tmlkyza
/
nanoparticlesims
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_71/melt.log

1979 lines
195 KiB
Plaintext
Raw Blame History

main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_71.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 = 71 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1750
main_MD> Size of nv and nvoiz: 71 7100
main_MD> Size of nv and nvoiz: 71 7100
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 = 71
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> 5.4006990398590617E-002 -7.5114907628457211E-002 -0.13306788328283614 initial drift of cluster / NP1 for coalescence
init> 0.34702073541184003 0.35568886358688223 0.32358503550298695 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8994802489947684E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.21914 1.80792 -1.10290
force_rgl> df(natom) -0.57467 0.67790 2.01375
preparo> THERMALIZATION PROCESS AT 313.36086203040736
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -179.54753152413804 2.7833004574891409 -182.33083198162717 3.6988754107935439E-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 35
MELTING PROCESS: loop number 1 T-loop= 338.00000000000000
main_MD> interactions number 1 at Temperature= 338.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.77900 -0.28953 -0.50920
force_rgl> df(natom) -0.56318 -0.04493 0.05452
5.0000 -181.81464 -178.75657 3.05807 1.77911 -178.94471 306.43252
10.0000 -181.44187 -178.16012 3.28175 1.79457 -178.67972 319.74975
15.0000 -181.51255 -178.44902 3.06353 1.81598 -178.31256 338.62494
20.0000 -181.07988 -178.16014 2.91974 1.82131 -178.22114 334.07049
25.0000 -181.57260 -178.48989 3.08271 1.81264 -178.36975 331.73420
30.0000 -181.21064 -177.78252 3.42812 1.82622 -178.13693 341.01116
35.0000 -181.86324 -178.41532 3.44792 1.83133 -178.04936 351.75564
40.0000 -181.72714 -179.41166 2.31548 1.79449 -178.68105 318.19441
45.0000 -181.08648 -177.83147 3.25501 1.79756 -178.62838 315.81638
50.0000 -181.07662 -178.10108 2.97554 1.82740 -178.11679 344.73094
55.0000 -181.54653 -178.18716 3.35937 1.81811 -178.27594 337.09718
60.0000 -181.07310 -178.13174 2.94135 1.84219 -177.86317 354.69209
65.0000 -181.38104 -178.44912 2.93193 1.81704 -178.29441 333.45538
70.0000 -180.90906 -177.97921 2.92985 1.81404 -178.34586 334.25625
75.0000 -181.70697 -178.14992 3.55705 1.83099 -178.05512 352.34335
80.0000 -180.84512 -178.02254 2.82258 1.83025 -178.06778 351.48704
85.0000 -181.35193 -177.99625 3.35568 1.84623 -177.79380 361.92246
90.0000 -181.82192 -178.61839 3.20353 1.80469 -178.50609 323.73728
95.0000 -181.45202 -178.27696 3.17506 1.79368 -178.69498 321.32142
100.0000 -181.46835 -178.32523 3.14313 1.81079 -178.40155 335.91608
105.0000 -181.86365 -178.79846 3.06519 1.79018 -178.75484 316.25242
110.0000 -181.22704 -177.65328 3.57377 1.80640 -178.47687 328.66410
115.0000 -181.76428 -178.54912 3.21516 1.84032 -177.89521 357.94673
120.0000 -181.83860 -178.68847 3.15013 1.81916 -178.25804 336.15169
125.0000 -181.33048 -178.49726 2.83322 1.80633 -178.47799 329.70057
130.0000 -180.79576 -177.73136 3.06439 1.81559 -178.31930 336.93896
135.0000 -181.22151 -177.58667 3.63484 1.86824 -177.41640 376.19205
140.0000 -181.48163 -178.54679 2.93484 1.81928 -178.25594 337.36959
145.0000 -180.93276 -177.72220 3.21056 1.81980 -178.24709 337.58015
150.0000 -180.93932 -177.46697 3.47234 1.84611 -177.79593 359.10853
155.0000 -181.06666 -177.81572 3.25094 1.84679 -177.78417 358.59870
160.0000 -181.25015 -178.04162 3.20853 1.84802 -177.76317 352.03359
165.0000 -181.03786 -177.92300 3.11485 1.82018 -178.24058 328.23478
170.0000 -181.73857 -178.38940 3.34917 1.82031 -178.23830 337.24773
175.0000 -181.23293 -178.00424 3.22869 1.80598 -178.48401 331.47803
180.0000 -181.20582 -177.96630 3.23952 1.83177 -178.04173 348.38031
185.0000 -180.65220 -177.65983 2.99237 1.85914 -177.57256 370.43916
190.0000 -181.66419 -178.22304 3.44114 1.81884 -178.26355 337.75483
195.0000 -181.16355 -178.86975 2.29380 1.81532 -178.32390 335.23676
200.0000 -181.47682 -177.95856 3.51826 1.82583 -178.14360 338.08909
205.0000 -181.22073 -178.18006 3.04066 1.83621 -177.96571 350.23929
210.0000 -180.84817 -177.21286 3.63531 1.84931 -177.74108 367.99158
215.0000 -181.25925 -178.02062 3.23863 1.85879 -177.57857 375.81926
220.0000 -181.47617 -178.03488 3.44129 1.83585 -177.97185 349.12939
225.0000 -181.41654 -178.36596 3.05058 1.82562 -178.14717 340.24983
230.0000 -181.22323 -178.18436 3.03887 1.82868 -178.09480 343.10596
235.0000 -181.36364 -178.62066 2.74298 1.80341 -178.52805 326.49688
240.0000 -181.87416 -178.62718 3.24698 1.81652 -178.30329 333.53672
245.0000 -180.95321 -178.00534 2.94787 1.82613 -178.13857 344.18728
250.0000 -181.01100 -178.35276 2.65824 1.81621 -178.30863 332.61792
MELTING PROCESS: loop number 2 T-loop= 363.00000000000000
main_MD> interactions number 2 at Temperature= 363.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44648 0.68946 -0.80533
force_rgl> df(natom) 2.19077 2.05688 0.91691
255.0000 -181.20587 -177.85537 3.35050 1.85460 -177.65036 365.04914
260.0000 -181.02388 -177.65313 3.37075 1.83217 -178.03490 343.98441
265.0000 -180.26285 -176.67381 3.58904 1.86493 -177.47330 368.01271
270.0000 -181.18072 -177.65458 3.52613 1.87266 -177.34060 383.51616
275.0000 -180.29889 -177.05554 3.24334 1.87796 -177.24980 387.34922
280.0000 -181.04362 -177.61635 3.42727 1.86315 -177.50372 381.41730
285.0000 -180.87412 -176.67730 4.19681 1.89534 -176.95188 409.44143
290.0000 -180.63607 -176.70875 3.92732 1.92706 -176.40786 422.97165
295.0000 -181.24647 -177.26963 3.97684 1.86912 -177.40137 381.79011
300.0000 -180.66867 -176.68009 3.98858 1.87330 -177.32965 392.82149
305.0000 -180.97882 -177.62639 3.35243 1.88140 -177.19082 399.10023
310.0000 -180.64084 -177.20919 3.43164 1.87516 -177.29780 393.77741
315.0000 -181.23623 -177.94795 3.28828 1.87542 -177.29331 393.40261
320.0000 -180.61484 -176.87900 3.73584 1.87285 -177.33742 390.87538
325.0000 -181.26654 -177.93669 3.32985 1.86556 -177.46236 380.42596
330.0000 -181.01296 -178.15496 2.85801 1.81391 -178.34798 341.64246
335.0000 -181.00162 -177.21832 3.78330 1.85005 -177.72833 367.93693
340.0000 -180.95391 -177.11728 3.83662 1.88315 -177.16089 394.52137
345.0000 -181.63829 -178.50390 3.13439 1.81616 -178.30936 336.26516
350.0000 -181.44073 -178.01569 3.42505 1.82939 -178.08266 350.53826
355.0000 -181.68092 -178.27445 3.40647 1.81921 -178.25714 341.72697
360.0000 -180.99728 -177.33282 3.66446 1.82939 -178.08252 357.56149
365.0000 -180.88214 -178.01894 2.86320 1.85953 -177.56589 367.87642
370.0000 -181.48760 -177.96372 3.52388 1.80781 -178.45269 329.17388
375.0000 -181.00087 -177.42521 3.57566 1.86490 -177.47378 380.30838
380.0000 -181.12612 -177.85453 3.27159 1.86840 -177.41376 378.42366
385.0000 -181.60563 -178.65215 2.95348 1.79595 -178.65594 319.78892
390.0000 -181.39837 -177.70744 3.69093 1.82671 -178.12849 351.85320
395.0000 -181.52529 -178.33195 3.19334 1.82328 -178.18740 350.34685
400.0000 -181.41674 -178.44971 2.96703 1.82635 -178.13470 349.84439
405.0000 -180.62177 -177.41335 3.20842 1.82275 -178.19647 348.21603
410.0000 -181.30008 -178.44645 2.85364 1.83699 -177.95236 366.09661
415.0000 -180.49633 -177.78244 2.71389 1.84311 -177.84742 367.81596
420.0000 -180.54405 -177.34986 3.19419 1.84977 -177.73313 366.81621
425.0000 -181.45678 -178.11545 3.34133 1.86232 -177.51793 381.23277
430.0000 -181.53665 -177.77351 3.76314 1.82262 -178.19866 350.15615
435.0000 -180.41260 -177.20796 3.20464 1.84973 -177.73387 372.71120
440.0000 -180.48209 -176.35217 4.12992 1.90942 -176.71041 421.76144
445.0000 -181.24066 -177.80589 3.43477 1.87259 -177.34185 389.02988
450.0000 -181.29054 -178.30501 2.98552 1.82642 -178.13348 352.74380
455.0000 -181.22157 -177.77824 3.44333 1.84198 -177.86673 360.91038
460.0000 -181.75319 -178.41214 3.34105 1.84735 -177.77467 367.82411
465.0000 -181.24051 -177.94299 3.29752 1.82613 -178.13848 349.20391
470.0000 -180.83522 -177.12195 3.71327 1.86636 -177.44876 385.05008
475.0000 -181.76632 -178.42462 3.34170 1.83400 -178.00363 357.86080
480.0000 -181.65052 -178.56512 3.08540 1.80607 -178.48245 333.36413
485.0000 -181.65234 -178.22476 3.42758 1.79870 -178.60883 327.04030
490.0000 -181.25391 -178.83669 2.41723 1.81931 -178.25543 341.41052
495.0000 -181.30412 -178.26924 3.03488 1.83170 -178.04307 354.06415
500.0000 -181.35124 -178.37768 2.97356 1.82355 -178.18271 347.91826
MELTING PROCESS: loop number 3 T-loop= 388.00000000000000
main_MD> interactions number 3 at Temperature= 388.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.41701 -0.64043 -0.25810
force_rgl> df(natom) 0.20142 -1.30962 -1.34987
505.0000 -181.41011 -177.91057 3.49954 1.82915 -178.08679 355.27569
510.0000 -180.82690 -177.13356 3.69334 1.87162 -177.35854 384.79688
515.0000 -180.96891 -177.22104 3.74787 1.88576 -177.11610 387.16548
520.0000 -181.32819 -177.20149 4.12670 1.84936 -177.74011 365.99845
525.0000 -180.59363 -176.82733 3.76630 1.88711 -177.09296 402.92081
530.0000 -180.99745 -177.54235 3.45510 1.87964 -177.22101 384.10988
535.0000 -181.43948 -178.08088 3.35860 1.86087 -177.54286 377.43633
540.0000 -181.08861 -178.23727 2.85134 1.82436 -178.16879 345.39240
545.0000 -181.12920 -176.92446 4.20473 1.87322 -177.33112 389.41859
550.0000 -181.47751 -177.74693 3.73058 1.88823 -177.07364 399.33535
555.0000 -181.14895 -177.63375 3.51520 1.83995 -177.90152 361.53630
560.0000 -180.80365 -177.29229 3.51136 1.86199 -177.52359 385.60007
565.0000 -181.02924 -177.65244 3.37680 1.87666 -177.27216 391.48765
570.0000 -180.96171 -177.27723 3.68449 1.87992 -177.21612 391.20707
575.0000 -181.01801 -177.23278 3.78522 1.86029 -177.55277 371.63352
580.0000 -180.31719 -176.67642 3.64077 1.88631 -177.10670 386.94611
585.0000 -180.45693 -177.06576 3.39117 1.90985 -176.70292 417.95485
590.0000 -180.20466 -176.92724 3.27742 1.87871 -177.23695 393.69540
595.0000 -180.85358 -176.82636 4.02722 1.90595 -176.76984 407.72002
600.0000 -180.42410 -176.53713 3.88697 1.91297 -176.64953 417.18140
605.0000 -180.00591 -176.48937 3.51655 1.91723 -176.57651 429.12091
610.0000 -180.68248 -176.69228 3.99020 1.88418 -177.14316 403.01059
615.0000 -179.69191 -176.21028 3.48163 1.91343 -176.64158 418.64407
620.0000 -180.14181 -177.16827 2.97354 1.90067 -176.86043 404.29633
625.0000 -181.51891 -178.00665 3.51225 1.84056 -177.89111 362.08927
630.0000 -181.51181 -177.69539 3.81643 1.85956 -177.56522 374.52369
635.0000 -181.45796 -178.32672 3.13124 1.84820 -177.76011 367.06233
640.0000 -181.18119 -177.97936 3.20183 1.83712 -177.95012 361.18827
645.0000 -180.34233 -176.55547 3.78687 1.86332 -177.50082 365.17425
650.0000 -180.79287 -177.25102 3.54184 1.88883 -177.06347 393.83393
655.0000 -181.14162 -177.52976 3.61185 1.87451 -177.30902 388.09030
660.0000 -180.50528 -176.81987 3.68542 1.87403 -177.31716 386.73501
665.0000 -179.83798 -175.87343 3.96455 1.92270 -176.48263 417.49766
670.0000 -180.06862 -176.32781 3.74081 1.95013 -176.01228 442.93037
675.0000 -180.86019 -176.78448 4.07571 1.92018 -176.52584 422.11439
680.0000 -180.86275 -177.24883 3.61391 1.89233 -177.00333 400.50032
685.0000 -180.91809 -177.37068 3.54740 1.87990 -177.21655 391.32796
690.0000 -181.41074 -177.30284 4.10790 1.85228 -177.69014 370.21477
695.0000 -181.02269 -177.67822 3.34447 1.85286 -177.68024 366.53905
700.0000 -180.35994 -177.39746 2.96249 1.86437 -177.48287 377.70366
705.0000 -181.09977 -177.77523 3.32454 1.86464 -177.47818 377.84850
710.0000 -180.79472 -177.48356 3.31117 1.84523 -177.81108 362.99504
715.0000 -180.78930 -176.78759 4.00171 1.88406 -177.14517 395.18579
720.0000 -180.82975 -177.09151 3.73823 1.91488 -176.61673 425.07709
725.0000 -180.55239 -177.20934 3.34305 1.87451 -177.30888 388.85567
730.0000 -180.58159 -176.36125 4.22034 1.87982 -177.21792 392.43830
735.0000 -180.29656 -176.74663 3.54994 1.92739 -176.40218 437.50223
740.0000 -181.44871 -177.66096 3.78775 1.88347 -177.15541 395.06544
745.0000 -180.44350 -176.98056 3.46294 1.86964 -177.39242 377.38661
750.0000 -181.18298 -177.28814 3.89484 1.86424 -177.48503 378.78602
MELTING PROCESS: loop number 4 T-loop= 413.00000000000000
main_MD> interactions number 4 at Temperature= 413.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.12273 -0.08275 0.07959
force_rgl> df(natom) -0.16916 1.03415 0.51296
755.0000 -180.88238 -176.82959 4.05279 1.88282 -177.16640 395.81285
760.0000 -180.55176 -177.29036 3.26140 1.87861 -177.23857 393.31180
765.0000 -180.12639 -176.16546 3.96093 1.91510 -176.61295 423.04505
770.0000 -180.50851 -176.59458 3.91393 1.89768 -176.91164 409.69305
