.38005 -38.48398 1.89607 2.07578 -38.84298 800.16159
4625.0000 -41.28832 -39.61214 1.67617 2.06091 -38.94505 803.24222
4630.0000 -40.04254 -38.43011 1.61243 1.97069 -39.56473 671.80438
4635.0000 -40.80476 -38.73789 2.06686 2.09374 -38.71957 904.23100
4640.0000 -40.50112 -39.05918 1.44194 2.03092 -39.15105 767.09365
4645.0000 -41.17186 -39.22979 1.94207 2.01192 -39.28155 779.86607
4650.0000 -41.02340 -39.05784 1.96555 2.07271 -38.86407 771.20881
4655.0000 -41.34530 -38.84492 2.50038 2.14328 -38.37932 946.14652
4660.0000 -41.06197 -38.89880 2.16316 2.03711 -39.10858 768.86721
4665.0000 -39.42581 -37.79633 1.62948 2.11814 -38.55202 861.31551
4670.0000 -40.61955 -38.65373 1.96582 2.10448 -38.64581 853.09116
4675.0000 -39.84579 -38.08941 1.75638 2.12913 -38.47650 833.63997
4680.0000 -40.25770 -37.72922 2.52848 2.17013 -38.19492 894.27440
4685.0000 -40.32925 -38.25770 2.07154 2.20334 -37.96681 969.59242
4690.0000 -40.86080 -39.40222 1.45858 2.13131 -38.46155 875.96421
4695.0000 -41.31803 -39.89490 1.42314 1.99909 -39.36969 743.04746
4700.0000 -40.21736 -38.41821 1.79915 2.01192 -39.28153 779.30154
4705.0000 -40.41629 -38.51826 1.89802 2.09841 -38.68749 809.68800
4710.0000 -40.85723 -38.56593 2.29131 2.08230 -38.79817 792.62221
4715.0000 -40.17274 -38.21368 1.95906 2.16124 -38.25597 828.62329
4720.0000 -40.19821 -38.15598 2.04223 2.14444 -38.37135 866.65490
4725.0000 -40.59038 -38.62950 1.96088 2.13919 -38.40743 895.33435
4730.0000 -41.24342 -39.08068 2.16274 2.10234 -38.66052 885.80418
4735.0000 -40.39832 -38.01943 2.37889 2.11987 -38.54011 864.87675
4740.0000 -40.03957 -37.54545 2.49412 2.25141 -37.63667 1015.70465
4745.0000 -40.39829 -38.01713 2.38116 2.19341 -38.03505 987.40365
4750.0000 -40.85068 -38.41015 2.44054 2.16412 -38.23623 915.64856
MELTING PROCESS: loop number 20 T-loop= 853.00000000000000
main_MD> interactions number 20 at Temperature= 853.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.73600 -1.49806 0.58686
force_rgl> df(natom) 2.25075 0.29537 0.67618
4755.0000 -40.56254 -38.52691 2.03562 2.14657 -38.35672 930.44171
4760.0000 -40.92399 -38.04757 2.87642 2.14897 -38.34025 888.58289
4765.0000 -40.44855 -38.54267 1.90588 2.21971 -37.85439 1007.57993
4770.0000 -40.26964 -38.67201 1.59764 2.13420 -38.44170 904.99044
4775.0000 -40.82414 -39.21215 1.61199 2.04155 -39.07802 797.37404
4780.0000 -41.39510 -39.81150 1.58361 2.03171 -39.14562 790.60763
4785.0000 -41.10982 -39.25160 1.85821 1.96244 -39.62141 696.45959
4790.0000 -40.41208 -39.00044 1.41164 2.03437 -39.12736 744.68786
4795.0000 -40.92921 -39.46219 1.46702 2.03286 -39.13774 777.04237
4800.0000 -40.04303 -38.29529 1.74773 2.11241 -38.59136 756.88057
4805.0000 -39.64974 -37.80120 1.84854 2.24511 -37.67994 863.28976
4810.0000 -40.09899 -37.26842 2.83058 2.22441 -37.82213 1102.18165
4815.0000 -40.73806 -38.77070 1.96736 2.24220 -37.69996 985.44583
4820.0000 -40.01651 -38.32139 1.69512 2.13342 -38.44703 900.83806
4825.0000 -40.53325 -38.04458 2.48866 2.19228 -38.04279 966.86749
4830.0000 -39.47390 -37.82097 1.65293 2.24571 -37.67585 1051.29349
4835.0000 -40.08022 -36.79117 3.28904 2.25567 -37.60740 1054.01054
4840.0000 -39.27700 -36.84154 2.43546 2.35334 -36.93660 1074.72591
4845.0000 -39.61804 -37.03739 2.58065 2.33017 -37.09574 1109.90006
4850.0000 -40.44454 -38.07541 2.36913 2.21934 -37.85694 947.95986
4855.0000 -41.12593 -39.30696 1.81898 2.08747 -38.76266 857.55002
4860.0000 -41.90271 -40.05244 1.85027 1.98881 -39.44029 712.18618
4865.0000 -42.24876 -40.44510 1.80366 1.87427 -40.22695 649.30949
4870.0000 -40.81500 -39.43263 1.38237 1.98579 -39.46100 725.01541
4875.0000 -41.28721 -39.34408 1.94313 1.99877 -39.37189 735.25333
4880.0000 -40.46484 -39.07276 1.39208 2.01980 -39.22746 686.75350
4885.0000 -40.35429 -38.60940 1.74489 2.03918 -39.09431 749.68645
4890.0000 -40.37702 -38.62322 1.75380 2.10042 -38.67373 851.82015
4895.0000 -39.92427 -37.98752 1.93675 2.14356 -38.37739 833.74370
4900.0000 -38.97855 -36.70012 2.27843 2.27645 -37.46466 942.93376
4905.0000 -40.34121 -38.28621 2.05500 2.30248 -37.28590 1035.62791
4910.0000 -39.76209 -38.13879 1.62330 2.12952 -38.47387 882.27524
4915.0000 -39.58644 -37.23151 2.35493 2.23234 -37.76765 928.46315
4920.0000 -40.33933 -37.66682 2.67251 2.29774 -37.31844 1074.22746
4925.0000 -40.49754 -38.40104 2.09650 2.15035 -38.33079 872.65565
4930.0000 -39.79102 -37.76817 2.02284 2.14941 -38.33721 934.73881
4935.0000 -39.38091 -37.93241 1.44850 2.17379 -38.16977 910.84660
4940.0000 -41.27047 -39.68974 1.58073 1.98516 -39.46535 707.70564
4945.0000 -41.29166 -39.61264 1.67902 1.93277 -39.82517 618.49349
4950.0000 -41.51267 -39.60108 1.91159 1.94836 -39.71811 668.95326
4955.0000 -40.87928 -38.95429 1.92499 2.08368 -38.78872 895.97199
4960.0000 -40.71028 -39.25411 1.45617 2.05955 -38.95440 799.58155
4965.0000 -40.74832 -38.89771 1.85061 2.01359 -39.27008 730.04848
4970.0000 -40.23511 -38.26921 1.96590 2.18313 -38.10562 947.26994
4975.0000 -40.56192 -38.81869 1.74323 2.09244 -38.72853 869.71329
4980.0000 -40.44865 -38.24793 2.20072 2.13329 -38.44794 846.20430
4985.0000 -39.93819 -38.45419 1.48400 2.18474 -38.09459 875.54605
4990.0000 -40.33633 -38.29809 2.03824 2.15100 -38.32631 894.68730
4995.0000 -40.02302 -38.05211 1.97091 2.17461 -38.16418 921.18093
5000.0000 -40.07312 -38.46352 1.60960 2.07398 -38.85529 857.80200
MELTING PROCESS: loop number 21 T-loop= 878.00000000000000
main_MD> interactions number 21 at Temperature= 878.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.06404 -0.89085 -4.81117
force_rgl> df(natom) 2.08959 -4.20153 -1.02196
5005.0000 -40.00226 -38.21881 1.78345 2.21118 -37.91297 995.84281
5010.0000 -41.21240 -38.94155 2.27084 2.13646 -38.42615 880.60219
5015.0000 -40.94341 -39.25652 1.68689 2.05751 -38.96840 855.43664
5020.0000 -40.47275 -38.65809 1.81465 2.02932 -39.16204 789.83760
5025.0000 -40.07193 -38.22976 1.84217 2.13480 -38.43757 847.84765
5030.0000 -39.93418 -37.87562 2.05856 2.17257 -38.17817 935.65115
5035.0000 -40.39358 -38.04849 2.34509 2.21044 -37.91803 903.90411
5040.0000 -40.49211 -38.80197 1.69014 2.10443 -38.64615 777.43598
5045.0000 -40.44018 -39.04737 1.39281 2.04082 -39.08304 751.12447
5050.0000 -39.56748 -38.00564 1.56184 2.15575 -38.29373 886.35626
5055.0000 -39.36554 -37.36647 1.99907 2.25791 -37.59206 997.43593
5060.0000 -39.95301 -37.72296 2.23005 2.21472 -37.88866 892.50214
5065.0000 -40.32421 -37.18267 3.14153 2.22761 -37.80011 971.40315
5070.0000 -40.47529 -37.80207 2.67322 2.32987 -37.09779 1044.58289