775.0000 -180.58689 -176.76999 3.81690 1.90851 -176.72597 416.58557
780.0000 -180.54825 -177.20786 3.34039 1.89344 -176.98431 394.81620
785.0000 -180.83405 -177.30210 3.53195 1.87993 -177.21609 391.80019
790.0000 -180.76784 -177.14645 3.62139 1.87839 -177.24239 386.95735
795.0000 -179.92780 -176.67839 3.24941 1.88504 -177.12846 397.31928
800.0000 -180.08411 -177.09828 2.98583 1.90848 -176.72649 414.94307
805.0000 -180.24378 -176.41511 3.82868 1.92172 -176.49946 432.99304
810.0000 -180.39334 -176.44465 3.94870 1.93253 -176.31410 431.58679
815.0000 -180.13285 -175.54524 4.58761 1.94963 -176.02086 432.97302
820.0000 -181.02886 -177.02641 4.00245 1.94303 -176.13406 425.63260
825.0000 -179.90515 -176.25776 3.64739 1.91355 -176.63948 406.53778
830.0000 -179.45750 -175.64252 3.81497 1.94667 -176.07163 435.63692
835.0000 -180.85511 -176.36082 4.49429 1.95029 -176.00957 448.06205
840.0000 -180.50895 -177.54696 2.96199 1.86771 -177.42549 383.16493
845.0000 -180.31294 -177.22433 3.08861 1.86021 -177.55410 377.80251
850.0000 -181.33155 -177.47998 3.85157 1.87555 -177.29117 395.85858
855.0000 -180.94042 -177.42390 3.51652 1.86764 -177.42674 385.69758
860.0000 -181.12845 -177.37783 3.75063 1.86494 -177.47304 385.63324
865.0000 -181.68032 -177.96694 3.71338 1.86228 -177.51873 390.48355
870.0000 -181.32834 -177.85089 3.47745 1.84209 -177.86486 366.13523
875.0000 -180.94614 -177.52115 3.42499 1.83872 -177.92255 362.58471
880.0000 -180.16003 -176.69099 3.46904 1.88949 -177.05209 403.57983
885.0000 -180.79901 -176.65963 4.13939 1.89638 -176.93396 403.66413
890.0000 -180.55166 -176.67579 3.87587 1.91254 -176.65691 419.76484
895.0000 -180.21953 -176.87911 3.34042 1.90583 -176.77185 414.04839
900.0000 -181.63636 -177.56238 4.07398 1.88734 -177.08904 400.75566
905.0000 -181.07740 -177.74861 3.32879 1.84819 -177.76029 367.97043
910.0000 -180.70753 -176.84734 3.86019 1.89837 -176.89977 414.12883
915.0000 -180.86244 -176.94197 3.92046 1.88963 -177.04978 406.10362
920.0000 -180.85783 -176.54301 4.31482 1.91313 -176.64683 420.02898
925.0000 -180.19964 -176.06906 4.13058 1.91360 -176.63874 419.56985
930.0000 -180.20448 -176.60587 3.59861 1.93949 -176.19473 437.53134
935.0000 -180.78458 -176.36603 4.41855 1.92207 -176.49343 424.92674
940.0000 -180.89839 -177.00108 3.89731 1.93047 -176.34947 425.14433
945.0000 -179.90985 -176.42826 3.48158 1.91077 -176.68731 405.25292
950.0000 -180.29769 -176.56058 3.73711 1.92804 -176.39116 419.82140
955.0000 -180.53043 -176.94373 3.58670 1.89918 -176.88594 404.12968
960.0000 -180.46972 -177.16579 3.30393 1.89894 -176.89014 407.50505
965.0000 -180.41148 -176.00675 4.40473 1.91639 -176.59092 426.45041
970.0000 -180.49704 -176.91736 3.57969 1.92253 -176.48562 434.22927
975.0000 -180.75260 -176.91826 3.83434 1.89975 -176.87617 415.71443
980.0000 -180.86806 -176.88968 3.97838 1.90614 -176.76666 424.58888
985.0000 -180.67329 -177.37037 3.30292 1.90153 -176.84567 415.37762
990.0000 -180.87162 -176.96484 3.90678 1.89692 -176.92476 410.09330
995.0000 -180.60477 -176.74480 3.85997 1.90255 -176.82821 409.47156
1000.0000 -180.76762 -177.00879 3.75883 1.90088 -176.85679 410.56257
MELTING PROCESS: loop number 5 T-loop= 438.00000000000000
main_MD> interactions number 5 at Temperature= 438.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.65863 2.49564 3.87138
force_rgl> df(natom) 0.67750 -1.89834 -1.89749
1005.0000 -180.75407 -177.16686 3.58722 1.89891 -176.89060 408.04838
1010.0000 -180.46727 -176.77496 3.69232 1.89728 -176.91850 409.29157
1015.0000 -181.23516 -177.14031 4.09486 1.87191 -177.35347 382.32145
1020.0000 -181.32800 -177.00712 4.32088 1.86631 -177.44961 384.60957
1025.0000 -180.44287 -176.97394 3.46893 1.89872 -176.89392 411.19976
1030.0000 -180.41705 -176.96807 3.44898 1.89474 -176.96200 409.86479
1035.0000 -179.55820 -176.12156 3.43665 1.93026 -176.35304 436.08218
1040.0000 -180.78107 -177.19745 3.58363 1.89823 -176.90230 405.74906
1045.0000 -180.90072 -176.97368 3.92704 1.90423 -176.79938 427.46428
1050.0000 -181.22307 -177.57904 3.64403 1.86466 -177.47786 397.12999
1055.0000 -180.74949 -177.13877 3.61072 1.86983 -177.38928 402.01836
1060.0000 -180.96895 -176.54650 4.42245 1.91791 -176.56472 446.74047
1065.0000 -180.93196 -176.84756 4.08440 1.92653 -176.41699 451.33518
1070.0000 -180.46785 -176.25476 4.21309 1.93884 -176.20599 450.47486
1075.0000 -179.25171 -175.24212 4.00959 1.96512 -175.75532 467.39541
1080.0000 -180.15724 -175.56306 4.59418 1.95771 -175.88237 460.72738
1085.0000 -180.34362 -176.40760 3.93603 1.92773 -176.39637 437.99155
1090.0000 -180.21790 -176.24010 3.97779 1.92864 -176.38086 443.25110
1095.0000 -180.69526 -176.53116 4.16409 1.94026 -176.18160 446.17709
1100.0000 -180.71119 -176.99393 3.71725 1.88284 -177.16620 399.67880
1105.0000 -181.00067 -176.83576 4.16491 1.89670 -176.92855 410.74257
1110.0000 -180.24050 -175.92587 4.31464 1.93541 -176.26466 439.92922
1115.0000 -180.25211 -176.13082 4.12129 1.94894 -176.03272 454.66422
1120.0000 -181.41007 -177.67801 3.73206 1.87784 -177.25193 438.81654
1125.0000 -182.31657 -178.06644 4.25013 1.82675 -178.12792 395.60003
1130.0000 -181.30867 -176.92703 4.38164 1.86643 -177.44754 427.11681
1135.0000 -180.73299 -176.85095 3.88203 1.90118 -176.85159 459.41552
1140.0000 -181.34907 -177.73724 3.61183 1.85154 -177.70286 419.82974
1145.0000 -181.25154 -177.11678 4.13476 1.88363 -177.15263 443.99640
1150.0000 -181.39682 -177.22426 4.17256 1.88414 -177.14390 446.70922
1155.0000 -181.52397 -177.87426 3.64971 1.87152 -177.36025 431.86353
1160.0000 -182.25291 -178.81395 3.43897 1.81778 -178.28160 393.21400
1165.0000 -182.12164 -178.31948 3.80217 1.79695 -178.63890 373.96611
1170.0000 -181.24641 -177.52032 3.72609 1.84929 -177.74134 421.01531
1175.0000 -181.70966 -177.91935 3.79031 1.84999 -177.72930 420.52443
1180.0000 -180.98324 -176.93844 4.04480 1.86098 -177.54094 427.65542
1185.0000 -180.86267 -177.45118 3.41150 1.90786 -176.73714 461.94556
1190.0000 -180.91634 -176.52953 4.38681 1.88951 -177.05182 448.79324
1195.0000 -181.48829 -177.60347 3.88482 1.90849 -176.72632 469.85079
1200.0000 -181.03123 -176.93602 4.09522 1.86974 -177.39078 434.02002
1205.0000 -181.29616 -177.26775 4.02842 1.89710 -176.92157 454.95655
1210.0000 -181.19378 -177.04640 4.14738 1.89269 -176.99716 455.21227
1215.0000 -181.10009 -177.36838 3.73171 1.87275 -177.33905 436.15080
1220.0000 -181.74896 -177.72617 4.02279 1.86280 -177.50976 427.41659
1225.0000 -180.51113 -175.93161 4.57952 1.90145 -176.84706 458.12492
1230.0000 -180.98964 -176.27637 4.71327 1.94707 -176.06482 497.74267
1235.0000 -181.46575 -177.18423 4.28152 1.91108 -176.68194 467.91620
1240.0000 -181.10469 -176.87625 4.22844 1.89013 -177.04107 455.35807
1245.0000 -181.86904 -177.48512 4.38393 1.88701 -177.09469 444.49788
1250.0000 -181.63541 -177.55161 4.08380 1.88330 -177.15823 446.79798
MELTING PROCESS: loop number 6 T-loop= 463.00000000000000
main_MD> interactions number 6 at Temperature= 463.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.83973 1.47581 2.31866
force_rgl> df(natom) 2.65498 0.75459 1.90086
1255.0000 -180.72562 -176.42822 4.29739 1.89787 -176.90836 451.70906
1260.0000 -181.62306 -177.49796 4.12510 1.90496 -176.78691 460.99873
1265.0000 -181.18787 -176.65975 4.52812 1.90881 -176.72091 466.44302
1270.0000 -180.61506 -177.06023 3.55483 1.89453 -176.96566 455.42112
1275.0000 -180.29177 -176.27429 4.01748 1.89687 -176.92560 460.03118
1280.0000 -180.68877 -175.78910 4.89967 1.92010 -176.52732 480.31053
1285.0000 -181.62841 -177.65334 3.97507 1.91046 -176.69251 466.03929
1290.0000 -180.92926 -176.83374 4.09552 1.85884 -177.57770 421.32659
1295.0000 -181.31467 -176.98762 4.32704 1.92382 -176.46352 475.15903
1300.0000 -180.78315 -176.95912 3.82403 1.89618 -176.93745 457.18554
1305.0000 -181.42313 -177.07120 4.35194 1.88400 -177.14622 442.98927
1310.0000 -181.01980 -176.93850 4.08130 1.90028 -176.86710 461.15595
1315.0000 -180.65847 -176.76618 3.89228 1.90175 -176.84183 459.85275
1320.0000 -181.23625 -177.08211 4.15414 1.90154 -176.84551 458.83609
1325.0000 -181.49049 -177.34491 4.14558 1.90400 -176.80329 474.35151
1330.0000 -181.99635 -177.55076 4.44559 1.86974 -177.39081 436.84557
1335.0000 -181.15842 -177.02157 4.13686 1.88541 -177.12207 447.46676
1340.0000 -180.60853 -175.86639 4.74214 1.92143 -176.50445 475.66707
1345.0000 -181.72165 -177.64043 4.08122 1.90975 -176.70477 467.81506
1350.0000 -181.02415 -176.69247 4.33168 1.90296 -176.82107 471.27935
1355.0000 -180.86589 -176.32794 4.53795 1.93491 -176.27338 475.50546
1360.0000 -181.32914 -176.95950 4.36964 1.91564 -176.60367 464.99174
1365.0000 -181.47351 -177.00800 4.46550 1.88914 -177.05806 447.60380
1370.0000 -180.74814 -176.84899 3.89914 1.90459 -176.79311 456.61419
1375.0000 -180.97771 -176.73792 4.23979 1.90560 -176.77591 460.39622
1380.0000 -181.39973 -177.70542 3.69431 1.87842 -177.24186 447.68579
1385.0000 -181.31132 -177.06243 4.24889 1.87446 -177.30985 442.09458
1390.0000 -180.35488 -175.69238 4.66250 1.91196 -176.66687 470.91006
1395.0000 -180.22123 -175.86750 4.35373 1.95400 -175.94604 497.37464
1400.0000 -181.59536 -176.17638 5.41898 1.94925 -176.02747 501.10742
1405.0000 -180.80294 -176.27778 4.52516 1.93028 -176.35262 487.07198
1410.0000 -181.35724 -176.72928 4.62796 1.92430 -176.45532 477.05462
1415.0000 -180.54076 -176.15366 4.38709 1.91326 -176.64457 457.31745
1420.0000 -181.12225 -176.32668 4.79558 1.91703 -176.57985 476.48506
1425.0000 -181.76805 -177.08657 4.68148 1.89845 -176.89841 462.76759
1430.0000 -181.05367 -176.61785 4.43582 1.91785 -176.56579 466.27045
1435.0000 -180.85655 -176.85346 4.00309 1.91601 -176.59742 469.90092
1440.0000 -181.38476 -175.85997 5.52479 1.92129 -176.50689 473.97042
1445.0000 -180.76988 -176.04315 4.72673 1.95436 -175.93984 500.69161
1450.0000 -180.92730 -176.31934 4.60796 1.94999 -176.01469 504.40560
1455.0000 -180.58215 -176.21191 4.37024 1.92740 -176.40215 472.67048
1460.0000 -180.50229 -176.56083 3.94146 1.90866 -176.72345 465.14276
1465.0000 -180.87884 -176.19232 4.68653 1.91562 -176.60402 473.53902
1470.0000 -181.20392 -176.35870 4.84521 1.93943 -176.19580 493.97538
1475.0000 -180.86700 -176.55934 4.30767 1.93209 -176.32168 489.04359
1480.0000 -181.10558 -176.87418 4.23140 1.89339 -176.98516 455.48660
1485.0000 -181.03941 -176.96051 4.07890 1.89799 -176.90643 454.38423
1490.0000 -180.66710 -175.58183 5.08526 1.94344 -176.12706 491.42221
1495.0000 -180.25572 -175.93098 4.32474 1.95567 -175.91744 507.64663
1500.0000 -181.02837 -176.80697 4.22140 1.91828 -176.55843 470.97748
MELTING PROCESS: loop number 7 T-loop= 488.00000000000000
main_MD> interactions number 7 at Temperature= 488.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.45715 -2.42448 2.01484
force_rgl> df(natom) -1.01335 -2.17663 0.21070
1505.0000 -181.14644 -176.99385 4.15258 1.90095 -176.85568 462.14173
1510.0000 -180.95155 -177.25362 3.69794 1.89251 -177.00029 453.20388
1515.0000 -180.30437 -175.86064 4.44374 1.90814 -176.73233 462.23536
1520.0000 -180.60006 -176.13905 4.46101 1.94764 -176.05504 499.77505
1525.0000 -180.67574 -175.75610 4.91964 1.94502 -176.09989 488.44544
1530.0000 -180.05260 -176.28095 3.77165 1.93475 -176.27614 484.47963
1535.0000 -180.66121 -175.67338 4.98783 1.95738 -175.88799 508.67961
1540.0000 -179.84113 -174.98568 4.85545 1.97856 -175.52480 514.20325
1545.0000 -180.29366 -175.60814 4.68552 1.97894 -175.51837 522.58273
1550.0000 -179.74725 -175.18980 4.55745 1.98782 -175.36617 522.99428
1555.0000 -181.02236 -176.93065 4.09171 1.96002 -175.84271 503.55567
1560.0000 -181.56068 -177.70937 3.85130 1.88686 -177.09714 446.33118
1565.0000 -181.30430 -176.29169 5.01261 1.87795 -177.24991 438.42967
1570.0000 -181.11098 -175.94737 5.16362 1.94631 -176.07792 505.13540
1575.0000 -179.83057 -174.79282 5.03774 1.99304 -175.27662 534.60499
1580.0000 -179.97683 -175.82451 4.15232 2.00928 -174.99810 544.45779
1585.0000 -180.43172 -175.50274 4.92897 1.95686 -175.89696 490.91168
1590.0000 -180.53707 -175.60860 4.92847 1.97875 -175.52157 521.95553
1595.0000 -179.77138 -175.47522 4.29615 1.99494 -175.24407 537.85027
1600.0000 -180.31020 -176.40474 3.90546 1.94885 -176.03436 495.28340
1605.0000 -180.87833 -176.07580 4.80253 1.94458 -176.10755 492.30335
1610.0000 -180.77082 -176.58864 4.18219 1.95941 -175.85322 499.29393
1615.0000 -180.47239 -176.53782 3.93457 1.92458 -176.45037 480.44168
1620.0000 -179.71207 -175.43851 4.27356 1.93868 -176.20861 486.96359
1625.0000 -180.86797 -175.79134 5.07664 1.96148 -175.81774 503.94311
1630.0000 -181.07365 -176.41841 4.65524 1.92196 -176.49530 476.51023