5075.0000 -39.26639 -37.55098 1.71541 2.25650 -37.60173 970.85124
5080.0000 -40.36493 -38.40102 1.96392 2.24820 -37.65875 1008.91992
5085.0000 -40.13595 -38.04881 2.08714 2.17558 -38.15751 933.95942
5090.0000 -41.16114 -38.65049 2.51065 2.10252 -38.65929 862.04600
5095.0000 -40.69170 -39.15267 1.53903 2.08878 -38.75369 901.59265
5100.0000 -39.91957 -37.36605 2.55352 2.13354 -38.44625 897.03066
5105.0000 -40.93764 -39.25457 1.68307 2.09726 -38.69541 861.13062
5110.0000 -41.05172 -40.00722 1.04450 1.94603 -39.73408 712.95986
5115.0000 -41.05496 -39.52693 1.52803 1.96224 -39.62277 694.43101
5120.0000 -41.47011 -39.09941 2.37070 2.01920 -39.23153 794.72468
5125.0000 -40.77597 -39.09252 1.68346 1.95973 -39.64002 678.73607
5130.0000 -39.99758 -38.29161 1.70596 2.12993 -38.47104 893.30846
5135.0000 -40.43459 -38.82335 1.61124 2.15119 -38.32502 939.89609
5140.0000 -41.01633 -39.23848 1.77785 2.10365 -38.65156 840.43465
5145.0000 -39.27524 -37.43873 1.83651 2.19142 -38.04867 931.87543
5150.0000 -40.66574 -38.47701 2.18873 2.12056 -38.53538 883.74209
5155.0000 -40.34840 -37.99677 2.35163 2.14176 -38.38981 854.28727
5160.0000 -41.03708 -38.83217 2.20491 2.16919 -38.20139 945.70235
5165.0000 -41.03834 -39.41813 1.62021 2.04368 -39.06342 791.98657
5170.0000 -40.80429 -38.97393 1.83036 2.00826 -39.30667 746.08169
5175.0000 -40.71748 -39.17980 1.53768 2.02793 -39.17161 749.36882
5180.0000 -41.13026 -38.90835 2.22191 2.08661 -38.76855 838.78944
5185.0000 -39.87415 -38.35401 1.52015 2.05710 -38.97122 766.64852
5190.0000 -40.17145 -38.85961 1.31184 2.10794 -38.62205 838.64560
5195.0000 -40.52389 -38.20756 2.31633 2.16022 -38.26297 892.69442
5200.0000 -40.34865 -37.41849 2.93016 2.26413 -37.54931 1077.02748
5205.0000 -39.86303 -36.73623 3.12680 2.40846 -36.55800 1176.12003
5210.0000 -40.36542 -37.73830 2.62712 2.37121 -36.81383 1159.67972
5215.0000 -38.63207 -36.40019 2.23188 2.32028 -37.16363 1043.59701
5220.0000 -40.60322 -38.05630 2.54691 2.33505 -37.06224 1028.06097
5225.0000 -40.69813 -38.90676 1.79137 2.12488 -38.50571 849.68390
5230.0000 -40.31765 -38.16102 2.15664 2.18581 -38.08722 952.57169
5235.0000 -39.78670 -37.62840 2.15830 2.22779 -37.79893 971.25363
5240.0000 -40.52650 -38.49768 2.02881 2.23911 -37.72116 898.83246
5245.0000 -40.30216 -38.38466 1.91750 2.20020 -37.98843 996.22915
5250.0000 -40.28882 -38.21521 2.07361 2.11800 -38.55295 901.03466
MELTING PROCESS: loop number 22 T-loop= 903.00000000000000
main_MD> interactions number 22 at Temperature= 903.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.42066 -0.81667 -0.30132
force_rgl> df(natom) -1.34236 0.82967 -0.07398
5255.0000 -38.89946 -37.00661 1.89285 2.22878 -37.79207 1010.88414
5260.0000 -39.64902 -37.20201 2.44701 2.25281 -37.62709 1014.76619
5265.0000 -39.49722 -37.57320 1.92402 2.23845 -37.72566 1031.73964
5270.0000 -39.42098 -37.76388 1.65710 2.21758 -37.86904 971.87243
5275.0000 -40.41553 -37.44935 2.96618 2.27949 -37.44384 956.81554
5280.0000 -40.28492 -37.99367 2.29125 2.21925 -37.85759 1016.34392
5285.0000 -40.24221 -38.31709 1.92512 2.17088 -38.18981 913.01948
5290.0000 -40.17644 -37.97701 2.19943 2.15887 -38.27225 894.41628
5295.0000 -40.48082 -37.90034 2.58047 2.23728 -37.73370 1013.47621
5300.0000 -40.01081 -37.77232 2.23849 2.27404 -37.48121 977.12504
5305.0000 -40.16546 -37.79673 2.36873 2.23267 -37.76542 992.85770
5310.0000 -40.26550 -38.66763 1.59787 2.14549 -38.36415 896.16123
5315.0000 -40.45427 -38.52145 1.93281 2.06513 -38.91609 821.35495
5320.0000 -40.50461 -39.04436 1.46025 2.10831 -38.61952 860.65522
5325.0000 -40.03110 -38.74235 1.28875 2.07911 -38.82005 823.99581
5330.0000 -40.48277 -38.44161 2.04115 2.10661 -38.63122 813.65510
5335.0000 -40.03823 -37.55319 2.48504 2.20265 -37.97154 898.58600
5340.0000 -40.71179 -38.52710 2.18469 2.17292 -38.17575 913.93165
5345.0000 -40.18347 -37.50124 2.68222 2.20180 -37.97740 927.71100
5350.0000 -40.21993 -37.76779 2.45214 2.26684 -37.53069 1050.66401
5355.0000 -41.08217 -38.98104 2.10113 2.12651 -38.49450 908.97473
5360.0000 -39.90425 -37.67134 2.23291 2.14622 -38.35914 825.87258
5365.0000 -40.29251 -38.62652 1.66599 2.14581 -38.36199 893.82713
5370.0000 -39.98467 -38.66047 1.32421 2.12353 -38.51498 911.37392
5375.0000 -40.14192 -38.48837 1.65355 2.10471 -38.64424 887.45945
5380.0000 -40.66227 -38.36918 2.29309 2.19270 -38.03994 943.41826
5385.0000 -40.17782 -38.53494 1.64287 2.12308 -38.51809 885.29928
5390.0000 -41.23325 -38.28092 2.95234 2.13625 -38.42759 925.21343
5395.0000 -40.22608 -38.18260 2.04348 2.09741 -38.69440 874.39635
5400.0000 -39.68342 -38.06550 1.61792 2.19218 -38.04349 976.38680
5405.0000 -39.92405 -37.93226 1.99179 2.22973 -37.78555 1044.90937
5410.0000 -39.94529 -38.69405 1.25123 2.20300 -37.96918 942.83962
5415.0000 -41.13290 -39.09877 2.03414 2.11086 -38.60204 810.12784
5420.0000 -39.85449 -38.07070 1.78379 2.12501 -38.50482 892.34719
5425.0000 -40.05214 -38.53392 1.51822 2.16667 -38.21870 867.99190
5430.0000 -41.05931 -39.00270 2.05661 2.08681 -38.76716 848.92295
5435.0000 -40.26014 -38.26065 1.99949 2.09543 -38.70796 841.51324
5440.0000 -40.17927 -38.01604 2.16323 2.21767 -37.86843 964.93657
5445.0000 -40.04780 -38.04332 2.00448 2.18756 -38.07523 933.40915
5450.0000 -40.71369 -38.24636 2.46733 2.14020 -38.40051 880.47606
5455.0000 -41.14293 -39.23473 1.90820 2.08269 -38.79547 838.21614
5460.0000 -40.18319 -38.31169 1.87149 2.07121 -38.87432 787.03754
5465.0000 -40.64448 -38.17461 2.46988 2.17952 -38.13046 1011.76428
5470.0000 -40.61851 -38.08270 2.53580 2.12034 -38.53692 906.11889
5475.0000 -40.88975 -39.62157 1.26818 2.09411 -38.71707 842.63322
5480.0000 -41.42254 -39.23210 2.19044 1.98563 -39.46214 723.05782
5485.0000 -40.16222 -38.19689 1.96532 2.10485 -38.64326 865.21784
5490.0000 -39.79080 -37.55102 2.23978 2.26305 -37.55670 1095.16003
5495.0000 -40.20827 -37.90135 2.30692 2.21062 -37.91681 987.48900
5500.0000 -40.18328 -38.46778 1.71550 2.18426 -38.09786 952.25005
MELTING PROCESS: loop number 23 T-loop= 928.00000000000000
main_MD> interactions number 23 at Temperature= 928.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.00762 -1.26277 -0.72390
force_rgl> df(natom) -0.05204 1.02933 0.59747
5505.0000 -39.80186 -38.43841 1.36345 2.15323 -38.31101 876.35773
5510.0000 -40.59473 -38.26073 2.33400 2.15659 -38.28793 894.68314
5515.0000 -40.55412 -38.50083 2.05329 2.08240 -38.79751 819.21921
5520.0000 -39.86741 -37.90931 1.95810 2.09717 -38.69604 860.85589
5525.0000 -39.95927 -38.50837 1.45091 2.16743 -38.21346 932.74593