1635.0000 -180.74804 -177.31704 3.43100 1.89159 -177.01602 447.17106
1640.0000 -181.04044 -176.90046 4.13998 1.89657 -176.93067 455.57653
1645.0000 -181.13000 -176.23530 4.89470 1.91136 -176.67704 467.01663
1650.0000 -180.37021 -175.83624 4.53397 1.97140 -175.64760 526.77635
1655.0000 -180.11663 -174.98154 5.13509 1.97935 -175.51126 528.16376
1660.0000 -180.33318 -174.41002 5.92316 2.01480 -174.90343 552.87269
1665.0000 -180.85976 -176.12737 4.73240 2.00020 -175.15379 532.25696
1670.0000 -181.48119 -176.44162 5.03958 1.93783 -176.22324 488.74849
1675.0000 -180.93920 -176.44872 4.49048 1.91899 -176.54631 473.66733
1680.0000 -180.81159 -175.92032 4.89127 1.94297 -176.13504 490.31052
1685.0000 -179.66147 -175.59430 4.06717 1.97602 -175.56834 512.03055
1690.0000 -181.70105 -177.09088 4.61017 1.91955 -176.53662 470.19111
1695.0000 -180.96959 -176.35834 4.61126 1.88425 -177.14200 451.16796
1700.0000 -180.63505 -175.75413 4.88093 1.96039 -175.83637 512.74831
1705.0000 -179.65963 -175.31593 4.34370 1.95595 -175.91250 497.71719
1710.0000 -180.49402 -174.82237 5.67166 1.99845 -175.18389 533.36543
1715.0000 -181.43059 -176.54527 4.88531 1.96866 -175.69463 512.18168
1720.0000 -180.66753 -175.81459 4.85294 1.93034 -176.35176 473.67492
1725.0000 -180.77734 -175.27591 5.50144 1.96323 -175.78776 511.94496
1730.0000 -180.70994 -174.96089 5.74905 2.00456 -175.07906 538.69133
1735.0000 -180.47677 -176.18149 4.29528 1.99346 -175.26944 530.33992
1740.0000 -180.85879 -176.91037 3.94842 1.91642 -176.59037 473.11565
1745.0000 -180.51655 -176.57746 3.93909 1.91724 -176.57636 470.02701
1750.0000 -181.86503 -178.05584 3.80919 1.88207 -177.17926 444.77412
MELTING PROCESS: loop number 8 T-loop= 513.00000000000000
main_MD> interactions number 8 at Temperature= 513.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.40049 0.49327 2.09937
force_rgl> df(natom) -0.24830 0.59446 -1.05296
1755.0000 -180.44520 -175.86077 4.58443 1.89226 -177.00464 456.76741
1760.0000 -180.01869 -175.31256 4.70613 1.99332 -175.27174 541.47675
1765.0000 -180.99050 -176.98499 4.00551 1.91735 -176.57435 473.42515
1770.0000 -179.40832 -174.93771 4.47061 1.93922 -176.19939 488.75979
1775.0000 -180.13179 -174.78932 5.34247 2.00174 -175.12750 540.23002
1780.0000 -180.64128 -175.78301 4.85828 1.97209 -175.63583 511.26031
1785.0000 -181.20518 -175.89416 5.31102 1.94105 -176.16804 490.61111
1790.0000 -181.40343 -176.78667 4.61675 1.93318 -176.30306 489.14859
1795.0000 -180.99142 -177.12723 3.86420 1.92370 -176.46549 473.21975
1800.0000 -181.07586 -176.65969 4.41617 1.90078 -176.85846 461.54494
1805.0000 -181.07124 -176.78593 4.28531 1.90602 -176.76861 470.60993
1810.0000 -181.17290 -176.87452 4.29837 1.93762 -176.22678 488.61008
1815.0000 -180.93673 -176.12227 4.81446 1.92968 -176.36296 490.01709
1820.0000 -180.46580 -176.17698 4.28882 1.94487 -176.10246 494.17196
1825.0000 -180.79428 -176.57033 4.22395 1.95781 -175.88063 496.37238
1830.0000 -179.98770 -175.31266 4.67504 1.95406 -175.94500 507.84282
1835.0000 -179.46946 -174.78689 4.68257 2.01454 -174.90801 550.93434
1840.0000 -180.70473 -175.44098 5.26375 1.98140 -175.47618 528.25751
1845.0000 -178.61787 -174.05874 4.55912 2.01359 -174.92416 541.29016
1850.0000 -179.62648 -175.28506 4.34141 2.04009 -174.46987 545.84613
1855.0000 -178.90142 -173.71046 5.19095 2.03627 -174.53539 520.55444
1860.0000 -178.81204 -173.93607 4.87597 2.12772 -172.96726 613.15419
1865.0000 -179.63329 -174.84870 4.78459 2.01492 -174.90148 547.90331
1870.0000 -179.81264 -174.99723 4.81541 2.03405 -174.57339 568.70986
1875.0000 -180.32304 -175.58449 4.73855 1.99356 -175.26770 536.36178
1880.0000 -180.52652 -175.52251 5.00401 2.00277 -175.10973 536.29072
1885.0000 -179.78559 -175.04283 4.74277 1.97629 -175.56385 503.86845
1890.0000 -180.49360 -176.02735 4.46625 2.00941 -174.99594 541.74064
1895.0000 -180.50624 -174.96536 5.54087 1.96064 -175.83213 502.54182
1900.0000 -180.68665 -175.58189 5.10477 1.98435 -175.42565 530.20846
1905.0000 -180.93278 -175.48800 5.44479 1.97367 -175.60872 508.14471
1910.0000 -180.27493 -175.50715 4.76778 1.96067 -175.83165 503.22604
1915.0000 -179.79933 -174.85266 4.94667 1.99140 -175.30468 526.60225
1920.0000 -179.97715 -175.43486 4.54229 1.99362 -175.26668 528.87218
1925.0000 -180.47761 -175.14821 5.32940 1.96515 -175.75486 512.76267
1930.0000 -180.28578 -175.56893 4.71685 1.96463 -175.76380 504.52320
1935.0000 -181.03993 -175.57078 5.46915 1.98879 -175.34946 534.77597
1940.0000 -180.38666 -176.44251 3.94414 1.93949 -176.19475 488.81820
1945.0000 -180.71296 -175.96951 4.74345 1.92112 -176.50972 479.94836
1950.0000 -180.29700 -175.67271 4.62429 1.98224 -175.46175 527.24258
1955.0000 -180.60853 -175.35015 5.25838 1.97899 -175.51753 523.67892
1960.0000 -180.08000 -175.51778 4.56221 1.95991 -175.84474 504.68917
1965.0000 -181.41562 -175.96249 5.45312 1.97455 -175.59371 511.97769
1970.0000 -181.15423 -176.50214 4.65209 1.97984 -175.50289 531.67709
1975.0000 -180.81787 -176.06969 4.74818 1.92129 -176.50677 476.12689
1980.0000 -180.52822 -175.68937 4.83885 1.97646 -175.56091 521.22195
1985.0000 -180.95186 -176.35676 4.59510 1.94987 -176.01682 501.79002
1990.0000 -179.94145 -175.66131 4.28014 1.95937 -175.85397 507.09485
1995.0000 -179.25451 -175.00252 4.25199 1.99504 -175.24234 537.88230
2000.0000 -180.27514 -175.42968 4.84546 1.97866 -175.52318 528.75561
MELTING PROCESS: loop number 9 T-loop= 538.00000000000000
main_MD> interactions number 9 at Temperature= 538.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.54589 -1.19512 1.57358
force_rgl> df(natom) -1.18945 -2.00984 -2.11327
2005.0000 -180.31374 -175.37424 4.93950 1.99936 -175.16829 535.71213
2010.0000 -180.69374 -175.97492 4.71882 1.97717 -175.54876 529.14903
2015.0000 -181.16845 -175.75196 5.41649 1.94912 -176.02966 499.61985
2020.0000 -179.66326 -174.87771 4.78555 1.96716 -175.72030 508.19627
2025.0000 -179.67386 -174.51445 5.15941 2.01939 -174.82473 544.89275
2030.0000 -179.82502 -174.16781 5.65721 2.04963 -174.30623 566.79100
2035.0000 -179.40466 -173.56692 5.83774 2.05903 -174.14517 579.37188
2040.0000 -179.58177 -174.14836 5.43341 2.06261 -174.08374 578.69271
2045.0000 -179.72737 -175.12559 4.60178 2.05253 -174.25658 576.51830
2050.0000 -179.65535 -174.65126 5.00409 2.00495 -175.07240 540.27028
2055.0000 -179.20925 -174.41513 4.79412 2.05583 -174.20005 589.12710
2060.0000 -179.55203 -173.82751 5.72452 2.05503 -174.21376 584.60535
2065.0000 -178.69719 -173.77459 4.92260 2.08203 -173.75076 592.94116
2070.0000 -180.53509 -176.21533 4.31975 2.00574 -175.05887 536.14970
2075.0000 -180.22454 -175.92437 4.30018 1.94869 -176.03706 497.37392
2080.0000 -180.81307 -175.50174 5.31133 1.97559 -175.57576 519.30811
2085.0000 -179.89048 -175.78055 4.10993 1.98989 -175.33061 525.33367
2090.0000 -179.77535 -174.60313 5.17222 2.01415 -174.91470 527.65122
2095.0000 -180.28040 -174.99186 5.28854 2.01813 -174.84640 551.07375
2100.0000 -180.07166 -175.25463 4.81703 1.98336 -175.44262 524.61173
2105.0000 -180.92302 -175.50936 5.41366 2.00203 -175.12237 529.81943
2110.0000 -180.48220 -176.31146 4.17074 1.94341 -176.12753 493.33906
2115.0000 -180.77904 -176.00648 4.77256 1.93623 -176.25063 488.36242
2120.0000 -179.53345 -173.80934 5.72412 2.00661 -175.04389 541.24034
2125.0000 -180.37903 -174.78399 5.59504 2.06327 -174.07236 575.75113
2130.0000 -180.29223 -174.88671 5.40551 1.99996 -175.15802 523.32400
2135.0000 -179.40513 -174.54826 4.85687 2.04011 -174.46956 570.94323
2140.0000 -181.02585 -176.12288 4.90296 1.99985 -175.15975 543.27629
2145.0000 -178.95066 -174.50047 4.45019 2.00606 -175.05337 544.14604
2150.0000 -178.80614 -174.83042 3.97572 2.05284 -174.25118 558.79817
2155.0000 -179.12327 -174.12387 4.99940 2.04141 -174.44723 515.75145
2160.0000 -180.11295 -175.57024 4.54271 2.01691 -174.86738 545.98508
2165.0000 -180.00459 -174.14527 5.85932 2.00946 -174.99509 551.29487
2170.0000 -179.64320 -174.54633 5.09686 2.05001 -174.29981 579.22688
2175.0000 -179.84479 -175.37173 4.47306 2.01283 -174.93734 549.17114
2180.0000 -180.29978 -175.36268 4.93710 1.98174 -175.47040 505.25398
2185.0000 -180.49058 -175.00410 5.48649 2.00504 -175.07077 545.54041
2190.0000 -180.31146 -175.58961 4.72185 1.97012 -175.66952 516.50805
2195.0000 -180.95646 -175.14695 5.80951 1.96996 -175.67240 509.00541
2200.0000 -180.39814 -175.37826 5.01988 1.98653 -175.38830 525.36247
2205.0000 -181.20333 -175.44501 5.75832 1.97464 -175.59208 517.48612
2210.0000 -180.58570 -176.09542 4.49028 1.96569 -175.74558 519.25614
2215.0000 -181.06088 -176.88248 4.17840 1.91617 -176.59465 473.28208
2220.0000 -181.00026 -176.72578 4.27448 1.90422 -176.79957 465.08032
2225.0000 -180.31467 -175.99514 4.31953 1.95596 -175.91242 503.59932
2230.0000 -180.41817 -176.03695 4.38123 1.94898 -176.03205 503.58058
2235.0000 -180.05458 -174.59153 5.46305 1.96803 -175.70544 519.48653
2240.0000 -179.95628 -175.18545 4.77083 2.03715 -174.52031 571.47520
2245.0000 -180.86071 -175.56232 5.29839 1.97951 -175.50862 515.18383
2250.0000 -180.44436 -175.63609 4.80827 1.97995 -175.50099 519.50608
MELTING PROCESS: loop number 10 T-loop= 563.00000000000000
main_MD> interactions number 10 at Temperature= 563.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.01330 1.57523 1.86718
force_rgl> df(natom) -0.66839 -0.33350 0.60444
2255.0000 -180.29278 -175.62387 4.66892 1.95115 -175.99493 501.81723
2260.0000 -179.85835 -174.65431 5.20403 1.98474 -175.41898 525.87351
2265.0000 -180.09416 -175.09408 5.00008 2.03130 -174.62060 566.40436
2270.0000 -180.48151 -175.26459 5.21692 2.00126 -175.13572 536.50310
2275.0000 -179.89730 -174.43711 5.46019 2.00799 -175.02017 545.80817
2280.0000 -180.86205 -175.90740 4.95465 1.99617 -175.22287 537.40033
2285.0000 -180.57257 -176.74290 3.82968 1.92756 -176.39939 478.58777
2290.0000 -180.18064 -175.64329 4.53735 1.95750 -175.88594 506.49052
2295.0000 -181.02391 -176.21616 4.80774 1.96545 -175.74964 519.60215
2300.0000 -180.29871 -174.76775 5.53096 1.99552 -175.23400 534.06454
2305.0000 -179.15130 -173.28418 5.86712 2.03606 -174.53897 566.11298
2310.0000 -179.17281 -173.43756 5.73525 2.07862 -173.80926 604.63050
2315.0000 -179.36344 -174.98485 4.37859 2.07917 -173.79983 594.65682
2320.0000 -178.13252 -173.61188 4.52065 2.06635 -174.01954 533.51572
2325.0000 -178.04348 -173.33967 4.70381 2.11138 -173.24749 561.39282
2330.0000 -178.13668 -173.27020 4.86648 2.13025 -172.92388 563.45185
2335.0000 -179.31598 -174.57883 4.73715 2.12907 -172.94417 567.44468
2340.0000 -178.34905 -173.38567 4.96338 2.07287 -173.90782 523.37347
2345.0000 -178.66524 -173.71232 4.95292 2.07893 -173.80392 509.45802
2350.0000 -177.31731 -172.23371 5.08360 2.13548 -172.83433 559.79819
2355.0000 -177.03615 -171.43846 5.59769 2.18548 -171.97703 596.33380
2360.0000 -177.65356 -172.35973 5.29382 2.17690 -172.12411 591.91718
2365.0000 -176.65850 -171.50054 5.15796 2.16753 -172.28472 550.34217
2370.0000 -176.62162 -171.47031 5.15131 2.20400 -171.65942 563.24952
2375.0000 -176.21259 -170.92958 5.28301 2.25949 -170.70797 591.10737
2380.0000 -177.09311 -171.46179 5.63132 2.24108 -171.02368 597.65916
2385.0000 -176.90690 -172.35836 4.54854 2.19234 -171.85931 594.13696
2390.0000 -176.14124 -171.89717 4.24407 2.19328 -171.84323 585.36504
2395.0000 -177.32113 -172.55158 4.76955 2.18733 -171.94530 567.87997
2400.0000 -177.80507 -172.22631 5.57876 2.14740 -172.62989 565.40115
2405.0000 -177.14095 -172.13452 5.00643 2.15258 -172.54115 578.35823
2410.0000 -178.29583 -172.57401 5.72181 2.13741 -172.80110 529.60039
2415.0000 -176.96161 -172.20141 4.76020 2.18708 -171.94946 586.60014
2420.0000 -177.81093 -172.11947 5.69146 2.20490 -171.64404 582.38391
2425.0000 -178.02490 -172.92210 5.10280 2.15206 -172.55005 535.30405
2430.0000 -177.87660 -172.42839 5.44821 2.17101 -172.22498 553.80434
2435.0000 -177.89270 -172.81439 5.07831 2.11756 -173.14153 538.28458
2440.0000 -177.98248 -172.21000 5.77248 2.14141 -172.73263 554.83737
2445.0000 -177.35697 -172.39158 4.96538 2.17105 -172.22430 562.85835
2450.0000 -177.58816 -172.15000 5.43816 2.18010 -172.06925 585.32822
2455.0000 -178.09743 -172.64125 5.45618 2.14527 -172.66643 573.40216
2460.0000 -179.13617 -174.41825 4.71791 2.13129 -172.90619 578.39615
2465.0000 -179.25322 -173.37436 5.87886 2.08688 -173.66750 541.14863
2470.0000 -178.25161 -172.89401 5.35760 2.12268 -173.05375 559.06744
2475.0000 -177.96407 -172.70190 5.26217 2.11559 -173.17534 538.49847
2480.0000 -177.80505 -173.58427 4.22078 2.13843 -172.78361 551.37412
2485.0000 -178.01571 -173.35095 4.66476 2.09891 -173.46123 527.97724
2490.0000 -178.24997 -173.27461 4.97536 2.11504 -173.18466 530.56780
2495.0000 -177.41683 -172.94439 4.47244 2.12091 -173.08416 524.25401
2500.0000 -178.42753 -173.52392 4.90361 2.12703 -172.97919 541.57792
MELTING PROCESS: loop number 11 T-loop= 588.00000000000000
main_MD> interactions number 11 at Temperature= 588.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.08533 -2.57703 3.32640
force_rgl> df(natom) 3.13514 4.24628 -1.74051
2505.0000 -176.96972 -171.89111 5.07861 2.13833 -172.78537 532.83970
2510.0000 -177.54932 -172.37846 5.17086 2.20757 -171.59819 580.29194
2515.0000 -177.51630 -173.07723 4.43907 2.14756 -172.62710 555.84270
2520.0000 -177.11116 -171.61555 5.49560 2.15878 -172.43478 539.36004
2525.0000 -177.96619 -172.60071 5.36548 2.18074 -172.05815 570.64179
2530.0000 -175.38974 -170.26982 5.11992 2.20589 -171.62695 606.58703
2535.0000 -178.28994 -172.96813 5.32181 2.19574 -171.80111 589.06026
2540.0000 -177.77787 -172.74084 5.03703 2.15575 -172.48675 565.73850
2545.0000 -178.09262 -172.43314 5.65948 2.14920 -172.59902 546.53518
2550.0000 -176.77124 -171.34083 5.43041 2.19530 -171.80852 570.94549
2555.0000 -176.81152 -170.26713 6.54439 2.23586 -171.11315 615.34904
2560.0000 -176.36673 -169.96081 6.40592 2.31552 -169.74729 674.30611
2565.0000 -176.78637 -170.96903 5.81735 2.25988 -170.70134 641.94191
2570.0000 -178.02719 -172.26025 5.76694 2.21786 -171.42180 597.10037
2575.0000 -177.60387 -172.30885 5.29502 2.18221 -172.03300 574.75043
2580.0000 -177.62937 -171.73542 5.89395 2.22424 -171.31243 613.41073
2585.0000 -179.90707 -173.93008 5.97699 2.11307 -173.21843 552.16420
2590.0000 -179.22296 -174.41090 4.81206 2.04836 -174.32813 510.12740
2595.0000 -177.23717 -172.00932 5.22785 2.10356 -173.38163 541.63325
2600.0000 -176.53306 -171.55271 4.98035 2.22422 -171.31267 624.96268
2605.0000 -176.23669 -170.83974 5.39695 2.22588 -171.28425 564.69513
2610.0000 -176.49980 -170.75397 5.74583 2.23962 -171.04861 598.75941
2615.0000 -177.71959 -172.39394 5.32565 2.20281 -171.67983 599.41716
2620.0000 -177.12021 -171.81363 5.30658 2.17462 -172.16313 595.85002
2625.0000 -178.49217 -172.62524 5.86692 2.19043 -171.89202 621.48741
2630.0000 -177.77038 -171.89297 5.87742 2.16868 -172.26502 592.93218
2635.0000 -175.81847 -171.34283 4.47565 2.17517 -172.15374 558.24339
2640.0000 -177.39757 -171.18916 6.20841 2.22231 -171.34545 604.81880
2645.0000 -177.28528 -171.63497 5.65032 2.20570 -171.63027 585.01212
2650.0000 -176.80562 -171.55266 5.25296 2.21556 -171.46115 601.22300
2655.0000 -176.85257 -171.73669 5.11588 2.17387 -172.17604 571.63427
2660.0000 -177.69406 -172.48850 5.20557 2.17392 -172.17509 548.86079
2665.0000 -177.29882 -172.34706 4.95176 2.17348 -172.18269 541.95203
2670.0000 -177.11753 -171.83500 5.28253 2.18407 -172.00106 566.94492
2675.0000 -176.46215 -171.40563 5.05651 2.22826 -171.24339 584.64060
2680.0000 -177.21084 -172.20527 5.00556 2.20264 -171.68279 573.89571
2685.0000 -177.07527 -172.50656 4.56870 2.16716 -172.29110 542.65043
2690.0000 -176.99172 -172.21808 4.77364 2.15611 -172.48054 534.79684
2695.0000 -177.80258 -171.53974 6.26284 2.18646 -171.96014 597.20548
2700.0000 -177.05607 -170.85047 6.20559 2.22425 -171.31213 607.32225
2705.0000 -175.63182 -170.14169 5.49014 2.23145 -171.18868 610.46362
2710.0000 -175.80977 -169.61707 6.19271 2.33496 -169.41397 692.00324
2715.0000 -176.31526 -169.91147 6.40379 2.33422 -169.42659 680.84787
2720.0000 -176.64240 -170.85412 5.78827 2.29184 -170.15318 624.08702
2725.0000 -176.12503 -170.89952 5.22551 2.25326 -170.81480 607.85090
2730.0000 -176.70632 -170.67408 6.03224 2.25520 -170.78147 619.27385
2735.0000 -176.57455 -170.41860 6.15594 2.27446 -170.45129 647.29443
2740.0000 -177.31762 -172.27685 5.04077 2.22050 -171.37645 595.82999
2745.0000 -177.64321 -172.25193 5.39128 2.16149 -172.38827 559.60542
2750.0000 -176.98130 -171.60233 5.37897 2.18424 -171.99827 577.98837
MELTING PROCESS: loop number 12 T-loop= 613.00000000000000
main_MD> interactions number 12 at Temperature= 613.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.61919 -1.69352 -3.44266
force_rgl> df(natom) 0.59236 0.31184 -0.89538
2755.0000 -176.94725 -171.82473 5.12252 2.21934 -171.39635 608.12277
2760.0000 -177.23531 -171.90280 5.33251 2.16709 -172.29225 574.89279
2765.0000 -177.75989 -172.58435 5.17554 2.15822 -172.44442 566.01312
2770.0000 -175.76694 -170.37736 5.38958 2.19234 -171.85937 564.00339
2775.0000 -174.76348 -167.83078 6.93270 2.32250 -169.62755 677.78210
2780.0000 -176.35094 -170.16998 6.18097 2.39042 -168.46301 720.38941
2785.0000 -176.89142 -170.69009 6.20133 2.28800 -170.21903 639.72568
2790.0000 -176.07076 -169.26579 6.80497 2.31224 -169.80350 671.35679
2795.0000 -175.27090 -168.88815 6.38275 2.34466 -169.24757 686.08986
2800.0000 -177.19295 -171.77827 5.41468 2.24019 -171.03884 632.52230
2805.0000 -177.98227 -171.95453 6.02774 2.20480 -171.64563 642.14679
2810.0000 -176.32177 -169.80226 6.51951 2.22401 -171.31621 607.02071
2815.0000 -176.21934 -170.12435 6.09499 2.31060 -169.83151 628.27064
2820.0000 -175.59206 -169.27054 6.32152 2.35716 -169.03322 672.26525
2825.0000 -176.41433 -170.20431 6.21002 2.32591 -169.56916 676.08389
2830.0000 -177.08790 -172.29536 4.79254 2.23147 -171.18839 622.68107
2835.0000 -177.91564 -172.37100 5.54463 2.18702 -171.95052 570.96574
2840.0000 -176.60706 -170.91209 5.69497 2.19616 -171.79375 560.02414
2845.0000 -177.08830 -170.98443 6.10387 2.24142 -171.01783 591.80450
2850.0000 -176.93442 -171.74727 5.18715 2.25629 -170.76284 620.94470
2855.0000 -176.40258 -170.18307 6.21951 2.23744 -171.08610 609.65670
2860.0000 -177.18963 -172.20678 4.98286 2.23169 -171.18453 580.73742
2865.0000 -176.38196 -171.13230 5.24967 2.20712 -171.60597 571.26423
2870.0000 -176.64749 -171.11251 5.53498 2.21897 -171.40269 580.14171
2875.0000 -177.24309 -171.61682 5.62628 2.20212 -171.69158 595.56828
2880.0000 -177.40439 -172.31241 5.09198 2.17406 -172.17272 581.87439
2885.0000 -176.78058 -171.00856 5.77202 2.18176 -172.04073 584.51824
2890.0000 -177.01942 -172.14633 4.87309 2.21482 -171.47393 575.89838
2895.0000 -175.87167 -170.22250 5.64917 2.26190 -170.66657 625.48615
2900.0000 -176.36956 -170.56162 5.80794 2.29280 -170.13685 630.85613
2905.0000 -176.19433 -170.46852 5.72581 2.27162 -170.50002 649.85898
2910.0000 -176.38335 -171.07216 5.31119 2.26546 -170.60552 616.25341
2915.0000 -176.66213 -171.15050 5.51164 2.22353 -171.32452 594.34767
2920.0000 -176.24416 -171.77305 4.47111 2.19717 -171.77652 577.95527
2925.0000 -175.06658 -169.36000 5.70658 2.26760 -170.56882 618.43984
2930.0000 -176.53189 -169.96219 6.56970 2.30539 -169.92093 651.03320
2935.0000 -177.23657 -171.50694 5.72962 2.24544 -170.94879 612.46257
2940.0000 -175.25032 -169.64522 5.60510 2.24110 -171.02327 612.75572
2945.0000 -175.75158 -169.42873 6.32285 2.36939 -168.82353 685.88044
2950.0000 -174.58931 -169.64680 4.94251 2.33110 -169.48008 674.72891
2955.0000 -176.94959 -170.66456 6.28503 2.27618 -170.42171 641.03733
2960.0000 -176.47246 -170.66503 5.80742 2.28722 -170.23251 662.88196
2965.0000 -176.35234 -170.86377 5.48858 2.25277 -170.82324 620.96034
2970.0000 -176.01471 -170.40391 5.61080 2.24812 -170.90288 596.47890
2975.0000 -176.29336 -171.17587 5.11749 2.30708 -169.89194 650.26802
2980.0000 -176.47383 -170.60289 5.87094 2.24283 -170.99358 603.53063
2985.0000 -176.09954 -171.24440 4.85513 2.26551 -170.60477 629.29568
2990.0000 -175.29482 -169.44110 5.85371 2.26702 -170.57890 624.24237
2995.0000 -176.65099 -170.90823 5.74276 2.27288 -170.47827 629.03036
3000.0000 -176.79911 -170.59057 6.20854 2.27218 -170.49033 617.45646
MELTING PROCESS: loop number 13 T-loop= 638.00000000000000
main_MD> interactions number 13 at Temperature= 638.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.28030 1.71832 -3.44001
force_rgl> df(natom) -0.48874 1.01209 0.44046
3005.0000 -175.87645 -169.71601 6.16044 2.28879 -170.20552 659.57760
3010.0000 -176.20482 -170.57147 5.63336 2.28599 -170.25364 633.59283
3015.0000 -175.42154 -170.65015 4.77139 2.25952 -170.70749 618.73039
3020.0000 -175.66446 -170.59070 5.07376 2.25735 -170.74471 621.37749
3025.0000 -175.92413 -169.98056 5.94357 2.30518 -169.92459 627.80221
3030.0000 -176.51705 -170.64558 5.87148 2.29012 -170.18281 628.35223
3035.0000 -176.58893 -170.66518 5.92375 2.28635 -170.24745 633.60086
3040.0000 -175.82386 -170.39407 5.42979 2.30211 -169.97717 668.23137
3045.0000 -175.53161 -169.88271 5.64890 2.30079 -169.99984 690.78264
3050.0000 -176.42856 -170.74162 5.68693 2.28712 -170.23415 660.29028
3055.0000 -176.54438 -170.66688 5.87750 2.26021 -170.69557 626.07881
3060.0000 -176.79239 -170.47862 6.31376 2.22483 -171.30220 613.90568
3065.0000 -177.21516 -170.66877 6.54639 2.25386 -170.80453 655.75253
3070.0000 -175.48273 -170.96567 4.51706 2.27834 -170.38481 633.57570
3075.0000 -177.20512 -172.37420 4.83092 2.20083 -171.71376 576.73872
3080.0000 -177.67216 -172.24254 5.42961 2.16239 -172.37283 560.05221
3085.0000 -176.81253 -170.87585 5.93668 2.18916 -171.91383 589.90990
3090.0000 -176.10998 -170.97211 5.13788 2.26166 -170.67069 633.08805
3095.0000 -176.96264 -171.19992 5.76272 2.25198 -170.83673 634.45674
3100.0000 -176.96470 -171.41142 5.55328 2.27483 -170.44500 631.56767
3105.0000 -177.15804 -170.86482 6.29321 2.19870 -171.75031 573.64179
3110.0000 -176.46944 -171.24725 5.22219 2.22310 -171.33192 595.00460
3115.0000 -177.25405 -171.19282 6.06122 2.24616 -170.93657 626.39096
3120.0000 -176.20103 -170.64443 5.55660 2.25683 -170.75347 617.93139
3125.0000 -175.79103 -169.40401 6.38702 2.27661 -170.41437 612.26208
3130.0000 -176.22311 -169.84058 6.38253 2.35738 -169.02955 679.83234
3135.0000 -175.38768 -169.02573 6.36196 2.32906 -169.51502 668.63260
3140.0000 -176.47787 -170.49348 5.98439 2.31627 -169.73436 660.80063
3145.0000 -176.35736 -171.02765 5.32971 2.29253 -170.14138 634.14024
3150.0000 -177.80882 -171.65405 6.15477 2.21286 -171.50741 591.99232
3155.0000 -177.08710 -171.00716 6.07993 2.20719 -171.60476 618.13437
3160.0000 -176.48727 -171.12948 5.35778 2.25001 -170.87047 639.57971
3165.0000 -177.68396 -171.86302 5.82094 2.21369 -171.49317 623.30326
3170.0000 -175.96288 -170.48063 5.48225 2.22860 -171.23759 611.91235
3175.0000 -175.65549 -169.55208 6.10340 2.32748 -169.54220 654.12988
3180.0000 -175.46721 -169.58573 5.88148 2.34705 -169.20665 690.44123
3185.0000 -175.39668 -167.96899 7.42768 2.34717 -169.20463 658.01797
3190.0000 -175.95879 -169.72552 6.23327 2.37376 -168.74860 683.34608
3195.0000 -176.03462 -170.07308 5.96153 2.31924 -169.68348 678.55877
3200.0000 -175.75505 -170.02497 5.73008 2.25287 -170.82137 627.40873
3205.0000 -175.60760 -169.66833 5.93928 2.30655 -169.90111 678.33992
3210.0000 -175.04580 -169.42238 5.62342 2.34792 -169.19171 689.09453
3215.0000 -176.73564 -170.60872 6.12691 2.33014 -169.49652 677.08809
3220.0000 -176.24654 -171.07020 5.17633 2.27547 -170.43400 635.43404
3225.0000 -176.47600 -170.51471 5.96129 2.23815 -171.07392 599.31851
3230.0000 -176.64906 -172.63018 4.01888 2.21105 -171.53855 631.69936
3235.0000 -177.32820 -171.85644 5.47175 2.17974 -172.07533 596.34260
3240.0000 -176.54191 -171.22284 5.31907 2.22936 -171.22451 606.59043
3245.0000 -177.85504 -172.27566 5.57938 2.19041 -171.89242 559.31229
3250.0000 -176.71169 -170.54158 6.17011 2.27313 -170.47413 653.86171
MELTING PROCESS: loop number 14 T-loop= 663.00000000000000
main_MD> interactions number 14 at Temperature= 663.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.16837 -2.06919 -3.48126
force_rgl> df(natom) 1.20649 2.05766 -4.66332
3255.0000 -174.66599 -169.23773 5.42826 2.29820 -170.04417 677.15004
3260.0000 -174.96278 -169.42458 5.53820 2.37220 -168.77538 700.33288
3265.0000 -175.48266 -170.16422 5.31844 2.30905 -169.85825 644.42224
3270.0000 -176.06772 -170.76610 5.30162 2.24805 -170.90417 592.06461
3275.0000 -176.78418 -170.86114 5.92304 2.28258 -170.31203 659.80094
3280.0000 -174.81873 -169.01851 5.80022 2.28445 -170.27995 648.31440
3285.0000 -176.16175 -168.84256 7.31918 2.36164 -168.95640 703.84061
3290.0000 -176.04613 -169.71484 6.33129 2.34072 -169.31514 685.74103
3295.0000 -175.31494 -169.52714 5.78780 2.29947 -170.02239 654.70083
3300.0000 -174.24227 -168.05626 6.18601 2.35538 -169.06372 688.79386
3305.0000 -176.79004 -169.93732 6.85272 2.36785 -168.85000 685.03234
3310.0000 -175.35311 -169.55701 5.79609 2.29167 -170.15625 629.46597
3315.0000 -174.71795 -168.25782 6.46013 2.36210 -168.94863 674.02414
3320.0000 -175.60659 -169.82418 5.78241 2.38057 -168.63184 710.69590
3325.0000 -174.29814 -168.39579 5.90235 2.35480 -169.07377 676.40659
3330.0000 -175.60494 -169.66300 5.94194 2.34241 -169.28613 667.82512