5530.0000 -40.60599 -39.31905 1.28694 2.03824 -39.10076 800.05063
5535.0000 -40.76157 -38.73506 2.02651 2.07810 -38.82703 837.18832
5540.0000 -40.20712 -37.82578 2.38134 2.17931 -38.13187 907.99526
5545.0000 -41.02225 -39.07400 1.94825 2.11014 -38.60695 914.22773
5550.0000 -40.90523 -38.41270 2.49252 2.04059 -39.08465 796.10962
5555.0000 -40.86654 -38.91804 1.94851 2.10933 -38.61251 870.68053
5560.0000 -40.65868 -39.10331 1.55537 2.02372 -39.20052 730.93945
5565.0000 -40.82817 -39.60251 1.22566 1.97803 -39.51431 716.32287
5570.0000 -40.99278 -38.99956 1.99323 2.04699 -39.04070 826.99960
5575.0000 -41.02878 -38.49196 2.53681 2.11159 -38.59699 851.96699
5580.0000 -40.83899 -38.97958 1.85941 2.06249 -38.93423 820.67763
5585.0000 -40.63253 -38.34063 2.29190 2.19562 -38.01982 910.46690
5590.0000 -40.94097 -38.70261 2.23836 2.14742 -38.35088 923.24254
5595.0000 -40.35660 -38.42329 1.93331 2.12679 -38.49259 873.51849
5600.0000 -40.98625 -38.68181 2.30444 2.13665 -38.42491 909.28655
5605.0000 -39.10056 -36.78282 2.31773 2.18459 -38.09561 920.99671
5610.0000 -39.69643 -36.91721 2.77922 2.36532 -36.85429 1103.08258
5615.0000 -39.22335 -37.26779 1.95556 2.28741 -37.38939 1073.45667
5620.0000 -40.23680 -38.46799 1.76881 2.18290 -38.10723 951.26629
5625.0000 -40.72781 -38.19207 2.53574 2.15497 -38.29905 939.79822
5630.0000 -40.85756 -38.38749 2.47006 2.22816 -37.79637 1018.61478
5635.0000 -39.72631 -37.50271 2.22360 2.25017 -37.64518 1071.14281
5640.0000 -40.42285 -37.88095 2.54191 2.19237 -38.04219 983.40511
5645.0000 -39.89503 -37.51546 2.37957 2.21701 -37.87293 1038.73507
5650.0000 -40.82927 -38.81176 2.01751 2.16364 -38.23948 981.34955
5655.0000 -40.40925 -37.43764 2.97160 2.16058 -38.26052 928.68592
5660.0000 -39.88337 -37.17541 2.70796 2.25842 -37.58852 1035.24244
5665.0000 -41.08617 -39.25374 1.83243 2.09772 -38.69228 818.27287
5670.0000 -40.67946 -39.18663 1.49283 2.01742 -39.24376 758.78137
5675.0000 -40.86616 -39.85790 1.00826 1.99814 -39.37618 705.16856
5680.0000 -40.88525 -39.13646 1.74879 1.99992 -39.36395 736.49079
5685.0000 -40.24273 -38.53579 1.70694 2.13471 -38.43824 826.96198
5690.0000 -39.70327 -37.82716 1.87611 2.14807 -38.34642 944.03044
5695.0000 -39.29389 -37.01362 2.28027 2.20572 -37.95050 932.57976
5700.0000 -38.55852 -36.45294 2.10558 2.38106 -36.74623 1102.32262
5705.0000 -38.41333 -35.85859 2.55474 2.46329 -36.18144 1108.59603
5710.0000 -39.31309 -37.25896 2.05413 2.42943 -36.41398 1232.67860
5715.0000 -39.62434 -37.54168 2.08266 2.31547 -37.19671 1024.54992
5720.0000 -41.28660 -38.02299 3.26361 2.33040 -37.09414 1120.46385
5725.0000 -40.49551 -37.65311 2.84240 2.17570 -38.15669 891.72216
5730.0000 -39.70292 -37.94824 1.75468 2.27226 -37.49348 1075.28326
5735.0000 -39.54279 -36.64955 2.89325 2.26854 -37.51901 982.09236
5740.0000 -40.15276 -37.67015 2.48262 2.32441 -37.13529 1075.74516
5745.0000 -40.35047 -38.26653 2.08394 2.21754 -37.86934 965.06321
5750.0000 -40.36512 -38.47117 1.89394 2.09452 -38.71427 843.76267
MELTING PROCESS: loop number 24 T-loop= 953.00000000000000
main_MD> interactions number 24 at Temperature= 953.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.87998 -4.43462 -4.96999
force_rgl> df(natom) 4.00637 -0.76976 2.04875
5755.0000 -40.45140 -38.67459 1.77681 2.10737 -38.62596 899.33411
5760.0000 -40.25919 -37.51955 2.73964 2.16587 -38.22417 903.29461
5765.0000 -39.57221 -37.65455 1.91766 2.27299 -37.48842 1006.33939
5770.0000 -39.79011 -36.93099 2.85912 2.23538 -37.74678 1008.88695
5775.0000 -40.36884 -38.06553 2.30331 2.27728 -37.45897 1062.98494
5780.0000 -40.61405 -38.76071 1.85333 2.18703 -38.07886 931.76909
5785.0000 -40.59127 -38.17373 2.41753 2.07037 -38.88013 822.01340
5790.0000 -39.77275 -36.86165 2.91110 2.29731 -37.32142 1018.47545
5795.0000 -39.70233 -37.54408 2.15825 2.30313 -37.28145 1041.73867
5800.0000 -40.32711 -37.74297 2.58414 2.23957 -37.71802 1055.60595
5805.0000 -41.41365 -39.55421 1.85944 2.03189 -39.14443 750.79769
5810.0000 -41.54053 -38.95644 2.58409 2.04108 -39.08126 830.37520
5815.0000 -40.42519 -38.01201 2.41318 2.07170 -38.87100 850.19084
5820.0000 -40.65561 -38.26008 2.39552 2.18569 -38.08805 1021.44092
5825.0000 -40.75893 -37.79887 2.96006 2.16796 -38.20983 936.75965
5830.0000 -39.88015 -37.40505 2.47510 2.26510 -37.54262 1017.17171
5835.0000 -40.60046 -38.36423 2.23623 2.20920 -37.92655 1037.87965
5840.0000 -40.45052 -38.14700 2.30352 2.20075 -37.98463 891.02480
5845.0000 -39.33405 -36.24122 3.09282 2.25056 -37.64254 986.52319
5850.0000 -39.09510 -36.10529 2.98980 2.45926 -36.20913 1255.89635
5855.0000 -40.15871 -37.83178 2.32693 2.28077 -37.43503 1087.37391
5860.0000 -39.88116 -38.06057 1.82059 2.20306 -37.96877 1051.55237
5865.0000 -39.68255 -38.15336 1.52919 2.20392 -37.96288 960.35602
5870.0000 -40.25383 -38.35170 1.90213 2.15075 -38.32803 897.24715
5875.0000 -40.33441 -38.13921 2.19520 2.13599 -38.42938 882.86569
5880.0000 -39.50546 -37.65771 1.84775 2.20532 -37.95326 999.96612
5885.0000 -40.00331 -37.73343 2.26988 2.25769 -37.59354 990.82483
5890.0000 -40.21286 -38.14545 2.06741 2.15868 -38.27354 902.29678
5895.0000 -39.89948 -38.31473 1.58475 2.18292 -38.10711 934.32927
5900.0000 -40.44792 -38.79162 1.65629 2.10008 -38.67604 810.04662
5905.0000 -40.23682 -38.58631 1.65050 2.10427 -38.64725 860.86669
5910.0000 -40.67124 -38.49199 2.17925 2.17628 -38.15267 961.30924
5915.0000 -40.75286 -38.55909 2.19377 2.12635 -38.49564 884.79309
5920.0000 -39.60947 -37.24825 2.36122 2.19408 -38.03044 1037.60960
5925.0000 -39.17604 -37.56105 1.61499 2.30525 -37.26689 1051.96799
5930.0000 -39.79383 -37.66170 2.13213 2.23346 -37.75997 930.64363
5935.0000 -40.26809 -38.28232 1.98577 2.16162 -38.25335 902.20254
5940.0000 -40.00861 -37.38923 2.61937 2.19697 -38.01061 962.04537
5945.0000 -39.56453 -36.99311 2.57142 2.31749 -37.18283 1074.33142
5950.0000 -39.99250 -36.60890 3.38361 2.36114 -36.88304 1039.23244
5955.0000 -39.55617 -37.28856 2.26761 2.34920 -36.96499 1135.31845
5960.0000 -39.86681 -37.99406 1.87275 2.24011 -37.71426 962.44968
5965.0000 -40.22010 -38.01966 2.20044 2.14373 -38.37624 900.80787
5970.0000 -40.06866 -37.77929 2.28938 2.23191 -37.77061 1016.74761
5975.0000 -40.78780 -38.93250 1.85530 2.08014 -38.81302 840.50061
5980.0000 -40.24609 -38.06030 2.18579 2.09774 -38.69211 873.83556
5985.0000 -40.57617 -38.27383 2.30234 2.15762 -38.28082 910.99087
5990.0000 -40.43430 -38.69160 1.74270 2.14288 -38.38206 899.52690
5995.0000 -38.92517 -37.00027 1.92490 2.21460 -37.88949 937.19278
6000.0000 -39.45811 -37.15265 2.30546 2.39056 -36.68098 1068.80095
MELTING PROCESS: loop number 25 T-loop= 978.00000000000000
main_MD> interactions number 25 at Temperature= 978.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.62109 0.74927 -2.69981
force_rgl> df(natom) 1.06875 0.84994 1.14416
6005.0000 -39.12255 -36.36152 2.76103 2.31488 -37.20072 1041.51073
6010.0000 -39.49225 -37.04163 2.45062 2.42223 -36.46344 1248.87128
6015.0000 -40.29255 -37.02023 3.27232 2.33420 -37.06804 1109.78191
6020.0000 -39.94123 -37.45193 2.48930 2.26783 -37.52391 1076.52383
6025.0000 -40.23427 -38.13785 2.09642 2.22879 -37.79206 996.30327
6030.0000 -39.49182 -37.96647 1.52535 2.17581 -38.15591 917.48639
6035.0000 -40.04786 -37.21572 2.83213 2.22451 -37.82143 975.73765
6040.0000 -39.94448 -37.30378 2.64070 2.27001 -37.50894 1048.33290
6045.0000 -40.51839 -37.84147 2.67692 2.21202 -37.90722 1015.18070
6050.0000 -39.97931 -37.91614 2.06317 2.18547 -38.08958 887.22347
6055.0000 -40.10994 -37.39062 2.71932 2.25049 -37.64296 1060.16464
6060.0000 -40.25854 -38.74504 1.51350 2.20228 -37.97411 995.62345
6065.0000 -40.98544 -38.62247 2.36298 2.13401 -38.44303 866.75384
6070.0000 -41.48266 -39.10869 2.37397 2.11595 -38.56703 912.18438
6075.0000 -40.28549 -38.66534 1.62015 2.07242 -38.86604 810.16205
6080.0000 -40.09491 -37.17473 2.92019 2.23034 -37.78141 961.90179
6085.0000 -40.01844 -37.61594 2.40249 2.24320 -37.69309 956.37264
6090.0000 -39.94920 -38.16705 1.78215 2.26372 -37.55214 1027.10087
6095.0000 -39.75070 -37.46765 2.28305 2.20018 -37.98853 959.98982
6100.0000 -39.94680 -37.42103 2.52577 2.22007 -37.85189 930.81852
6105.0000 -40.01250 -37.76742 2.24507 2.24013 -37.71417 972.15177
6110.0000 -40.28057 -37.67153 2.60904 2.18878 -38.06684 958.27810
6115.0000 -41.14165 -38.95287 2.18877 2.13013 -38.46965 834.65685
6120.0000 -40.71997 -38.55026 2.16971 2.08107 -38.80664 809.38598
6125.0000 -39.21054 -37.14216 2.06838 2.25796 -37.59172 1047.25480
6130.0000 -39.40011 -37.12768 2.27243 2.29291 -37.35165 1037.34321
6135.0000 -39.69187 -37.25405 2.43782 2.28708 -37.39169 969.16512
6140.0000 -39.72258 -37.37044 2.35213 2.34927 -36.96456 1151.03911
6145.0000 -40.26751 -38.01503 2.25248 2.20653 -37.94489 971.58930
6150.0000 -39.86795 -36.87826 2.98969 2.25629 -37.60318 1055.98683
6155.0000 -39.79263 -36.57775 3.21488 2.35408 -36.93149 1188.03288
6160.0000 -38.75950 -35.92099 2.83851 2.47498 -36.10112 1223.47650
6165.0000 -39.77785 -38.00349 1.77436 2.34907 -36.96588 1067.57685
6170.0000 -40.12789 -37.96098 2.16690 2.15662 -38.28771 899.99294
6175.0000 -39.81667 -37.48345 2.33321 2.28914 -37.37756 1036.17671
6180.0000 -40.57918 -37.50951 3.06967 2.17046 -38.19266 919.39389
6185.0000 -39.83428 -37.41289 2.42139 2.23097 -37.77707 1008.47695
6190.0000 -40.58112 -37.03124 3.54988 2.31514 -37.19894 1048.04347
6195.0000 -39.45467 -37.05158 2.40310 2.31671 -37.18818 1073.80227
6200.0000 -41.00352 -37.70234 3.30117 2.27952 -37.44362 1037.15252
6205.0000 -40.15698 -37.88198 2.27500 2.22490 -37.81876 989.51924
6210.0000 -40.29408 -37.95331 2.34076 2.22044 -37.84941 1015.67533
6215.0000 -40.53147 -38.37250 2.15897 2.16420 -38.23568 901.82604
6220.0000 -40.21738 -37.75308 2.46431 2.16991 -38.19641 902.89114
6225.0000 -39.89350 -37.94287 1.95063 2.10745 -38.62542 856.28765
6230.0000 -40.82573 -38.53864 2.28710 2.11694 -38.56022 872.23728
6235.0000 -40.21889 -37.85316 2.36573 2.24365 -37.68999 1009.23514
6240.0000 -38.90030 -37.14372 1.75658 2.20130 -37.98087 953.80989
6245.0000 -39.61357 -37.65585 1.95773 2.32444 -37.13511 1083.70247
6250.0000 -40.01895 -37.97974 2.03921 2.16998 -38.19597 984.23877
MELTING PROCESS: loop number 26 T-loop= 1003.0000000000000
main_MD> interactions number 26 at Temperature= 1003.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.06780 1.84077 0.27985
force_rgl> df(natom) 0.16956 2.48817 0.10095
6255.0000 -39.98085 -37.41599 2.56486 2.31667 -37.18846 1059.23822
6260.0000 -40.47911 -38.66032 1.81879 2.22870 -37.79262 1104.89739
6265.0000 -40.23680 -38.12128 2.11553 2.18169 -38.11556 915.83729
6270.0000 -40.56469 -38.04177 2.52292 2.23180 -37.77134 1022.11054
6275.0000 -39.75008 -37.57028 2.17979 2.19822 -38.00202 896.35768
6280.0000 -40.66826 -37.82617 2.84209 2.23627 -37.74068 975.37351
6285.0000 -40.44889 -38.02410 2.42479 2.16111 -38.25688 932.27082
6290.0000 -39.98454 -37.48708 2.49746 2.26572 -37.53840 1039.16705
6295.0000 -40.26245 -38.46805 1.79440 2.18784 -38.07328 987.65948
6300.0000 -40.52918 -38.01923 2.50995 2.11835 -38.55054 864.93898
6305.0000 -40.50888 -38.95919 1.54969 2.06431 -38.92172 792.31270
6310.0000 -40.60800 -39.04210 1.56591 2.07155 -38.87200 780.30476
6315.0000 -40.60689 -38.70219 1.90470 2.12794 -38.48468 919.55887
6320.0000 -40.20853 -38.11003 2.09850 2.07070 -38.87786 750.06033
6325.0000 -40.12050 -37.95943 2.16107 2.24127 -37.70634 967.50234
6330.0000 -40.60974 -38.28608 2.32365 2.17081 -38.19026 975.60942
6335.0000 -40.12406 -38.29280 1.83125 2.14252 -38.38453 864.38695
6340.0000 -40.13563 -37.27301 2.86262 2.21627 -37.87804 1003.66595
6345.0000 -39.46403 -36.69217 2.77186 2.25417 -37.61769 1038.55590
6350.0000 -39.65509 -37.20874 2.44635 2.33333 -37.07404 1065.86421
6355.0000 -38.30857 -36.49459 1.81398 2.29890 -37.31053 1012.62017
6360.0000 -40.24506 -37.90809 2.33697 2.30545 -37.26549 1055.18412
6365.0000 -40.03138 -37.36920 2.66218 2.19722 -38.00886 966.74942
6370.0000 -40.39288 -37.86559 2.52729 2.18977 -38.06006 968.31114
6375.0000 -39.56897 -37.52114 2.04783 2.24807 -37.65958 1028.26099
6380.0000 -40.41828 -38.54520 1.87308 2.16443 -38.23406 918.70078
6385.0000 -39.18831 -36.55880 2.62951 2.28815 -37.38431 1062.21678
6390.0000 -39.77208 -37.40424 2.36784 2.34995 -36.95985 1077.38512
6395.0000 -38.83770 -37.13991 1.69779 2.28765 -37.38778 1017.58785
6400.0000 -39.80609 -37.48674 2.31935 2.29303 -37.35085 1032.70996
6405.0000 -40.54545 -37.53238 3.01308 2.31411 -37.20604 1132.15682
6410.0000 -40.19360 -37.27238 2.92122 2.29530 -37.33524 1082.40604
6415.0000 -40.04874 -36.78065 3.26809 2.34320 -37.00621 1238.65714
6420.0000 -40.46425 -38.22859 2.23566 2.32785 -37.11169 1099.35494
6425.0000 -40.22325 -38.10667 2.11657 2.20747 -37.93846 945.29231
6430.0000 -39.70745 -38.07669 1.63076 2.30186 -37.29017 980.84121
6435.0000 -39.10646 -37.64241 1.46406 2.22728 -37.80241 1022.01205
6440.0000 -39.36950 -36.61360 2.75590 2.35629 -36.91635 1159.48637
6445.0000 -39.87843 -37.36410 2.51434 2.35569 -36.92044 1185.20656