3335.0000 -174.87289 -168.44627 6.42663 2.32756 -169.54074 654.78516
3340.0000 -176.45448 -169.34275 7.11173 2.33580 -169.39956 666.58946
3345.0000 -175.94211 -170.41794 5.52417 2.30713 -169.89116 639.92413
3350.0000 -175.51578 -169.37100 6.14477 2.31026 -169.83750 670.62067
3355.0000 -176.20119 -169.71067 6.49052 2.37212 -168.77680 693.12444
3360.0000 -174.82546 -168.40557 6.41990 2.34074 -169.31485 668.59120
3365.0000 -176.43354 -170.74235 5.69119 2.32524 -169.58050 663.03051
3370.0000 -176.07406 -169.80639 6.26767 2.26760 -170.56892 634.15234
3375.0000 -174.88616 -168.87216 6.01400 2.32503 -169.58425 676.42775
3380.0000 -174.91616 -168.82933 6.08683 2.33678 -169.38270 653.45533
3385.0000 -175.88920 -169.74388 6.14532 2.35326 -169.10020 672.44376
3390.0000 -175.93572 -170.61538 5.32034 2.27024 -170.52359 621.31831
3395.0000 -174.83260 -168.69131 6.14129 2.35669 -169.04135 695.09530
3400.0000 -174.88543 -167.48207 7.40336 2.38697 -168.52213 714.74279
3405.0000 -175.21931 -169.27671 5.94260 2.39293 -168.41986 732.81285
3410.0000 -175.47703 -169.72544 5.75159 2.28696 -170.23700 649.94066
3415.0000 -175.02088 -169.14221 5.87867 2.37209 -168.77733 695.98190
3420.0000 -175.54985 -169.26335 6.28650 2.33456 -169.42080 638.94111
3425.0000 -176.83389 -170.57027 6.26362 2.34425 -169.25468 677.37115
3430.0000 -176.21170 -170.44926 5.76244 2.28197 -170.32244 621.48752
3435.0000 -175.94888 -169.97538 5.97350 2.30581 -169.91366 654.73024
3440.0000 -175.02091 -169.48170 5.53922 2.30501 -169.92751 625.83291
3445.0000 -176.59855 -171.24470 5.35386 2.28476 -170.27459 636.23039
3450.0000 -176.55827 -171.01731 5.54096 2.26983 -170.53065 601.85542
3455.0000 -177.07693 -170.88410 6.19283 2.23924 -171.05516 601.31416
3460.0000 -176.02059 -169.54774 6.47286 2.29663 -170.07106 656.45061
3465.0000 -174.28548 -167.66617 6.61931 2.36391 -168.91747 691.06192
3470.0000 -174.98210 -169.48137 5.50073 2.37511 -168.72542 687.06908
3475.0000 -175.91382 -170.09957 5.81425 2.30555 -169.91811 671.62081
3480.0000 -174.30987 -167.80011 6.50976 2.38672 -168.52637 712.14158
3485.0000 -174.79220 -168.82908 5.96312 2.42517 -167.86715 721.57999
3490.0000 -175.73722 -168.77954 6.95769 2.34449 -169.25049 678.25148
3495.0000 -175.49707 -169.51830 5.97877 2.35178 -169.12553 702.69546
3500.0000 -174.75586 -168.63574 6.12012 2.34181 -169.29653 685.99752
MELTING PROCESS: loop number 15 T-loop= 688.00000000000000
main_MD> interactions number 15 at Temperature= 688.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.98251 2.38987 -0.37540
force_rgl> df(natom) 0.91730 4.65480 2.59385
3505.0000 -175.46754 -169.52996 5.93758 2.33088 -169.48379 665.94405
3510.0000 -175.17623 -169.25731 5.91893 2.31866 -169.69345 640.25562
3515.0000 -174.90698 -167.66352 7.24346 2.35998 -168.98494 700.51159
3520.0000 -174.02076 -167.82736 6.19340 2.40600 -168.19583 724.71312
3525.0000 -174.42129 -168.20391 6.21739 2.39166 -168.44163 706.82630
3530.0000 -174.09792 -168.78132 5.31661 2.39021 -168.46651 681.31486
3535.0000 -176.23527 -169.60067 6.63460 2.35107 -169.13767 663.04297
3540.0000 -175.73961 -169.46664 6.27297 2.30085 -169.99870 649.62899
3545.0000 -176.45755 -170.73866 5.71890 2.27487 -170.44430 636.08735
3550.0000 -176.02874 -169.45811 6.57063 2.32370 -169.60698 666.44209
3555.0000 -175.73732 -169.20054 6.53678 2.39592 -168.36870 745.06128
3560.0000 -175.72264 -170.06159 5.66105 2.30582 -169.91350 672.60915
3565.0000 -175.30810 -170.04540 5.26270 2.32214 -169.63377 675.52158
3570.0000 -175.61931 -168.69025 6.92906 2.32545 -169.57690 659.79528
3575.0000 -175.90258 -169.62247 6.28011 2.33984 -169.33019 667.59691
3580.0000 -175.45389 -168.14424 7.30964 2.38087 -168.62665 700.65314
3585.0000 -175.36710 -169.59270 5.77441 2.36797 -168.84783 682.00883
3590.0000 -173.71921 -167.96675 5.75246 2.38654 -168.52949 682.82427
3595.0000 -175.64344 -168.80816 6.83528 2.38754 -168.51240 702.22672
3600.0000 -174.23071 -167.76653 6.46418 2.40541 -168.20591 704.42415
3605.0000 -175.24196 -168.63701 6.60495 2.39285 -168.42137 730.26606
3610.0000 -175.54921 -168.75292 6.79628 2.38519 -168.55267 710.98460
3615.0000 -175.26246 -168.70998 6.55249 2.37673 -168.69766 707.96982
3620.0000 -174.81685 -168.29586 6.52099 2.35702 -169.03565 676.38169
3625.0000 -176.04342 -169.84127 6.20214 2.39504 -168.38371 712.58628
3630.0000 -176.38764 -169.86918 6.51846 2.31264 -169.79658 652.33849
3635.0000 -174.80103 -168.09308 6.70795 2.35202 -169.12146 702.24800
3640.0000 -175.08588 -168.93959 6.14629 2.36264 -168.93935 713.80915
3645.0000 -177.47113 -171.75530 5.71584 2.30625 -169.90617 648.56781
3650.0000 -176.68432 -171.41335 5.27098 2.24562 -170.94578 601.45597
3655.0000 -175.74667 -169.93797 5.80870 2.28080 -170.34250 621.43517
3660.0000 -174.97754 -168.12692 6.85061 2.29695 -170.06562 644.42174
3665.0000 -175.22501 -168.21870 7.00631 2.38564 -168.54485 691.63414
3670.0000 -176.31760 -170.19365 6.12395 2.32729 -169.54537 668.66671
3675.0000 -176.51018 -170.87426 5.63592 2.24402 -170.97315 626.02613
3680.0000 -175.85129 -169.63736 6.21394 2.28000 -170.35631 638.90520
3685.0000 -175.21232 -169.18824 6.02407 2.30761 -169.88288 682.48187
3690.0000 -174.35903 -168.75173 5.60730 2.36908 -168.82895 691.96743
3695.0000 -175.64816 -169.28242 6.36574 2.34952 -169.16425 676.18708
3700.0000 -174.51696 -168.34494 6.17202 2.38256 -168.59766 723.23212
3705.0000 -175.02409 -167.59675 7.42733 2.41772 -167.99488 727.71562
3710.0000 -174.61318 -168.80219 5.81099 2.39626 -168.36287 695.34820
3715.0000 -174.00505 -167.64423 6.36082 2.39905 -168.31501 695.99236
3720.0000 -175.38397 -168.71966 6.66431 2.40579 -168.19939 723.15070
3725.0000 -175.35775 -169.25631 6.10144 2.37616 -168.70742 697.67172
3730.0000 -174.46373 -167.48412 6.97961 2.42101 -167.93844 727.95295
3735.0000 -175.18667 -167.52836 7.65830 2.43678 -167.66799 750.59718
3740.0000 -176.90266 -170.17973 6.72293 2.36172 -168.95514 694.64306
3745.0000 -176.04590 -169.53906 6.50684 2.32581 -169.57087 656.95849
3750.0000 -175.28020 -168.60681 6.67340 2.36167 -168.95595 685.81374
MELTING PROCESS: loop number 16 T-loop= 713.00000000000000
main_MD> interactions number 16 at Temperature= 713.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.56327 -6.58817 0.43417
force_rgl> df(natom) 0.06203 -2.86588 2.67071
3755.0000 -174.94878 -168.41321 6.53557 2.38489 -168.55770 673.40929
3760.0000 -175.20243 -168.34963 6.85280 2.37771 -168.68091 696.63651
3765.0000 -174.51121 -167.76302 6.74819 2.42528 -167.86525 742.56300
3770.0000 -175.74145 -167.96622 7.77523 2.38773 -168.50908 724.23806
3775.0000 -174.64363 -167.46145 7.18218 2.39493 -168.38570 722.45623
3780.0000 -173.65730 -166.43054 7.22676 2.44427 -167.53963 734.37714
3785.0000 -173.05532 -166.25437 6.80095 2.50512 -166.49634 772.04278
3790.0000 -174.08049 -168.01231 6.06818 2.44121 -167.59203 745.64465
3795.0000 -173.91825 -167.00411 6.91415 2.41206 -168.09188 709.18085
3800.0000 -175.12211 -168.50944 6.61267 2.45067 -167.42988 733.34964
3805.0000 -175.33195 -168.79868 6.53327 2.41065 -168.11605 727.17179
3810.0000 -175.04529 -168.46802 6.57727 2.35222 -169.11802 707.98071
3815.0000 -175.50703 -168.22453 7.28250 2.40861 -168.15112 723.91443
3820.0000 -175.30673 -169.50168 5.80505 2.37517 -168.72449 689.54043
3825.0000 -173.71771 -169.01505 4.70266 2.39722 -168.34645 708.46491
3830.0000 -175.59722 -168.87390 6.72332 2.32438 -169.59535 653.13750
3835.0000 -176.68179 -170.96024 5.72155 2.30872 -169.86385 651.91039
3840.0000 -176.41272 -169.89559 6.51713 2.28311 -170.30291 651.12269
3845.0000 -175.71458 -169.90418 5.81040 2.27555 -170.43262 641.17606
3850.0000 -175.40068 -169.86142 5.53927 2.32696 -169.55111 671.22565
3855.0000 -174.88200 -167.90753 6.97447 2.39992 -168.30015 719.59901
3860.0000 -174.19519 -168.15592 6.03927 2.42433 -167.88154 733.95367
3865.0000 -175.15746 -168.85659 6.30087 2.38714 -168.51920 756.98204
3870.0000 -175.25850 -169.54253 5.71597 2.36297 -168.93362 692.31041
3875.0000 -174.92099 -168.95146 5.96954 2.34006 -169.32647 681.10842
3880.0000 -176.72905 -169.30413 7.42492 2.35046 -169.14813 693.33553
3885.0000 -175.07844 -169.12689 5.95156 2.37093 -168.79714 688.37496
3890.0000 -175.89303 -169.38638 6.50665 2.36801 -168.84720 673.35067
3895.0000 -174.74579 -168.67030 6.07550 2.37617 -168.70731 696.17047
3900.0000 -175.59206 -170.39805 5.19401 2.33065 -169.48779 677.07558
3905.0000 -176.55305 -170.21876 6.33430 2.31878 -169.69133 648.99173
3910.0000 -175.11602 -170.54529 4.57073 2.28206 -170.32101 648.52086
3915.0000 -175.86643 -169.89439 5.97204 2.26213 -170.66269 613.27478
3920.0000 -176.68460 -170.87303 5.81157 2.26207 -170.66362 645.71617
3925.0000 -175.76611 -169.60123 6.16488 2.31080 -169.82821 669.43117
3930.0000 -176.25975 -170.34742 5.91233 2.31544 -169.74854 651.85382
3935.0000 -174.59640 -168.62619 5.97021 2.33199 -169.46476 674.35853
3940.0000 -174.03611 -167.08802 6.94809 2.44723 -167.48885 760.78901
3945.0000 -173.19118 -167.04632 6.14486 2.46398 -167.20170 758.23375
3950.0000 -174.85679 -168.53443 6.32236 2.42651 -167.84410 725.21621
3955.0000 -176.18667 -169.24516 6.94151 2.35146 -169.13106 680.55555
3960.0000 -173.91879 -167.58647 6.33232 2.39124 -168.44888 713.48392
3965.0000 -175.12923 -168.70588 6.42335 2.46320 -167.21505 764.12176
3970.0000 -174.66250 -168.64564 6.01686 2.39630 -168.36222 708.03453
3975.0000 -174.33937 -168.07674 6.26263 2.42026 -167.95140 716.53314
3980.0000 -175.20044 -168.16603 7.03441 2.41299 -168.07591 715.61470
3985.0000 -174.00698 -167.43160 6.57537 2.41626 -168.01983 722.55781
3990.0000 -173.91067 -168.54962 5.36105 2.39722 -168.34629 689.26605
3995.0000 -174.55373 -169.04277 5.51096 2.35727 -169.03130 703.40342
4000.0000 -174.36543 -168.43779 5.92764 2.36529 -168.89389 676.84445
MELTING PROCESS: loop number 17 T-loop= 738.00000000000000
main_MD> interactions number 17 at Temperature= 738.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.00054 -5.50830 0.82147
force_rgl> df(natom) -0.03163 -0.61414 1.94999
4005.0000 -175.97349 -169.05059 6.92290 2.35556 -169.06066 664.08694
4010.0000 -176.34355 -170.49388 5.84967 2.33055 -169.48946 664.00790
4015.0000 -175.18846 -168.63017 6.55829 2.33812 -169.35969 668.00451
4020.0000 -174.39990 -167.41374 6.98616 2.40315 -168.24467 717.35081
4025.0000 -173.92851 -167.90091 6.02760 2.43010 -167.78266 746.52869
4030.0000 -175.03692 -168.75904 6.27788 2.36704 -168.86382 665.44615
4035.0000 -174.63990 -167.68257 6.95732 2.38247 -168.59933 711.26900
4040.0000 -174.05117 -167.55621 6.49496 2.44248 -167.57025 734.80537
4045.0000 -174.34032 -166.96677 7.37355 2.50458 -166.50554 770.47691
4050.0000 -174.10013 -167.87282 6.22731 2.45142 -167.41702 748.30059
4055.0000 -175.81213 -168.89112 6.92100 2.42525 -167.86569 746.03317
4060.0000 -174.19006 -166.64403 7.54604 2.43379 -167.71940 736.75613
4065.0000 -173.92074 -167.00738 6.91335 2.50824 -166.44275 785.95827
4070.0000 -174.09226 -167.44434 6.64792 2.47899 -166.94431 783.55309
4075.0000 -175.09956 -168.32990 6.76965 2.44861 -167.46519 749.98523
4080.0000 -174.99998 -168.09769 6.90229 2.39247 -168.42779 718.72592
4085.0000 -175.20490 -168.54346 6.66145 2.40039 -168.29195 710.52789
4090.0000 -172.74326 -166.51738 6.22587 2.46085 -167.25540 775.87477
4095.0000 -173.56697 -166.32806 7.23892 2.48424 -166.85427 775.16617
4100.0000 -172.72921 -165.33130 7.39790 2.54049 -165.88984 820.08347
4105.0000 -173.91661 -167.77016 6.14644 2.51865 -166.26435 790.29932
4110.0000 -172.75076 -166.03464 6.71612 2.47722 -166.97469 765.28843
4115.0000 -173.14496 -165.88531 7.25965 2.51701 -166.29248 808.67215
4120.0000 -174.23974 -166.48638 7.75336 2.50701 -166.46393 780.92964
4125.0000 -173.14148 -165.55822 7.58326 2.53364 -166.00724 808.20160
4130.0000 -174.01585 -166.33171 7.68414 2.52812 -166.10183 801.24909
4135.0000 -175.87736 -169.41908 6.45828 2.44559 -167.51706 742.47680
4140.0000 -175.49731 -167.91820 7.57910 2.37868 -168.66429 697.09277
4145.0000 -175.38941 -167.72388 7.66554 2.41939 -167.96622 745.06352
4150.0000 -175.46545 -168.84492 6.62053 2.39844 -168.32552 721.99829
4155.0000 -174.82287 -168.65943 6.16345 2.37980 -168.64512 705.05406
4160.0000 -174.86182 -167.53484 7.32698 2.43628 -167.67661 737.29460
4165.0000 -173.53919 -166.63656 6.90263 2.47692 -166.97981 771.92731
4170.0000 -172.83565 -165.94306 6.89259 2.50510 -166.49670 775.75647
4175.0000 -172.54694 -165.75393 6.79301 2.53553 -165.97478 787.57697
4180.0000 -173.64425 -165.66841 7.97584 2.55234 -165.68666 795.29852
4185.0000 -173.22817 -166.66474 6.56343 2.53679 -165.95328 817.07494
4190.0000 -173.51660 -166.75459 6.76201 2.49057 -166.74572 768.67068
4195.0000 -174.41969 -168.35596 6.06373 2.42552 -167.86121 738.44136
4200.0000 -174.26427 -167.48801 6.77626 2.44001 -167.61274 728.52848
4205.0000 -175.11794 -167.79666 7.32128 2.42454 -167.87786 737.93349
4210.0000 -174.98092 -168.72149 6.25943 2.42658 -167.84289 742.35082
4215.0000 -173.96285 -167.66814 6.29471 2.46543 -167.17689 770.92518
4220.0000 -174.65316 -167.06884 7.58432 2.41483 -168.04439 750.39629
4225.0000 -173.46910 -166.86063 6.60847 2.46176 -167.23974 766.37711
4230.0000 -174.24012 -167.34343 6.89670 2.45778 -167.30802 720.61582
4235.0000 -174.37902 -167.60628 6.77274 2.43020 -167.78090 734.03339
4240.0000 -175.63231 -168.79757 6.83474 2.38885 -168.48997 695.26453
4245.0000 -174.04896 -166.23361 7.81535 2.45364 -167.37891 765.55649
4250.0000 -174.30680 -167.09956 7.20724 2.48559 -166.83107 759.32377
MELTING PROCESS: loop number 18 T-loop= 763.00000000000000
main_MD> interactions number 18 at Temperature= 763.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -3.35955 1.15710 -0.15469
force_rgl> df(natom) 1.88286 -2.36347 -2.55393
4255.0000 -173.37218 -165.37419 7.99798 2.48795 -166.79072 765.85560
4260.0000 -172.62155 -165.08400 7.53754 2.53135 -166.04648 815.90430
4265.0000 -174.65214 -165.91674 8.73540 2.52589 -166.14017 808.68798
4270.0000 -174.30393 -167.09435 7.20957 2.51103 -166.39486 786.41453
4275.0000 -172.12122 -165.58594 6.53528 2.52144 -166.21646 823.97939
4280.0000 -175.10384 -168.46362 6.64022 2.47434 -167.02397 763.33074
4285.0000 -174.02862 -167.18801 6.84061 2.43822 -167.64335 735.92610
4290.0000 -175.28153 -168.68144 6.60010 2.44304 -167.56067 730.98637
4295.0000 -174.49423 -168.52535 5.96888 2.34712 -169.20539 677.04504
4300.0000 -174.56833 -167.95113 6.61719 2.41770 -167.99528 713.72351
4305.0000 -173.22480 -166.45958 6.76522 2.49161 -166.72789 753.07907
4310.0000 -174.87902 -167.55698 7.32204 2.44166 -167.58431 732.68757
4315.0000 -174.71835 -166.67304 8.04531 2.42678 -167.83945 739.11053
4320.0000 -175.24692 -169.26301 5.98391 2.42913 -167.79926 746.71443
4325.0000 -174.58682 -168.28711 6.29971 2.39827 -168.32829 710.78188
4330.0000 -174.37851 -166.63952 7.73900 2.39001 -168.46994 711.48202
4335.0000 -172.92111 -166.80045 6.12066 2.47675 -166.98274 767.79540
4340.0000 -175.28225 -168.54392 6.73833 2.47727 -166.97373 735.39241
4345.0000 -174.30476 -167.53707 6.76769 2.43898 -167.63038 742.10698
4350.0000 -174.03610 -167.55461 6.48148 2.44082 -167.59878 722.80612
4355.0000 -174.85577 -169.37535 5.48042 2.38133 -168.61886 703.00776
4360.0000 -174.63886 -168.09288 6.54597 2.38682 -168.52473 695.86929
4365.0000 -174.69677 -168.13604 6.56073 2.41724 -168.00305 740.70045
4370.0000 -174.16331 -167.62940 6.53391 2.42664 -167.84195 708.78936
4375.0000 -174.08209 -166.77637 7.30572 2.46313 -167.21620 761.04448
4380.0000 -173.33070 -165.26693 8.06378 2.48837 -166.78347 790.79166
4385.0000 -174.89079 -169.13198 5.75881 2.47101 -167.08107 776.43981
4390.0000 -174.47401 -167.02386 7.45015 2.46219 -167.23230 756.72393
4395.0000 -173.85106 -167.07927 6.77178 2.45041 -167.43439 744.15767
4400.0000 -175.60537 -168.84747 6.75790 2.43950 -167.62139 763.14442
4405.0000 -173.81990 -167.81628 6.00362 2.36776 -168.85158 674.86755
4410.0000 -173.42329 -167.95818 5.46511 2.47299 -167.04723 757.89830
4415.0000 -175.02337 -168.48180 6.54158 2.44600 -167.50990 738.38527
4420.0000 -174.15263 -168.58630 5.56632 2.34289 -169.27785 679.87740
4425.0000 -174.82259 -168.06994 6.75265 2.40794 -168.16250 733.59175
4430.0000 -173.55029 -166.37827 7.17202 2.44964 -167.44757 729.86675
4435.0000 -173.26751 -167.26476 6.00275 2.47191 -167.06569 777.92399
4440.0000 -174.59635 -168.34755 6.24880 2.42661 -167.84250 751.61025
4445.0000 -174.08195 -168.16123 5.92072 2.41316 -168.07301 716.25705
4450.0000 -171.94059 -164.99351 6.94708 2.52230 -166.20170 801.09763
4455.0000 -173.85684 -167.62840 6.22844 2.52989 -166.07156 770.42955
4460.0000 -174.12286 -168.46407 5.65879 2.42355 -167.89497 731.08688
4465.0000 -174.85057 -167.50320 7.34737 2.40013 -168.29646 714.96299
4470.0000 -174.26552 -167.30710 6.95841 2.50851 -166.43809 785.53259
4475.0000 -174.13876 -166.64009 7.49867 2.46036 -167.26381 735.24668
4480.0000 -172.27832 -165.16568 7.11264 2.54134 -165.87523 790.39190
4485.0000 -173.77766 -165.84315 7.93451 2.56378 -165.49049 796.15765
4490.0000 -172.94389 -165.07738 7.86651 2.58435 -165.13770 847.34206
4495.0000 -172.80561 -165.60635 7.19926 2.54194 -165.86494 812.69132
4500.0000 -172.78583 -167.42794 5.35789 2.51709 -166.29096 800.74531
MELTING PROCESS: loop number 19 T-loop= 788.00000000000000
main_MD> interactions number 19 at Temperature= 788.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28252 0.34493 1.20668
force_rgl> df(natom) -0.91050 -0.63150 -2.89976
4505.0000 -175.02788 -167.83518 7.19270 2.51283 -166.36410 791.08932
4510.0000 -173.52744 -165.49388 8.03356 2.50242 -166.54258 793.06243
4515.0000 -173.69486 -166.46120 7.23365 2.52542 -166.14819 806.96343
4520.0000 -172.54179 -163.59857 8.94322 2.61284 -164.64919 849.10135
4525.0000 -171.91908 -163.68638 8.23270 2.64746 -164.05565 862.83497
4530.0000 -172.37871 -165.36980 7.00891 2.61426 -164.62492 846.86995
4535.0000 -175.07036 -167.51793 7.55244 2.49760 -166.62515 776.56379
4540.0000 -174.34097 -167.70725 6.63372 2.44315 -167.55883 750.29813
4545.0000 -173.60073 -166.84168 6.75906 2.44546 -167.51922 713.36468
4550.0000 -173.33051 -167.12518 6.20532 2.48575 -166.82835 758.83930
4555.0000 -173.72107 -167.73573 5.98534 2.44785 -167.47817 735.94598
4560.0000 -173.92830 -166.32066 7.60764 2.47194 -167.06524 747.99233
4565.0000 -172.13072 -165.31914 6.81158 2.58829 -165.07020 830.70470
4570.0000 -171.87785 -164.35120 7.52665 2.62794 -164.39035 862.94609
4575.0000 -174.71432 -166.49625 8.21806 2.58460 -165.13355 816.54611
4580.0000 -174.34989 -168.26817 6.08172 2.47361 -167.03665 753.56496
4585.0000 -172.97141 -166.09822 6.87319 2.48549 -166.83281 782.66740
4590.0000 -174.63606 -166.29686 8.33920 2.53470 -165.98906 804.23022
4595.0000 -174.68042 -168.88364 5.79679 2.43932 -167.62453 779.50420
4600.0000 -174.55761 -168.23112 6.32649 2.41714 -168.00480 733.75366
4605.0000 -173.14135 -165.92477 7.21659 2.52583 -166.14118 823.20306
4610.0000 -173.09922 -166.03137 7.06785 2.54541 -165.80541 790.16490
4615.0000 -174.19567 -166.43794 7.75774 2.53387 -166.00327 812.72745
4620.0000 -174.81046 -168.38645 6.42400 2.45270 -167.39513 751.01583
4625.0000 -174.16889 -167.74022 6.42867 2.46192 -167.23694 744.33207
4630.0000 -173.66289 -167.10471 6.55818 2.41406 -168.05757 728.12311
4635.0000 -174.40673 -168.23328 6.17345 2.46549 -167.17581 747.31341
4640.0000 -173.73248 -166.50213 7.23035 2.47066 -167.08707 783.75296
4645.0000 -173.00666 -166.55294 6.45372 2.50144 -166.55933 792.80374
4650.0000 -172.66626 -165.03970 7.62656 2.56722 -165.43143 794.60742
4655.0000 -174.50987 -166.91873 7.59115 2.54192 -165.86523 824.41326
4660.0000 -174.22404 -166.54275 7.68129 2.50943 -166.42241 789.06207
4665.0000 -173.25872 -165.57821 7.68051 2.53079 -166.05613 808.57787
4670.0000 -172.21398 -166.02715 6.18683 2.52922 -166.08305 792.19750
4675.0000 -173.60233 -166.60509 6.99724 2.47683 -166.98134 745.21385
4680.0000 -173.64116 -165.88778 7.75338 2.53586 -165.96915 801.50272
4685.0000 -175.17587 -169.03422 6.14165 2.43441 -167.70877 762.58032
4690.0000 -174.87171 -168.58032 6.29139 2.36612 -168.87969 692.71561
4695.0000 -173.77325 -166.89144 6.88181 2.43435 -167.70976 748.95411
4700.0000 -173.35631 -165.64689 7.70943 2.52904 -166.08615 800.81884
4705.0000 -174.90272 -166.89726 8.00546 2.52742 -166.11395 782.74054
4710.0000 -174.63800 -167.42898 7.20902 2.47666 -166.98433 783.81793
4715.0000 -173.91843 -167.49282 6.42561 2.47431 -167.02464 763.34178
4720.0000 -173.30254 -166.63165 6.67089 2.49193 -166.72249 697.28121
4725.0000 -172.66170 -167.17727 5.48442 2.46621 -167.16344 726.99268
4730.0000 -174.06289 -167.25388 6.80901 2.47248 -167.05601 740.45635
4735.0000 -173.02452 -165.08790 7.93663 2.50948 -166.42149 795.54390
4740.0000 -172.49974 -164.90200 7.59775 2.56499 -165.46968 838.14193
4745.0000 -173.94004 -165.71612 8.22392 2.54940 -165.73703 826.64953
4750.0000 -173.44276 -166.64841 6.79435 2.49780 -166.62172 778.39587
MELTING PROCESS: loop number 20 T-loop= 813.00000000000000
main_MD> interactions number 20 at Temperature= 813.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.04278 -2.09592 1.78708
force_rgl> df(natom) 0.03535 2.50628 1.67950
4755.0000 -171.96915 -164.19857 7.77058 2.53572 -165.97162 812.75621
4760.0000 -172.88060 -165.50512 7.37548 2.61748 -164.56965 863.39832
4765.0000 -172.67883 -165.79994 6.87890 2.57250 -165.34095 838.15653
4770.0000 -173.53242 -166.32709 7.20533 2.51175 -166.38265 809.67423
4775.0000 -172.70099 -164.40955 8.29144 2.58853 -165.06606 846.93243
4780.0000 -172.82108 -164.56970 8.25138 2.61839 -164.55407 855.42599
4785.0000 -173.37453 -166.32642 7.04811 2.54390 -165.83138 805.35035
4790.0000 -173.78666 -165.78848 7.99818 2.50515 -166.49578 768.26621
4795.0000 -173.66907 -167.37637 6.29270 2.57162 -165.35612 823.63931
4800.0000 -173.56411 -166.83986 6.72425 2.49545 -166.66212 790.34176
4805.0000 -173.15178 -165.07946 8.07233 2.49938 -166.59466 759.83120
4810.0000 -173.35993 -165.26114 8.09879 2.57770 -165.25178 841.50782
4815.0000 -172.57856 -164.47459 8.10397 2.58663 -165.09867 866.67774
4820.0000 -172.26898 -163.76260 8.50639 2.66623 -163.73382 899.27369
4825.0000 -172.30616 -165.01856 7.28761 2.64913 -164.02710 859.03437
4830.0000 -173.46503 -165.89437 7.57066 2.55416 -165.65538 816.22524
4835.0000 -172.56166 -165.21772 7.34394 2.55285 -165.67793 814.74249
4840.0000 -173.63683 -165.95908 7.67775 2.60908 -164.71370 851.70726
4845.0000 -174.30309 -167.37192 6.93117 2.49011 -166.75357 776.56450
4850.0000 -173.56541 -166.73146 6.83395 2.49301 -166.70390 775.51049
4855.0000 -172.80678 -166.32170 6.48508 2.51961 -166.24776 772.14955
4860.0000 -173.16202 -165.51012 7.65190 2.52069 -166.22923 793.90698
4865.0000 -171.32352 -162.41961 8.90390 2.63814 -164.21548 905.88793
4870.0000 -171.33387 -163.58777 7.74610 2.68319 -163.44298 918.44530
4875.0000 -172.88732 -165.71893 7.16839 2.62241 -164.48510 858.37414
4880.0000 -172.11545 -163.00112 9.11433 2.61077 -164.68484 879.15005
4885.0000 -170.71062 -163.81404 6.89658 2.66434 -163.76624 889.67984
4890.0000 -172.95689 -165.53209 7.42480 2.58326 -165.15648 833.80463
4895.0000 -172.81646 -164.66018 8.15628 2.55919 -165.56916 794.64590
4900.0000 -171.96806 -164.17116 7.79690 2.64002 -164.18322 855.41428
4905.0000 -171.81938 -164.47271 7.34667 2.65860 -163.86473 892.20622
4910.0000 -173.66727 -166.17143 7.49584 2.55801 -165.58946 830.73227
4915.0000 -173.22936 -164.03691 9.19245 2.61497 -164.61274 842.35298
4920.0000 -172.83900 -163.86061 8.97839 2.64060 -164.17329 889.42473
4925.0000 -173.25129 -166.17125 7.08004 2.59686 -164.92319 840.63497
4930.0000 -173.42027 -165.59413 7.82614 2.52339 -166.18305 833.14357
4935.0000 -172.74643 -166.74804 5.99839 2.56110 -165.53636 818.11853
4940.0000 -172.60389 -165.53772 7.06618 2.47207 -167.06302 747.67037
4945.0000 -173.16212 -165.76209 7.40003 2.56826 -165.41358 847.28419
4950.0000 -173.26804 -165.89018 7.37786 2.56442 -165.47955 815.66304
4955.0000 -171.90174 -165.14225 6.75948 2.57631 -165.27559 825.78234
4960.0000 -172.85926 -165.47605 7.38320 2.53882 -165.91841 823.90408
4965.0000 -171.83098 -165.34450 6.48648 2.56050 -165.54675 815.81430
4970.0000 -172.13473 -165.37855 6.75618 2.50439 -166.50872 783.15173
4975.0000 -172.85160 -165.17926 7.67233 2.58141 -165.18811 825.96064
4980.0000 -174.56927 -167.75483 6.81445 2.56209 -165.51939 856.36900
4985.0000 -173.56544 -167.10060 6.46484 2.47735 -166.97244 773.76040
4990.0000 -172.22880 -164.27694 7.95186 2.57004 -165.38313 831.20790
4995.0000 -171.84276 -163.25329 8.58947 2.68409 -163.42759 898.02164
5000.0000 -172.18620 -163.78189 8.40431 2.69114 -163.30670 903.49040
MELTING PROCESS: loop number 21 T-loop= 838.00000000000000
main_MD> interactions number 21 at Temperature= 838.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.34198 0.56834 -2.30986
force_rgl> df(natom) 3.52868 -1.18456 0.60412
5005.0000 -173.93470 -166.08653 7.84817 2.61974 -164.53093 851.17150
5010.0000 -174.65076 -167.72462 6.92614 2.52619 -166.13500 829.31102
5015.0000 -174.73080 -166.90463 7.82617 2.41914 -167.97054 742.69802
5020.0000 -175.09018 -166.79830 8.29189 2.47884 -166.94685 794.25599
5025.0000 -173.00152 -166.02207 6.97945 2.50779 -166.45052 813.12892