6450.0000 -40.38980 -37.08128 3.30853 2.24384 -37.68870 1093.93264
6455.0000 -39.75895 -37.93832 1.82063 2.33132 -37.08785 1126.40760
6460.0000 -40.65567 -38.32162 2.33406 2.16427 -38.23521 915.69185
6465.0000 -40.32620 -38.20209 2.12411 2.18642 -38.08307 995.00831
6470.0000 -39.03144 -37.23739 1.79405 2.27795 -37.45436 1133.50505
6475.0000 -39.50482 -37.04983 2.45499 2.35128 -36.95072 1118.56909
6480.0000 -40.08708 -37.33963 2.74745 2.31156 -37.22355 1078.21462
6485.0000 -38.38551 -35.36891 3.01660 2.40473 -36.58365 1171.32110
6490.0000 -39.13945 -36.83746 2.30199 2.44470 -36.30911 1147.25197
6495.0000 -39.10901 -37.07918 2.02983 2.32897 -37.10395 1078.68237
6500.0000 -40.12404 -38.25895 1.86509 2.25932 -37.58237 1009.76756
MELTING PROCESS: loop number 27 T-loop= 1028.0000000000000
main_MD> interactions number 27 at Temperature= 1028.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.18250 2.69364 1.63381
force_rgl> df(natom) -0.82075 -0.82772 -1.45226
6505.0000 -39.30207 -36.90314 2.39893 2.21304 -37.90020 951.97663
6510.0000 -40.18309 -38.30523 1.87786 2.25547 -37.60877 1061.10575
6515.0000 -40.53582 -38.87988 1.65594 2.13497 -38.43639 836.23484
6520.0000 -39.94999 -37.39214 2.55785 2.21362 -37.89622 924.00366
6525.0000 -40.19760 -38.29469 1.90292 2.15621 -38.29054 933.03585
6530.0000 -39.20320 -37.29452 1.90868 2.22299 -37.83189 996.05535
6535.0000 -39.72559 -37.60001 2.12558 2.27381 -37.48286 996.26174
6540.0000 -40.33386 -37.90218 2.43168 2.21683 -37.87416 996.07433
6545.0000 -39.29766 -36.75343 2.54423 2.35537 -36.92266 1107.52143
6550.0000 -40.16837 -37.76430 2.40407 2.22006 -37.85203 979.29934
6555.0000 -40.25349 -37.81485 2.43864 2.22306 -37.83136 973.39331
6560.0000 -39.01468 -36.30692 2.70776 2.33581 -37.05699 1072.36762
6565.0000 -39.34534 -36.90189 2.44345 2.39490 -36.65114 1245.66025
6570.0000 -39.18191 -37.01540 2.16651 2.36033 -36.88855 1071.82450
6575.0000 -38.73297 -35.80224 2.93073 2.39386 -36.65827 1133.68186
6580.0000 -39.33682 -35.71392 3.62290 2.58098 -35.37307 1333.28816
6585.0000 -38.96900 -34.94684 4.02216 2.57626 -35.40554 1366.59501
6590.0000 -38.36150 -35.71382 2.64769 2.59453 -35.28006 1387.41935
6595.0000 -39.75281 -36.43630 3.31651 2.45081 -36.26711 1242.86637
6600.0000 -39.13490 -36.61583 2.51907 2.40877 -36.55585 1199.73336
6605.0000 -40.43794 -37.91530 2.52264 2.26946 -37.51271 1080.62595
6610.0000 -40.16655 -37.00768 3.15887 2.27415 -37.48050 965.05552
6615.0000 -39.41251 -36.34399 3.06852 2.43207 -36.39585 1203.91809
6620.0000 -40.58673 -38.10402 2.48272 2.28171 -37.42854 1209.85649
6625.0000 -40.78652 -37.61466 3.17186 2.22579 -37.81266 988.12907
6630.0000 -39.36873 -36.31920 3.04953 2.33783 -37.04310 1102.05499
6635.0000 -40.28979 -36.96013 3.32966 2.42939 -36.41427 1261.02109
6640.0000 -39.40490 -37.26398 2.14092 2.38788 -36.69938 1171.68688
6645.0000 -39.46177 -37.67874 1.78303 2.27251 -37.49177 1022.92724
6650.0000 -39.52120 -37.66750 1.85370 2.25818 -37.59019 1048.03007
6655.0000 -39.86248 -37.70176 2.16072 2.26377 -37.55179 1041.17500
6660.0000 -39.05884 -37.10420 1.95464 2.31016 -37.23318 1031.50009
6665.0000 -38.32392 -36.38759 1.93633 2.44863 -36.28208 1126.99220
6670.0000 -38.98575 -36.76433 2.22142 2.34254 -37.01075 1095.19107
6675.0000 -38.86947 -36.86083 2.00864 2.39685 -36.63777 1140.09433
6680.0000 -39.44376 -36.96148 2.48228 2.32222 -37.15035 1118.61566
6685.0000 -38.49059 -36.57554 1.91505 2.35721 -36.91004 1191.10655
6690.0000 -39.66053 -36.28562 3.37491 2.40732 -36.56584 1161.78258
6695.0000 -40.34290 -37.60657 2.73633 2.27218 -37.49402 1005.43260
6700.0000 -40.30358 -38.13532 2.16826 2.23515 -37.74833 958.24888
6705.0000 -39.95041 -37.64063 2.30978 2.29019 -37.37031 1124.81650
6710.0000 -39.86649 -38.37168 1.49481 2.19979 -37.99122 895.54979
6715.0000 -39.98658 -38.16005 1.82652 2.19317 -38.03666 854.92361
6720.0000 -40.20238 -37.47303 2.72935 2.24567 -37.67607 935.15141
6725.0000 -40.29495 -38.00076 2.29419 2.17856 -38.13700 917.28399
6730.0000 -40.09652 -38.32015 1.77636 2.13877 -38.41028 919.86619
6735.0000 -38.37540 -35.90352 2.47188 2.33124 -37.08837 1104.08697
6740.0000 -39.37088 -37.05872 2.31215 2.35092 -36.95323 1130.88573
6745.0000 -40.16186 -38.30366 1.85820 2.22795 -37.79780 1029.72339
6750.0000 -39.56951 -37.92104 1.64847 2.16679 -38.21788 931.47018
MELTING PROCESS: loop number 28 T-loop= 1053.0000000000000
main_MD> interactions number 28 at Temperature= 1053.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23083 -0.05129 -0.17579
force_rgl> df(natom) 4.06397 -0.97778 -4.17249
6755.0000 -39.28482 -36.37656 2.90827 2.34724 -36.97847 1031.70063
6760.0000 -40.49447 -37.90919 2.58528 2.37068 -36.81747 1105.94051
6765.0000 -40.80736 -38.13803 2.66933 2.21743 -37.87006 986.95925
6770.0000 -40.06532 -38.22149 1.84383 2.16580 -38.22466 939.53098
6775.0000 -39.77123 -37.07248 2.69874 2.29748 -37.32028 1018.77752
6780.0000 -40.60398 -38.20235 2.40163 2.19981 -37.99106 956.77969
6785.0000 -38.87385 -36.08704 2.78681 2.25107 -37.63899 1024.45370
6790.0000 -39.81985 -37.71020 2.10965 2.29606 -37.32999 1031.62996
6795.0000 -40.61397 -38.19193 2.42204 2.19988 -37.99061 978.01606
6800.0000 -39.74046 -36.90088 2.83958 2.16328 -38.24195 920.39808
6805.0000 -39.91234 -37.82593 2.08641 2.30573 -37.26355 992.84159
6810.0000 -38.24298 -36.07285 2.17013 2.40730 -36.56599 1192.98090
6815.0000 -39.59485 -37.61891 1.97594 2.42928 -36.41500 1182.29873
6820.0000 -38.43344 -36.65289 1.78055 2.28087 -37.43432 929.60210
6825.0000 -40.42223 -37.77452 2.64771 2.40085 -36.61027 1098.75247
6830.0000 -39.31547 -37.43694 1.87853 2.22866 -37.79293 900.94150
6835.0000 -40.43693 -38.70259 1.73434 2.19093 -38.05205 910.82453
6840.0000 -39.63245 -37.14816 2.48429 2.20420 -37.96095 938.53013
6845.0000 -39.84828 -37.10160 2.74669 2.37332 -36.79938 1129.71346
6850.0000 -38.91638 -35.74736 3.16902 2.43933 -36.34597 1219.76045
6855.0000 -40.43505 -38.09769 2.33736 2.36971 -36.82414 1140.69917
6860.0000 -39.95740 -37.23295 2.72445 2.23684 -37.73678 1002.36416
6865.0000 -39.44214 -37.68113 1.76101 2.28834 -37.38300 1056.00894
6870.0000 -39.41298 -37.04133 2.37164 2.29042 -37.36876 1049.28060
6875.0000 -39.79441 -37.04253 2.75187 2.28830 -37.38327 1056.77170
6880.0000 -40.87700 -38.52645 2.35055 2.13216 -38.45574 853.96840
6885.0000 -39.97556 -38.11393 1.86163 2.17637 -38.15209 958.82791
6890.0000 -40.57326 -38.03691 2.53635 2.23975 -37.71676 1056.59844
6895.0000 -39.14705 -36.48075 2.66630 2.36683 -36.84391 1227.40837
6900.0000 -38.94540 -36.49806 2.44734 2.44067 -36.33678 1157.85008
6905.0000 -39.45714 -35.95044 3.50670 2.45546 -36.23519 1266.71980
6910.0000 -39.98520 -37.32867 2.65653 2.34973 -36.96137 1066.07579
6915.0000 -39.85212 -38.18171 1.67041 2.25231 -37.63052 1014.10571
6920.0000 -39.97932 -38.03939 1.93994 2.29315 -37.34996 1039.60966
6925.0000 -40.30779 -37.42169 2.88610 2.25524 -37.61039 973.44819
6930.0000 -39.65607 -37.75349 1.90258 2.29784 -37.31781 1058.02252
6935.0000 -40.90158 -37.54379 3.35779 2.24347 -37.69121 1040.31116
6940.0000 -39.59523 -37.49615 2.09908 2.23252 -37.76639 1002.89233
6945.0000 -40.09856 -37.86639 2.23217 2.21989 -37.85319 954.38785
6950.0000 -40.21213 -37.05283 3.15930 2.24671 -37.66897 985.73621
6955.0000 -40.22212 -37.12015 3.10197 2.35701 -36.91140 1204.71455
6960.0000 -40.48608 -37.20028 3.28580 2.33332 -37.07409 1104.03421
6965.0000 -40.54162 -38.42199 2.11963 2.24826 -37.65830 1065.60652
6970.0000 -40.66740 -38.58953 2.07787 2.11819 -38.55165 874.68916
6975.0000 -39.50523 -37.22881 2.27642 2.23486 -37.75037 1030.05918
6980.0000 -39.98176 -37.53491 2.44685 2.15528 -38.29694 932.52788
6985.0000 -39.64512 -36.83525 2.80987 2.27860 -37.44991 1133.98828
6990.0000 -39.07401 -36.58655 2.48746 2.32324 -37.14330 1136.94254
6995.0000 -39.90099 -37.87697 2.02402 2.35464 -36.92763 1084.74155
7000.0000 -39.91548 -37.07310 2.84239 2.26133 -37.56851 1008.90006
MELTING PROCESS: loop number 29 T-loop= 1078.0000000000000
main_MD> interactions number 29 at Temperature= 1078.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.49268 -2.15242 2.02425
force_rgl> df(natom) 0.69034 2.67206 1.31899
7005.0000 -39.39525 -37.39997 1.99528 2.26985 -37.51005 1013.09917
7010.0000 -39.80999 -37.20272 2.60727 2.31720 -37.18479 1024.88097
7015.0000 -39.69653 -37.07962 2.61691 2.28649 -37.39574 1042.91726
7020.0000 -38.75846 -36.88568 1.87278 2.33350 -37.07287 1058.63300
7025.0000 -39.23301 -37.47257 1.76045 2.26879 -37.51731 922.46613
7030.0000 -40.27977 -38.49325 1.78652 2.24842 -37.65718 1035.28463
7035.0000 -40.10384 -37.99306 2.11078 2.12266 -38.52099 897.16766
7040.0000 -39.54431 -37.40393 2.14038 2.25974 -37.57947 952.39689
7045.0000 -40.36982 -37.84824 2.52158 2.24550 -37.67727 1053.03640
7050.0000 -39.90251 -37.82130 2.08121 2.19099 -38.05166 947.05098
7055.0000 -39.42250 -36.69844 2.72406 2.32378 -37.13961 1116.95080
7060.0000 -38.49441 -35.71900 2.77541 2.47910 -36.07282 1143.21017
7065.0000 -39.59589 -37.08403 2.51186 2.41947 -36.48237 1120.96506
7070.0000 -39.00669 -37.03716 1.96953 2.34880 -36.96777 1167.44385
7075.0000 -39.57516 -37.73606 1.83909 2.25159 -37.63547 980.20016
7080.0000 -39.09325 -37.02079 2.07245 2.20804 -37.93458 981.63198
7085.0000 -39.74921 -37.51385 2.23536 2.34486 -36.99483 1064.85703
7090.0000 -39.40168 -36.93788 2.46380 2.28284 -37.42078 1042.31217
7095.0000 -38.97956 -36.40108 2.57848 2.34730 -36.97810 1188.01584
7100.0000 -39.90581 -37.34578 2.56002 2.31539 -37.19725 1042.43287
7105.0000 -38.83140 -35.99899 2.83242 2.35895 -36.89803 1099.61262
7110.0000 -39.82074 -36.38257 3.43818 2.45326 -36.25031 1231.20380
7115.0000 -40.31831 -37.56003 2.75829 2.29112 -37.36394 1136.26572
7120.0000 -38.97702 -36.43840 2.53861 2.33441 -37.06662 1044.65719
7125.0000 -39.61814 -37.10489 2.51325 2.41122 -36.53904 1127.62189
7130.0000 -39.69817 -37.10867 2.58950 2.32337 -37.14240 1008.85647
7135.0000 -39.90005 -37.11549 2.78456 2.35477 -36.92680 1122.94756
7140.0000 -40.05967 -36.41783 3.64184 2.38343 -36.72989 1169.58206
7145.0000 -37.94408 -35.80302 2.14105 2.51215 -35.84583 1316.12874
7150.0000 -39.84025 -37.81107 2.02918 2.39647 -36.64037 1205.08844
7155.0000 -40.37650 -38.39263 1.98387 2.12019 -38.53791 871.32570
7160.0000 -39.96710 -38.15523 1.81187 2.15770 -38.28027 888.70397
7165.0000 -39.54819 -37.47685 2.07134 2.22898 -37.79075 959.02341
7170.0000 -39.56102 -36.28404 3.27698 2.44209 -36.32704 1315.16251
7175.0000 -39.86715 -36.49313 3.37402 2.42469 -36.44656 1247.15195
7180.0000 -39.83437 -37.67172 2.16265 2.28928 -37.37660 1094.96903
7185.0000 -39.86345 -37.51649 2.34696 2.21855 -37.86238 965.99188
7190.0000 -39.97607 -37.75381 2.22226 2.24465 -37.68307 1039.37694
7195.0000 -39.18724 -36.65152 2.53572 2.28959 -37.37446 1050.17495
7200.0000 -39.41517 -36.74135 2.67382 2.43768 -36.35733 1263.26721
7205.0000 -39.92596 -37.64924 2.27672 2.28148 -37.43017 962.68969
7210.0000 -40.72217 -39.31248 1.40969 2.10862 -38.61741 855.82373
7215.0000 -40.53996 -38.14737 2.39259 2.06359 -38.92668 824.86794
7220.0000 -39.83681 -37.67357 2.16325 2.20306 -37.96874 962.28382
7225.0000 -40.23909 -37.59244 2.64664 2.28933 -37.37624 1123.28005
7230.0000 -38.98673 -36.57669 2.41004 2.36093 -36.88446 1110.19827
7235.0000 -40.56592 -37.66145 2.90448 2.25039 -37.64369 1031.34428
7240.0000 -39.40808 -36.76183 2.64625 2.24989 -37.64710 1023.61919
7245.0000 -40.35471 -38.13373 2.22099 2.26281 -37.55834 998.50309
7250.0000 -39.45482 -36.89944 2.55538 2.31359 -37.20958 1110.74720
MELTING PROCESS: loop number 30 T-loop= 1103.0000000000000
main_MD> interactions number 30 at Temperature= 1103.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.07132 -2.88124 -1.22551
force_rgl> df(natom) -1.87939 -2.41125 0.85309
7255.0000 -39.33806 -36.83833 2.49973 2.37120 -36.81394 1145.98805
7260.0000 -40.12437 -37.43646 2.68791 2.35261 -36.94162 1171.14193
7265.0000 -39.24833 -37.55258 1.69575 2.28674 -37.39400 1012.79446
7270.0000 -40.43281 -37.79075 2.64206 2.26552 -37.53973 1010.18470
7275.0000 -39.65350 -38.01783 1.63566 2.27280 -37.48974 974.82118
7280.0000 -39.89789 -37.58035 2.31753 2.27947 -37.44392 1037.13422
7285.0000 -38.44283 -36.40440 2.03843 2.26604 -37.53616 1024.64055
7290.0000 -39.82884 -37.32001 2.50882 2.41645 -36.50310 1191.55528
7295.0000 -39.26383 -35.95217 3.31166 2.37496 -36.78808 1111.71698
7300.0000 -39.21350 -35.60461 3.60889 2.53419 -35.69448 1369.89734
7305.0000 -39.35412 -36.90699 2.44712 2.47445 -36.10475 1263.72053
7310.0000 -38.96365 -36.00199 2.96166 2.43626 -36.36708 1192.54702
7315.0000 -40.29028 -38.14684 2.14345 2.38967 -36.68710 1172.43486
7320.0000 -40.47499 -38.07005 2.40494 2.14887 -38.34092 946.73867
7325.0000 -39.56020 -36.86481 2.69539 2.23374 -37.75802 947.34333
7330.0000 -39.95774 -36.99734 2.96040 2.31483 -37.20108 1094.11423
7335.0000 -40.77257 -38.47955 2.29302 2.29498 -37.33743 1020.19375
7340.0000 -39.84792 -37.53804 2.30988 2.18449 -38.09628 1018.90410
7345.0000 -40.20126 -37.96139 2.23987 2.23860 -37.72465 998.92146