5030.0000 -173.82791 -166.86045 6.96745 2.52638 -166.13183 796.04040
5035.0000 -173.39150 -165.26842 8.12308 2.54275 -165.85113 828.12905
5040.0000 -173.29258 -164.92752 8.36506 2.58512 -165.12456 823.35259
5045.0000 -174.32887 -166.88575 7.44312 2.50997 -166.41305 806.85295
5050.0000 -174.11230 -166.82568 7.28661 2.48850 -166.78127 773.31265
5055.0000 -173.11669 -164.90802 8.20867 2.54443 -165.82227 800.02621
5060.0000 -173.48295 -165.94755 7.53540 2.59371 -164.97729 810.40823
5065.0000 -173.49556 -166.22447 7.27109 2.54725 -165.77392 799.95984
5070.0000 -171.53480 -163.81755 7.71725 2.58981 -165.04419 846.85103
5075.0000 -172.33694 -165.10543 7.23151 2.62397 -164.45850 904.49997
5080.0000 -174.10915 -165.33187 8.77728 2.58190 -165.17972 812.77438
5085.0000 -172.88137 -165.57846 7.30291 2.55699 -165.60682 798.35857
5090.0000 -173.61720 -165.60219 8.01501 2.56306 -165.50278 810.54572
5095.0000 -173.85116 -166.24591 7.60526 2.57104 -165.36598 840.12774
5100.0000 -174.08586 -165.67229 8.41357 2.52271 -166.19472 800.15507
5105.0000 -174.29692 -166.72101 7.57591 2.53734 -165.94388 805.08011
5110.0000 -174.27393 -166.01355 8.26038 2.48384 -166.86118 764.29928
5115.0000 -172.46461 -165.10671 7.35790 2.53739 -165.94295 803.13377
5120.0000 -173.44419 -164.86748 8.57670 2.62670 -164.41163 881.30276
5125.0000 -174.10894 -165.59283 8.51612 2.53892 -165.91680 815.97499
5130.0000 -171.95467 -162.89361 9.06106 2.64855 -164.03690 878.48204
5135.0000 -172.28694 -164.93932 7.34762 2.64094 -164.16743 859.47124
5140.0000 -172.36983 -164.02401 8.34582 2.62307 -164.47394 843.43948
5145.0000 -172.37149 -165.15929 7.21220 2.57229 -165.34456 816.86297
5150.0000 -170.66495 -162.78573 7.87922 2.65505 -163.92556 897.69425
5155.0000 -172.75294 -163.78070 8.97224 2.69144 -163.30165 900.93451
5160.0000 -172.63947 -164.63536 8.00411 2.61789 -164.56269 853.70251
5165.0000 -173.75789 -166.98821 6.76968 2.55656 -165.61435 827.74839
5170.0000 -172.96410 -165.53825 7.42585 2.52048 -166.23298 783.88135
5175.0000 -172.64086 -165.79883 6.84203 2.58034 -165.20646 850.41757
5180.0000 -173.33652 -166.24592 7.09061 2.55599 -165.62409 821.44874
5185.0000 -171.22828 -164.27026 6.95802 2.59498 -164.95545 860.30311
5190.0000 -171.90334 -163.83097 8.07237 2.61753 -164.56882 873.81607
5195.0000 -170.92570 -163.35657 7.56913 2.63471 -164.27427 855.02975
5200.0000 -171.99943 -164.76685 7.23258 2.65988 -163.84265 903.88019
5205.0000 -173.24039 -164.80982 8.43057 2.58578 -165.11331 836.08390
5210.0000 -172.57751 -165.45134 7.12617 2.59981 -164.87265 835.00186
5215.0000 -173.46265 -165.89511 7.56754 2.59162 -165.01317 833.32880
5220.0000 -173.13784 -165.01123 8.12661 2.56278 -165.50767 807.62047
5225.0000 -171.97388 -162.78612 9.18776 2.62646 -164.41575 843.48933
5230.0000 -172.29940 -164.94638 7.35302 2.69546 -163.23264 907.29161
5235.0000 -172.40823 -164.21271 8.19553 2.62432 -164.45235 863.85231
5240.0000 -173.65344 -165.76016 7.89328 2.59275 -164.99372 851.20146
5245.0000 -172.19839 -163.87165 8.32674 2.56954 -165.39163 812.49925
5250.0000 -171.99712 -164.10013 7.89699 2.65585 -163.91189 906.71784
MELTING PROCESS: loop number 22 T-loop= 863.00000000000000
main_MD> interactions number 22 at Temperature= 863.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.34164 -3.48582 -0.57864
force_rgl> df(natom) -0.90772 0.88567 2.09638
5255.0000 -170.41141 -162.64636 7.76506 2.66616 -163.73507 901.12518
5260.0000 -170.89881 -163.14299 7.75582 2.74802 -162.33144 930.76490
5265.0000 -173.09088 -165.48470 7.60618 2.62429 -164.45291 843.34808
5270.0000 -173.65692 -163.74362 9.91330 2.63985 -164.18618 874.75541
5275.0000 -171.41105 -161.70921 9.70184 2.69421 -163.25403 918.67699
5280.0000 -172.02270 -163.90715 8.11555 2.71093 -162.96738 904.33834
5285.0000 -172.53836 -164.11192 8.42644 2.60569 -164.77182 845.90518
5290.0000 -171.59947 -163.89474 7.70473 2.60963 -164.70435 840.03731
5295.0000 -172.71724 -164.25026 8.46698 2.65772 -163.87970 900.98711
5300.0000 -173.47761 -165.00334 8.47427 2.62363 -164.46428 866.55918
5305.0000 -174.14357 -165.71584 8.42773 2.63603 -164.25172 900.34089
5310.0000 -172.57314 -164.95151 7.62163 2.59237 -165.00028 870.72754
5315.0000 -172.71823 -164.08349 8.63474 2.61378 -164.63308 867.39280
5320.0000 -172.21184 -163.25002 8.96182 2.67368 -163.60609 900.33514
5325.0000 -172.92341 -163.17906 9.74435 2.73406 -162.57080 946.09272
5330.0000 -171.51582 -162.87245 8.64337 2.75342 -162.23887 953.61965
5335.0000 -170.63174 -161.35100 9.28074 2.74594 -162.36714 911.57444
5340.0000 -173.45350 -164.41230 9.04121 2.74989 -162.29941 937.29373
5345.0000 -171.14335 -164.40200 6.74134 2.60074 -164.85672 846.35982
5350.0000 -172.89809 -164.64643 8.25166 2.60595 -164.76740 838.41595
5355.0000 -174.00864 -165.81619 8.19245 2.65362 -163.95001 904.12949
5360.0000 -170.99170 -163.84973 7.14197 2.62607 -164.42236 848.39543
5365.0000 -172.29870 -164.58823 7.71047 2.65118 -163.99184 867.21665
5370.0000 -173.79310 -166.45216 7.34094 2.57672 -165.26862 850.46289
5375.0000 -172.72472 -166.88655 5.83817 2.50116 -166.56426 792.54633
5380.0000 -173.10737 -165.32448 7.78289 2.58124 -165.19105 840.38367
5385.0000 -173.14792 -165.90373 7.24419 2.55137 -165.70326 801.85548
5390.0000 -172.18659 -163.68750 8.49909 2.59613 -164.93574 848.81510
5395.0000 -173.46766 -165.28469 8.18298 2.65099 -163.99520 884.59037
5400.0000 -172.95653 -166.01547 6.94106 2.53674 -165.95417 796.51021
5405.0000 -171.21801 -162.81342 8.40459 2.63683 -164.23797 883.37187
5410.0000 -172.12815 -163.69045 8.43771 2.67483 -163.58642 918.74068
5415.0000 -171.35378 -164.17121 7.18257 2.68794 -163.36157 901.37710
5420.0000 -173.69654 -165.20301 8.49353 2.63673 -164.23964 859.79847
5425.0000 -172.72692 -164.85220 7.87472 2.59378 -164.97605 845.45100
5430.0000 -173.04852 -163.70990 9.33862 2.62934 -164.36630 885.39040
5435.0000 -172.84108 -164.29499 8.54609 2.67644 -163.55877 888.35329
5440.0000 -170.96862 -162.02071 8.94791 2.66076 -163.82759 883.56859
5445.0000 -171.15035 -162.73042 8.41992 2.72640 -162.70210 944.82829
5450.0000 -172.39490 -164.70085 7.69405 2.71081 -162.96945 924.24831
5455.0000 -172.28764 -165.13955 7.14810 2.56398 -165.48698 844.38101
5460.0000 -171.54519 -164.47154 7.07365 2.63281 -164.30694 892.57518
5465.0000 -173.76514 -164.84587 8.91927 2.60921 -164.71152 865.30590
5470.0000 -173.20322 -164.43361 8.76961 2.61226 -164.65913 817.92266
5475.0000 -174.77019 -166.67123 8.09896 2.58219 -165.17482 852.83319
5480.0000 -173.47756 -166.93679 6.54077 2.54027 -165.89363 817.43454
5485.0000 -173.21817 -166.08230 7.13587 2.50396 -166.51622 776.64073
5490.0000 -172.37997 -164.68859 7.69138 2.55332 -165.66975 804.76164
5495.0000 -171.16752 -161.75138 9.41614 2.75743 -162.17004 944.91360
5500.0000 -170.27305 -162.56471 7.70834 2.71718 -162.86021 900.87267
MELTING PROCESS: loop number 23 T-loop= 888.00000000000000
main_MD> interactions number 23 at Temperature= 888.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.37910 0.61450 2.61834
force_rgl> df(natom) -0.04887 -2.07284 3.01461
5505.0000 -171.39853 -163.71252 7.68601 2.65105 -163.99418 872.16200
5510.0000 -172.52394 -162.81643 9.70752 2.66820 -163.69998 911.99027
5515.0000 -171.92066 -163.05695 8.86370 2.64951 -164.02055 881.63185
5520.0000 -170.24545 -161.48861 8.75684 2.74153 -162.44268 959.20745
5525.0000 -171.01843 -162.66318 8.35525 2.72763 -162.68099 908.98926
5530.0000 -170.88873 -163.34240 7.54633 2.71348 -162.92365 904.27450
5535.0000 -170.75678 -162.18273 8.57405 2.73310 -162.58720 917.82221
5540.0000 -170.48984 -161.32299 9.16685 2.78304 -161.73094 979.10889
5545.0000 -171.00327 -164.48314 6.52013 2.69241 -163.28494 901.60528
5550.0000 -172.61625 -164.71088 7.90537 2.61928 -164.53885 855.42614
5555.0000 -171.90243 -165.10450 6.79793 2.62078 -164.51317 872.48009
5560.0000 -171.60873 -164.38709 7.22164 2.60506 -164.78259 830.80211
5565.0000 -171.11484 -163.74305 7.37180 2.61871 -164.54866 832.79458
5570.0000 -171.17227 -163.45836 7.71391 2.63462 -164.27577 842.60371
5575.0000 -172.47498 -163.31547 9.15951 2.66620 -163.73430 883.79162
5580.0000 -171.70161 -163.90169 7.79992 2.69452 -163.24874 897.32915
5585.0000 -173.79213 -166.97345 6.81869 2.57867 -165.23520 835.93270
5590.0000 -174.24677 -166.06809 8.17868 2.46047 -167.26191 754.98735
5595.0000 -172.75424 -164.95826 7.79598 2.55448 -165.65002 834.45107
5600.0000 -172.23245 -164.04394 8.18851 2.64311 -164.13023 903.20701
5605.0000 -172.23089 -164.01295 8.21794 2.63696 -164.23563 873.04835
5610.0000 -172.95295 -164.05966 8.89329 2.62982 -164.35820 850.07018
5615.0000 -172.90066 -164.24215 8.65851 2.60488 -164.78572 863.03666
5620.0000 -172.81439 -164.62805 8.18635 2.62184 -164.49492 855.59511
5625.0000 -170.44435 -162.68748 7.75688 2.66458 -163.76218 888.29725
5630.0000 -172.48542 -164.39742 8.08800 2.65785 -163.87746 873.99986
5635.0000 -173.49018 -165.78723 7.70295 2.54786 -165.76348 776.62233
5640.0000 -172.19864 -163.82637 8.37227 2.64330 -164.12694 888.77965
5645.0000 -170.32991 -161.54805 8.78186 2.69502 -163.24018 898.68456
5650.0000 -170.04955 -161.70075 8.34880 2.80347 -161.38068 972.52206
5655.0000 -172.75816 -164.48492 8.27325 2.70972 -162.98820 916.66792
5660.0000 -172.25548 -164.40154 7.85393 2.67474 -163.58795 884.80912
5665.0000 -174.07105 -166.35229 7.71876 2.54878 -165.74763 795.93716
5670.0000 -173.87413 -166.09578 7.77834 2.57206 -165.34859 813.11831
5675.0000 -172.69282 -164.84171 7.85112 2.60463 -164.79003 854.46412
5680.0000 -172.94184 -164.59288 8.34896 2.61072 -164.68561 853.48600
5685.0000 -172.93772 -164.02606 8.91166 2.65849 -163.86662 900.21822
5690.0000 -172.88690 -162.94291 9.94399 2.66556 -163.74537 906.26003
5695.0000 -170.36039 -161.66588 8.69451 2.70088 -163.13975 937.22569
5700.0000 -171.67868 -164.35396 7.32472 2.72039 -162.80519 895.41857
5705.0000 -173.57172 -165.53835 8.03337 2.59496 -164.95578 860.10290
5710.0000 -173.46150 -166.32320 7.13830 2.56043 -165.54784 813.50412
5715.0000 -174.00366 -166.69295 7.31071 2.54171 -165.86892 812.32282
5720.0000 -172.50178 -164.01515 8.48663 2.56848 -165.40995 811.33470
5725.0000 -172.02801 -163.29198 8.73604 2.70464 -163.07524 915.32998
5730.0000 -172.20535 -164.10011 8.10524 2.62451 -164.44913 868.45341
5735.0000 -173.26530 -165.31797 7.94732 2.62446 -164.45011 866.57284
5740.0000 -172.72465 -162.98480 9.73985 2.60279 -164.82162 880.45179
5745.0000 -172.76849 -164.42964 8.33884 2.70174 -163.12494 916.28275
5750.0000 -170.60523 -161.65957 8.94566 2.70710 -163.03302 907.10519
MELTING PROCESS: loop number 24 T-loop= 913.00000000000000
main_MD> interactions number 24 at Temperature= 913.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.46448 3.66699 -0.71659
force_rgl> df(natom) -1.88411 -0.78128 -1.97910
5755.0000 -173.13449 -163.29796 9.83653 2.73286 -162.59135 943.59927
5760.0000 -171.54892 -162.92111 8.62781 2.72896 -162.65827 928.34510
5765.0000 -171.21921 -162.33206 8.88716 2.70379 -163.08979 888.35472
5770.0000 -171.00490 -163.60463 7.40027 2.72195 -162.77848 907.20176
5775.0000 -171.59925 -163.47338 8.12586 2.73700 -162.52046 915.68488
5780.0000 -171.43313 -163.79935 7.63378 2.69992 -163.15615 895.28114
5785.0000 -171.40458 -161.48494 9.91964 2.72958 -162.64768 915.30470
5790.0000 -170.75587 -163.42845 7.32742 2.70621 -163.04830 924.23584
5795.0000 -171.66096 -163.17771 8.48325 2.71066 -162.97202 942.04202
5800.0000 -172.93196 -165.11723 7.81472 2.63605 -164.25136 880.94284
5805.0000 -173.17637 -165.78533 7.39104 2.57407 -165.31408 842.85182
5810.0000 -173.11053 -165.47514 7.63539 2.60226 -164.83074 860.70794
5815.0000 -171.34650 -163.13237 8.21413 2.61304 -164.64591 832.56941
5820.0000 -171.57018 -162.55032 9.01986 2.70625 -163.04772 907.09519
5825.0000 -170.48689 -162.32239 8.16449 2.74444 -162.39287 942.78635
5830.0000 -170.36536 -161.50215 8.86321 2.74508 -162.38182 948.42848
5835.0000 -170.90831 -162.95666 7.95165 2.73903 -162.48555 926.96631
5840.0000 -171.96785 -162.75136 9.21649 2.73075 -162.62746 956.39251
5845.0000 -171.07341 -163.71593 7.35748 2.68914 -163.34106 928.57507
5850.0000 -169.89544 -160.39154 9.50389 2.76922 -161.96800 948.24061
5855.0000 -171.76220 -164.03138 7.73082 2.72672 -162.69664 929.05753
5860.0000 -172.81150 -164.47398 8.33752 2.63391 -164.28797 871.85307
5865.0000 -172.77852 -163.50587 9.27265 2.64730 -164.05834 895.05571
5870.0000 -171.78580 -162.13778 9.64802 2.75854 -162.15101 939.70225
5875.0000 -170.33896 -160.71959 9.61937 2.79498 -161.52632 949.90526
5880.0000 -170.07623 -160.93935 9.13688 2.82169 -161.06833 993.05978