7350.0000 -39.81674 -37.20864 2.60810 2.20565 -37.95097 897.52200
7355.0000 -38.70468 -36.15692 2.54776 2.42189 -36.46578 1112.16354
7360.0000 -38.72369 -36.62591 2.09778 2.44378 -36.31540 1200.97922
7365.0000 -39.21052 -36.42483 2.78569 2.39678 -36.63823 1157.39835
7370.0000 -38.85019 -36.67302 2.17717 2.37992 -36.75402 1174.07885
7375.0000 -39.83417 -36.82219 3.01198 2.38432 -36.72382 1162.74682
7380.0000 -40.03731 -37.66998 2.36734 2.33025 -37.09515 1150.75606
7385.0000 -40.37952 -36.53540 3.84413 2.19386 -38.03196 977.31081
7390.0000 -39.90081 -37.98293 1.91788 2.28039 -37.43765 1106.38824
7395.0000 -39.95375 -38.28854 1.66521 2.19866 -37.99897 955.85058
7400.0000 -40.98151 -38.17458 2.80693 2.08342 -38.79046 751.21926
7405.0000 -40.32263 -38.28560 2.03704 2.22307 -37.83129 984.04442
7410.0000 -39.22206 -36.58435 2.63771 2.31661 -37.18885 1147.34000
7415.0000 -38.91754 -36.75585 2.16169 2.40854 -36.55745 1175.99894
7420.0000 -38.89144 -35.96442 2.92703 2.33727 -37.04697 1054.11122
7425.0000 -38.86536 -35.83997 3.02538 2.51255 -35.84307 1246.84719
7430.0000 -39.61500 -36.41631 3.19869 2.45862 -36.21352 1302.26298
7435.0000 -39.64319 -36.77049 2.87270 2.34194 -37.01489 1045.20699
7440.0000 -39.40294 -36.14256 3.26038 2.38497 -36.71931 1061.19658
7445.0000 -39.77516 -37.10956 2.66559 2.38015 -36.75242 1113.52490
7450.0000 -40.99305 -38.64681 2.34624 2.24081 -37.70946 1046.97844
7455.0000 -40.52366 -38.77081 1.75285 2.09287 -38.72554 788.40380
7460.0000 -40.02841 -37.47428 2.55412 2.17545 -38.15842 967.96659
7465.0000 -39.95172 -36.88301 3.06871 2.32905 -37.10344 1106.71085
7470.0000 -39.33739 -37.17445 2.16295 2.38763 -36.70109 1136.99323
7475.0000 -39.78178 -37.78798 1.99380 2.28983 -37.37278 952.30998
7480.0000 -39.26306 -37.17435 2.08871 2.27541 -37.47181 1013.61193
7485.0000 -39.54615 -37.26259 2.28357 2.33646 -37.05256 997.26408
7490.0000 -39.19177 -36.14571 3.04606 2.37761 -36.76993 1129.80872
7495.0000 -38.57770 -34.54583 4.03188 2.69412 -34.59599 1428.73922
7500.0000 -39.02270 -35.55627 3.46643 2.63831 -34.97934 1390.48364
MELTING PROCESS: loop number 31 T-loop= 1128.0000000000000
main_MD> interactions number 31 at Temperature= 1128.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65570 -0.62899 -1.31584
force_rgl> df(natom) -1.53967 5.61003 6.36864
7505.0000 -38.96003 -36.23471 2.72532 2.49951 -35.93265 1306.39474
7510.0000 -39.67154 -37.11165 2.55989 2.32360 -37.14083 1110.25335
7515.0000 -40.46868 -38.15748 2.31120 2.26869 -37.51796 1014.78123
7520.0000 -40.05607 -37.90733 2.14874 2.25156 -37.63566 1095.04500
7525.0000 -40.06627 -37.38637 2.67990 2.36344 -36.86721 1104.67760
7530.0000 -39.63515 -37.01813 2.61702 2.33481 -37.06385 1105.62984
7535.0000 -38.42565 -36.04690 2.37875 2.40805 -36.56081 1208.06408
7540.0000 -39.26703 -36.84295 2.42408 2.43005 -36.40975 1141.09952
7545.0000 -38.88928 -35.94617 2.94311 2.36404 -36.86311 995.47379
7550.0000 -40.32912 -37.37994 2.94918 2.45510 -36.23770 1181.10294
7555.0000 -39.80007 -36.95296 2.84711 2.24604 -37.67352 966.14934
7560.0000 -39.41390 -37.01405 2.39986 2.32093 -37.15918 1049.39593
7565.0000 -39.86669 -37.28723 2.57946 2.30369 -37.27759 1072.45813
7570.0000 -39.35566 -37.03219 2.32347 2.28387 -37.41371 1015.01220
7575.0000 -39.25126 -36.60548 2.64577 2.37006 -36.82173 1052.26137
7580.0000 -39.22518 -35.69411 3.53108 2.42562 -36.44012 1245.01042
7585.0000 -39.47176 -36.51893 2.95283 2.48490 -36.03301 1249.42937
7590.0000 -38.09993 -34.77675 3.32318 2.57781 -35.39489 1386.79289
7595.0000 -39.35299 -36.37940 2.97359 2.53721 -35.67369 1309.70079
7600.0000 -37.98724 -35.43162 2.55562 2.54968 -35.58809 1294.34786
7605.0000 -40.48426 -37.20206 3.28219 2.46792 -36.14964 1260.92692
7610.0000 -40.17836 -37.67819 2.50017 2.32192 -37.15239 1120.23198
7615.0000 -39.86737 -37.54000 2.32737 2.21958 -37.85526 1017.58015
7620.0000 -39.79081 -36.67882 3.11199 2.32972 -37.09885 1086.20940
7625.0000 -40.05946 -37.14691 2.91255 2.29458 -37.34020 1032.66149
7630.0000 -38.72290 -36.50501 2.21789 2.39993 -36.61659 1159.83250
7635.0000 -38.43609 -34.31608 4.12002 2.56017 -35.51604 1380.34147
7640.0000 -38.13481 -35.53797 2.59684 2.60166 -35.23106 1336.04046
7645.0000 -37.52114 -34.32072 3.20042 2.57427 -35.41917 1296.67546
7650.0000 -40.45490 -38.26982 2.18507 2.48670 -36.02063 1315.32965
7655.0000 -39.94404 -38.03647 1.90757 2.19728 -38.00849 937.56976
7660.0000 -40.15164 -36.67921 3.47243 2.27098 -37.50228 1063.71596
7665.0000 -39.49939 -37.07992 2.41947 2.38910 -36.69101 1191.44025
7670.0000 -39.25234 -36.78622 2.46612 2.38632 -36.71005 1118.87888
7675.0000 -39.74453 -36.80699 2.93754 2.31622 -37.19155 1094.75623
7680.0000 -39.34027 -36.90678 2.43349 2.43403 -36.38241 1272.17530
7685.0000 -39.25568 -35.79052 3.46516 2.41330 -36.52477 1095.39413
7690.0000 -39.17625 -36.01762 3.15863 2.45852 -36.21420 1245.14196
7695.0000 -39.82016 -36.71431 3.10584 2.43049 -36.40668 1232.05634
7700.0000 -39.95729 -37.30603 2.65126 2.30747 -37.25167 1093.94467
7705.0000 -39.27007 -37.80279 1.46728 2.27985 -37.44137 1047.14704
7710.0000 -39.31183 -37.06904 2.24279 2.22901 -37.79050 927.45719
7715.0000 -39.59815 -37.36040 2.23774 2.37353 -36.79789 1106.03480
7720.0000 -39.41803 -37.16521 2.25282 2.30844 -37.24495 1035.27208
7725.0000 -38.33711 -35.16878 3.16832 2.38302 -36.73276 1137.54146
7730.0000 -38.30748 -34.85302 3.45446 2.65076 -34.89380 1467.82290
7735.0000 -38.64496 -35.89823 2.74673 2.57667 -35.40268 1388.13746
7740.0000 -38.28395 -34.85151 3.43244 2.53202 -35.70938 1336.65715
7745.0000 -39.09830 -36.88547 2.21283 2.44557 -36.30312 1240.66732
7750.0000 -39.20043 -36.52185 2.67858 2.37712 -36.77329 1123.76645
MELTING PROCESS: loop number 32 T-loop= 1153.0000000000000
main_MD> interactions number 32 at Temperature= 1153.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.40119 0.76519 -9.56135
force_rgl> df(natom) -0.67289 1.67645 -3.20378
7755.0000 -39.47784 -37.06289 2.41495 2.38311 -36.73212 1070.03434
7760.0000 -38.92918 -36.99987 1.92931 2.34587 -36.98792 1067.31443
7765.0000 -39.09542 -36.09671 2.99871 2.42604 -36.43727 1185.04879
7770.0000 -38.19637 -35.13265 3.06372 2.63197 -35.02287 1399.46811
7775.0000 -38.25100 -35.38163 2.86937 2.56330 -35.49451 1287.76934
7780.0000 -38.68190 -35.21588 3.46602 2.63037 -35.03387 1515.46470
7785.0000 -39.10781 -36.75633 2.35148 2.41548 -36.50982 1056.28933
7790.0000 -39.45293 -36.57390 2.87903 2.36226 -36.87530 1102.45539
7795.0000 -39.64072 -37.16585 2.47488 2.38191 -36.74037 1219.70563
7800.0000 -39.83807 -37.12460 2.71347 2.29572 -37.33235 1060.62669
7805.0000 -39.84166 -36.97326 2.86840 2.48980 -35.99933 1282.53910
7810.0000 -39.33743 -36.31721 3.02022 2.34222 -37.01297 1100.08412
7815.0000 -39.88854 -36.74570 3.14284 2.40812 -36.56037 1190.91591
7820.0000 -39.05968 -36.85317 2.20651 2.33320 -37.07488 1125.21221
7825.0000 -41.05209 -38.28773 2.76436 2.26695 -37.52992 1091.47685
7830.0000 -40.08574 -37.09110 2.99464 2.28596 -37.39940 1160.81496
7835.0000 -40.94863 -38.56398 2.38465 2.22179 -37.84012 997.15713
7840.0000 -39.03538 -36.81655 2.21883 2.28710 -37.39151 1111.33276
7845.0000 -39.12484 -35.04745 4.07739 2.36599 -36.84970 1131.25587
7850.0000 -39.74942 -37.98567 1.76375 2.42304 -36.45786 1086.40446
7855.0000 -40.09010 -36.70536 3.38474 2.25967 -37.57991 976.11817
7860.0000 -39.66581 -37.25713 2.40868 2.30226 -37.28743 1055.40713
7865.0000 -38.64777 -36.14649 2.50128 2.41340 -36.52410 1130.06684
7870.0000 -39.18937 -36.47727 2.71210 2.40829 -36.55921 1161.22619
7875.0000 -39.47278 -36.47800 2.99477 2.40790 -36.56184 1186.86276
7880.0000 -39.34250 -37.14838 2.19412 2.35121 -36.95120 1051.62163
7885.0000 -37.61812 -35.13187 2.48625 2.50549 -35.89158 1319.07156
7890.0000 -39.93229 -36.28454 3.64775 2.51815 -35.80463 1291.72136
7895.0000 -40.59917 -37.50173 3.09745 2.31947 -37.16920 1144.83774
7900.0000 -39.15925 -36.67625 2.48300 2.40503 -36.58160 1203.73173
7905.0000 -38.52892 -35.05164 3.47727 2.47599 -36.09423 1257.73132
7910.0000 -38.30566 -35.77790 2.52777 2.51084 -35.85486 1219.15997
7915.0000 -39.19825 -35.31033 3.88792 2.59977 -35.24402 1496.81658
7920.0000 -39.05028 -36.35396 2.69632 2.53022 -35.72171 1421.45476
7925.0000 -38.29386 -36.07887 2.21500 2.49305 -35.97704 1309.58965
7930.0000 -38.85784 -36.48958 2.36826 2.51572 -35.82133 1272.31933
7935.0000 -39.63711 -36.57084 3.06627 2.46634 -36.16050 1238.38675
7940.0000 -38.86127 -35.98535 2.87592 2.46857 -36.14515 1262.77591
7945.0000 -39.50228 -36.73058 2.77170 2.44891 -36.28017 1150.96920
7950.0000 -40.03172 -37.24120 2.79052 2.31331 -37.21152 1109.33488
7955.0000 -39.85267 -36.59298 3.25969 2.36026 -36.88906 1152.17205
7960.0000 -39.05448 -36.07722 2.97726 2.38292 -36.73343 1147.87644
7965.0000 -39.30763 -36.26076 3.04687 2.48647 -36.02220 1164.54142
7970.0000 -40.23139 -36.52044 3.71095 2.51498 -35.82638 1339.44535
7975.0000 -39.75771 -36.53242 3.22530 2.43084 -36.40433 1119.64691
7980.0000 -38.88526 -35.35473 3.53053 2.43882 -36.34950 1177.25853
7985.0000 -38.83508 -35.80460 3.03048 2.49573 -35.95860 1333.01460
7990.0000 -39.12949 -37.42931 1.70018 2.41586 -36.50719 1185.13504
7995.0000 -39.38953 -36.84021 2.54932 2.30078 -37.29756 1123.51076
8000.0000 -39.80129 -37.58303 2.21826 2.35968 -36.89307 1096.87985
MELTING PROCESS: loop number 33 T-loop= 1178.0000000000000
main_MD> interactions number 33 at Temperature= 1178.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.80400 0.99504 1.65869
force_rgl> df(natom) -0.07485 -0.14037 -2.62856
8005.0000 -39.48401 -37.17951 2.30450 2.27369 -37.48362 1042.65413
8010.0000 -39.62396 -37.02076 2.60320 2.33104 -37.08976 1085.40275
8015.0000 -40.06744 -37.35622 2.71123 2.33255 -37.07935 1115.29828
8020.0000 -40.72304 -37.64968 3.07336 2.25960 -37.58042 1051.13958
8025.0000 -39.69673 -36.59538 3.10135 2.34853 -36.96963 1108.86613
8030.0000 -39.37759 -35.95805 3.41954 2.46141 -36.19434 1194.97183
8035.0000 -39.26916 -36.56049 2.70868 2.53716 -35.67403 1301.19329
8040.0000 -39.73880 -37.07367 2.66513 2.37439 -36.79202 1107.64007
8045.0000 -38.67922 -36.29158 2.38764 2.43161 -36.39901 1198.46657
8050.0000 -38.08244 -35.14740 2.93503 2.52119 -35.78376 1225.41747
8055.0000 -38.84372 -35.57959 3.26413 2.58342 -35.35636 1393.97826
8060.0000 -39.39539 -37.20937 2.18602 2.40382 -36.58986 1230.98622
8065.0000 -39.71309 -37.25877 2.45432 2.34621 -36.98559 1098.03410
8070.0000 -40.05690 -37.34449 2.71241 2.29906 -37.30938 1102.78155
8075.0000 -39.63420 -36.25100 3.38320 2.40499 -36.58184 1186.67742
8080.0000 -38.65882 -36.35346 2.30536 2.44702 -36.29317 1191.19463
8085.0000 -39.36335 -36.34220 3.02116 2.49341 -35.97455 1267.87638
8090.0000 -40.17125 -37.02016 3.15109 2.40588 -36.57572 1147.77852
8095.0000 -40.44490 -37.64498 2.79993 2.32958 -37.09978 1141.18630
8100.0000 -40.35963 -37.80158 2.55805 2.19166 -38.04707 941.71289
8105.0000 -38.87714 -36.33897 2.53817 2.33928 -37.03314 1096.20711
8110.0000 -38.30150 -35.72923 2.57227 2.40789 -36.56194 1177.66188
8115.0000 -39.87504 -36.82183 3.05321 2.48747 -36.01532 1291.92217
8120.0000 -39.56649 -37.13965 2.42685 2.29182 -37.35912 1055.70075
8125.0000 -39.69171 -36.47192 3.21978 2.42381 -36.45257 1215.81594
8130.0000 -38.85138 -35.80078 3.05060 2.52019 -35.79061 1324.79071
8135.0000 -38.90343 -36.53613 2.36730 2.46064 -36.19959 1180.15541
8140.0000 -39.52162 -37.27112 2.25050 2.32906 -37.10338 1112.81487
8145.0000 -39.91293 -37.70141 2.21152 2.27502 -37.47450 1078.75102
8150.0000 -40.17713 -37.34428 2.83284 2.29058 -37.36768 952.16956
8155.0000 -38.30546 -35.68788 2.61757 2.44535 -36.30466 1267.19474
8160.0000 -39.36402 -36.67479 2.68922 2.34132 -37.01917 1048.93339
8165.0000 -38.27002 -35.69397 2.57604 2.43466 -36.37804 1135.29937
8170.0000 -37.61181 -34.74810 2.86371 2.51477 -35.82785 1231.06902
8175.0000 -39.02065 -35.05640 3.96424 2.63358 -35.01181 1442.23398
8180.0000 -38.50834 -35.40789 3.10045 2.55403 -35.55821 1299.98343
8185.0000 -39.33864 -35.74472 3.59393 2.53742 -35.67228 1233.58953
8190.0000 -40.41672 -37.84804 2.56868 2.43469 -36.37786 1162.11612
8195.0000 -39.34464 -37.04690 2.29774 2.23189 -37.77073 1037.00612
8200.0000 -40.16443 -37.21857 2.94586 2.29254 -37.35415 1055.52902
8205.0000 -39.66301 -37.06441 2.59861 2.33913 -37.03417 1176.43655
8210.0000 -39.89922 -37.51954 2.37968 2.33842 -37.03907 1102.35639
8215.0000 -39.74488 -35.85844 3.88645 2.37864 -36.76282 1120.20364
8220.0000 -39.38425 -35.67063 3.71362 2.42259 -36.46094 1188.69081
8225.0000 -38.05479 -35.51880 2.53599 2.57600 -35.40729 1415.25679
8230.0000 -38.08689 -35.28013 2.80676 2.47514 -36.10003 1230.55325
8235.0000 -39.93991 -36.62743 3.31249 2.44324 -36.31914 1234.66203
8240.0000 -40.87265 -38.16721 2.70544 2.30068 -37.29824 1123.34644
8245.0000 -38.87012 -36.17698 2.69314 2.38313 -36.73198 1151.65476
8250.0000 -39.83587 -36.40251 3.43336 2.47769 -36.08253 1238.58559
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 34.0648768 [s].
main_MD> Deallocating global variables
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