5885.0000 -171.66536 -161.97175 9.69362 2.77849 -161.80902 957.26590
5890.0000 -169.21774 -160.95892 8.25881 2.77883 -161.80312 969.87342
5895.0000 -171.50836 -162.85372 8.65464 2.81757 -161.13897 992.19190
5900.0000 -170.55400 -161.05554 9.49845 2.77008 -161.95314 967.82307
5905.0000 -170.05704 -162.90807 7.14897 2.78301 -161.73150 982.79977
5910.0000 -171.86659 -163.55815 8.30844 2.74534 -162.37732 963.82627
5915.0000 -173.24282 -164.94455 8.29828 2.64000 -164.18364 859.43511
5920.0000 -171.89595 -164.91219 6.98376 2.59887 -164.88882 831.66469
5925.0000 -174.32405 -166.02064 8.30341 2.56825 -165.41385 843.59344
5930.0000 -172.42598 -164.85647 7.56951 2.56853 -165.40908 832.67527
5935.0000 -170.18945 -162.78379 7.40566 2.63591 -164.25373 850.37797
5940.0000 -173.63682 -165.47804 8.15878 2.65549 -163.91797 859.16771
5945.0000 -173.71484 -165.79129 7.92355 2.56012 -165.55325 806.35354
5950.0000 -173.50512 -167.27981 6.22530 2.52384 -166.17525 818.18611
5955.0000 -171.45873 -163.41105 8.04768 2.55714 -165.60432 812.02729
5960.0000 -173.64766 -164.13691 9.51075 2.66546 -163.74708 900.83770
5965.0000 -171.30830 -164.38736 6.92093 2.64764 -164.05260 883.19341
5970.0000 -172.37754 -165.01727 7.36026 2.62669 -164.41186 869.74203
5975.0000 -171.34228 -163.65199 7.69028 2.69774 -163.19359 909.10600
5980.0000 -170.38703 -161.55491 8.83212 2.74985 -162.29997 894.93057
5985.0000 -170.59371 -160.69491 9.89880 2.84299 -160.70307 990.57509
5990.0000 -169.31287 -161.22596 8.08691 2.82645 -160.98658 966.31909
5995.0000 -169.16473 -160.96078 8.20394 2.83652 -160.81402 985.81512
6000.0000 -168.79084 -162.22086 6.56998 2.79762 -161.48090 933.06526
MELTING PROCESS: loop number 25 T-loop= 938.00000000000000
main_MD> interactions number 25 at Temperature= 938.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.28009 -1.02533 0.78093
force_rgl> df(natom) 2.08664 -1.92751 1.38501
6005.0000 -171.06134 -161.65884 9.40250 2.77335 -161.89706 954.89828
6010.0000 -172.64595 -163.97907 8.66688 2.73389 -162.57369 948.02401
6015.0000 -171.16075 -162.64256 8.51818 2.61088 -164.68288 885.48247
6020.0000 -171.32602 -161.41895 9.90707 2.75247 -162.25512 957.99447
6025.0000 -171.86021 -162.57108 9.28912 2.78456 -161.70493 955.94959
6030.0000 -170.21070 -160.31097 9.89973 2.77075 -161.94171 944.31184
6035.0000 -168.34114 -160.50111 7.84004 2.86656 -160.29884 1025.05551
6040.0000 -170.42144 -161.53617 8.88527 2.87224 -160.20148 1033.46270
6045.0000 -169.75419 -161.01086 8.74333 2.83060 -160.91553 979.51194
6050.0000 -169.98248 -160.22689 9.75559 2.82349 -161.03746 976.47424
6055.0000 -170.31380 -163.08614 7.22767 2.76602 -162.02279 945.53095
6060.0000 -172.42596 -163.43784 8.98811 2.66450 -163.76349 883.55014
6065.0000 -171.00555 -162.57132 8.43423 2.71853 -162.83712 911.76452
6070.0000 -172.11907 -164.73324 7.38583 2.65370 -163.94869 878.69231
6075.0000 -170.85307 -163.31138 7.54169 2.66069 -163.82884 894.45107
6080.0000 -171.60218 -164.28467 7.31750 2.75065 -162.28632 936.12452
6085.0000 -172.02002 -163.97047 8.04955 2.62977 -164.35905 855.40298
6090.0000 -170.11313 -162.18555 7.92758 2.71044 -162.97578 910.96284
6095.0000 -170.86426 -162.42681 8.43745 2.77163 -161.92663 962.28555
6100.0000 -170.68922 -161.95929 8.72994 2.71219 -162.94575 906.76125
6105.0000 -171.60449 -161.32488 10.27961 2.79101 -161.59436 944.54140
6110.0000 -171.49740 -162.08769 9.40971 2.80820 -161.29956 1000.69380
6115.0000 -169.51762 -160.80729 8.71033 2.82619 -160.99102 1014.38983
6120.0000 -170.69424 -161.70146 8.99278 2.84153 -160.72810 989.70639
6125.0000 -168.96497 -160.98568 7.97929 2.83142 -160.90138 969.85600
6130.0000 -171.55069 -163.29296 8.25773 2.71771 -162.85106 913.28697
6135.0000 -171.33315 -163.61971 7.71343 2.64103 -164.16593 834.72638
6140.0000 -171.44649 -162.55698 8.88951 2.66419 -163.76882 880.91328
6145.0000 -169.90613 -161.48740 8.41873 2.75641 -162.18761 950.50802
6150.0000 -170.42877 -161.50986 8.91890 2.79040 -161.60469 949.93041
6155.0000 -170.06213 -161.79849 8.26364 2.79387 -161.54525 968.93433
6160.0000 -170.35232 -161.98746 8.36486 2.72351 -162.75172 907.51294
6165.0000 -170.28790 -161.12862 9.15928 2.79020 -161.60827 968.88832
6170.0000 -173.14016 -164.28032 8.85984 2.70991 -162.98496 900.84263
6175.0000 -172.79348 -165.06170 7.73178 2.66138 -163.81695 869.93781
6180.0000 -170.91078 -164.16734 6.74344 2.63476 -164.27336 839.31759
6185.0000 -169.95037 -161.16651 8.78386 2.78199 -161.74889 953.20463
6190.0000 -171.39553 -161.33012 10.06541 2.80888 -161.28797 985.71189
6195.0000 -171.63778 -161.58212 10.05566 2.83802 -160.78828 1015.30686
6200.0000 -170.31157 -161.36953 8.94204 2.80410 -161.36989 970.28515
6205.0000 -169.47722 -161.94546 7.53175 2.78383 -161.71747 981.29506
6210.0000 -170.95090 -162.82473 8.12617 2.77773 -161.82201 953.78028
6215.0000 -170.56513 -160.87721 9.68792 2.80335 -161.38277 1010.39815
6220.0000 -169.70328 -159.42397 10.27932 2.88563 -159.97186 1039.71096
6225.0000 -169.07528 -159.92076 9.15453 2.97100 -158.50817 1098.15197
6230.0000 -171.20189 -162.90269 8.29920 2.80144 -161.41547 957.03084
6235.0000 -171.03809 -162.87869 8.15939 2.71230 -162.94392 886.92843
6240.0000 -171.23691 -161.60857 9.62834 2.69982 -163.15792 915.21119
6245.0000 -170.91951 -162.22159 8.69792 2.74738 -162.34236 960.23690
6250.0000 -172.41928 -162.82264 9.59664 2.73149 -162.61494 932.36042
MELTING PROCESS: loop number 26 T-loop= 963.00000000000000
main_MD> interactions number 26 at Temperature= 963.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.90736 -0.05581 0.70076
force_rgl> df(natom) 0.03438 -0.38217 0.61210
6255.0000 -170.53372 -161.33247 9.20124 2.75885 -162.14573 1001.50922
6260.0000 -171.53193 -163.80780 7.72413 2.69161 -163.29871 903.69550
6265.0000 -171.29086 -162.52193 8.76894 2.70953 -162.99140 926.78067
6270.0000 -172.60660 -164.18112 8.42548 2.63570 -164.25729 879.63838
6275.0000 -172.82580 -163.09205 9.73375 2.71250 -162.94052 935.00269
6280.0000 -171.76489 -164.34047 7.42442 2.70649 -163.04344 918.21811
6285.0000 -171.90658 -163.38163 8.52496 2.72638 -162.70243 933.89012
6290.0000 -170.69052 -162.14128 8.54924 2.74802 -162.33140 921.41115
6295.0000 -170.91960 -159.89565 11.02396 2.84163 -160.72632 1002.85856
6300.0000 -169.64881 -159.81064 9.83817 2.83418 -160.85402 997.52719
6305.0000 -171.43451 -160.89455 10.53996 2.86467 -160.33128 1037.69491
6310.0000 -171.48545 -160.77238 10.71306 2.83590 -160.82461 1031.94669
6315.0000 -170.74649 -162.28392 8.46257 2.81665 -161.15463 972.48873
6320.0000 -170.52445 -162.51603 8.00841 2.75960 -162.13279 934.91935
6325.0000 -168.83225 -159.98718 8.84507 2.80038 -161.43373 979.93890
6330.0000 -169.17830 -160.16699 9.01131 2.86465 -160.33172 1018.59160
6335.0000 -170.88898 -163.47680 7.41219 2.76866 -161.97752 949.24835
6340.0000 -170.95141 -161.36852 9.58289 2.74649 -162.35765 956.30970
6345.0000 -170.29749 -162.26297 8.03452 2.79174 -161.58181 991.13425
6350.0000 -170.53909 -161.75262 8.78647 2.73496 -162.55542 962.45012
6355.0000 -169.45181 -159.01994 10.43187 2.85495 -160.49794 1075.13137
6360.0000 -169.53775 -159.40575 10.13200 2.93866 -159.06258 1101.24268
6365.0000 -170.84751 -161.25409 9.59343 2.88163 -160.04050 1025.41476
6370.0000 -167.29573 -158.12773 9.16799 2.86899 -160.25726 1014.58099
6375.0000 -168.51099 -158.50401 10.00698 2.96680 -158.58016 1063.76460
6380.0000 -168.34152 -158.26383 10.07769 3.03895 -157.34309 1084.36344
6385.0000 -169.46570 -159.55560 9.91009 2.94240 -158.99859 1061.01184
6390.0000 -171.00809 -161.73111 9.27697 2.81383 -161.20310 994.85306
6395.0000 -168.91299 -162.25611 6.65688 2.77943 -161.79294 934.05124
6400.0000 -169.31610 -161.07987 8.23623 2.82202 -161.06258 951.11794
6405.0000 -170.96236 -162.07307 8.88928 2.78662 -161.66960 981.72400
6410.0000 -169.38034 -159.21662 10.16372 2.82570 -160.99950 982.75901
6415.0000 -171.35690 -161.10296 10.25394 2.88843 -159.92384 1042.98408
6420.0000 -170.90170 -161.04969 9.85201 2.85984 -160.41406 1028.61766
6425.0000 -169.00211 -159.86100 9.14111 2.79880 -161.46079 993.35931
6430.0000 -171.78273 -163.66320 8.11953 2.76759 -161.99581 942.31359
6435.0000 -171.07822 -162.57585 8.50237 2.66138 -163.81698 892.34413
6440.0000 -169.75485 -159.91240 9.84245 2.80067 -161.42866 970.08720
6445.0000 -170.21461 -160.85377 9.36084 2.86406 -160.34175 1015.29380
6450.0000 -170.62682 -161.66460 8.96223 2.81607 -161.16467 1000.50918
6455.0000 -170.95757 -161.51439 9.44317 2.73716 -162.51758 928.98821
6460.0000 -171.85387 -162.63034 9.22353 2.78253 -161.73964 957.82650
6465.0000 -172.49379 -164.64927 7.84452 2.63700 -164.23509 888.10357
6470.0000 -171.51179 -163.89633 7.61546 2.65635 -163.90326 878.31069
6475.0000 -171.28203 -161.32764 9.95439 2.77472 -161.87361 968.65980
6480.0000 -170.08360 -162.72690 7.35669 2.75073 -162.28498 937.25905
6485.0000 -170.17149 -161.20911 8.96238 2.81126 -161.24702 961.68209
6490.0000 -168.00586 -159.26530 8.74056 2.90419 -159.65372 1028.47135
6495.0000 -169.07785 -158.95845 10.11940 2.92286 -159.33354 1046.86042
6500.0000 -169.95473 -161.13577 8.81896 2.85573 -160.48458 1001.97117
MELTING PROCESS: loop number 27 T-loop= 988.00000000000000
main_MD> interactions number 27 at Temperature= 988.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.25275 1.35219 -1.87728
force_rgl> df(natom) -2.40141 -0.20189 -3.79506
6505.0000 -169.89078 -160.57302 9.31775 2.86858 -160.26423 1018.37380
6510.0000 -171.39245 -162.71401 8.67844 2.79002 -161.61120 963.67069
6515.0000 -171.45917 -163.78780 7.67137 2.71992 -162.81331 924.99737
6520.0000 -170.39206 -162.05926 8.33281 2.72875 -162.66182 938.76599
6525.0000 -168.80419 -160.15096 8.65322 2.85796 -160.44628 1005.25591
6530.0000 -171.17448 -160.50608 10.66840 2.85416 -160.51145 1009.00619
6535.0000 -171.78919 -163.56640 8.22280 2.78866 -161.63460 979.84380
6540.0000 -172.07562 -163.54036 8.53526 2.66428 -163.76729 893.32084
6545.0000 -170.54269 -161.87559 8.66710 2.72473 -162.73081 924.57192
6550.0000 -172.24239 -163.78354 8.45886 2.75551 -162.20308 946.54439
6555.0000 -172.32639 -163.42791 8.89848 2.71725 -162.85895 902.05666
6560.0000 -170.24604 -162.12233 8.12371 2.73999 -162.46907 916.10926
6565.0000 -169.67744 -160.31055 9.36689 2.84848 -160.60898 1017.07553
6570.0000 -169.29243 -160.10250 9.18994 2.85745 -160.45516 1025.96484
6575.0000 -168.87028 -158.77015 10.10013 2.93358 -159.14977 1072.38516
6580.0000 -168.10376 -158.02232 10.08144 3.00353 -157.95029 1111.61232
6585.0000 -170.27410 -158.94039 11.33372 2.90501 -159.63957 1034.41536
6590.0000 -168.16147 -158.21765 9.94382 2.96855 -158.55021 1099.14646
6595.0000 -169.85918 -161.84832 8.01086 2.85464 -160.50334 1040.67000
6600.0000 -168.70473 -159.44341 9.26131 2.78695 -161.66398 950.74775
6605.0000 -170.59650 -161.42377 9.17272 2.88134 -160.04541 1010.54238
6610.0000 -169.67820 -161.35083 8.32737 2.76732 -162.00052 970.64201
6615.0000 -167.61870 -157.81857 9.80013 2.93908 -159.05538 1057.19097
6620.0000 -170.79855 -160.50737 10.29118 2.96963 -158.53164 1097.80120
6625.0000 -171.38757 -162.11648 9.27108 2.80519 -161.35109 971.03404
6630.0000 -170.12947 -161.06213 9.06735 2.80104 -161.42229 998.09422
6635.0000 -170.69047 -160.75275 9.93772 2.81623 -161.16183 1004.64878
6640.0000 -170.11755 -161.09258 9.02496 2.76598 -162.02354 974.83566
6645.0000 -169.34004 -161.59207 7.74797 2.80707 -161.31896 997.64164
6650.0000 -171.34971 -160.86828 10.48143 2.81771 -161.13658 996.51634
6655.0000 -171.62158 -161.65303 9.96855 2.81128 -161.24669 1030.21973
6660.0000 -172.02077 -163.44346 8.57731 2.71997 -162.81240 918.99213
6665.0000 -169.82080 -160.83022 8.99058 2.76032 -162.12049 991.37941
6670.0000 -171.59986 -163.51185 8.08801 2.76343 -162.06712 998.56147
6675.0000 -170.43331 -161.72370 8.70961 2.69903 -163.17141 910.66147
6680.0000 -170.80801 -162.99273 7.81528 2.74090 -162.45351 902.76681
6685.0000 -169.28592 -160.92478 8.36114 2.79116 -161.59167 954.58964
6690.0000 -169.62445 -159.73651 9.88795 2.86691 -160.29296 1015.75697
6695.0000 -171.26879 -161.43439 9.83440 2.84405 -160.68484 1047.50034
6700.0000 -171.00516 -163.34460 7.66056 2.75952 -162.13430 961.40570
6705.0000 -171.99820 -163.11068 8.88751 2.71723 -162.85944 937.84687
6710.0000 -170.98174 -162.81789 8.16385 2.74340 -162.41063 948.62211
6715.0000 -168.44051 -159.09805 9.34246 2.80854 -161.29367 1003.49553
6720.0000 -168.54093 -160.26561 8.27532 2.90161 -159.69789 1068.91751
6725.0000 -170.39654 -161.60648 8.79005 2.82214 -161.06056 994.66167
6730.0000 -171.43854 -162.84304 8.59550 2.70198 -163.12087 936.15259
6735.0000 -171.88348 -162.90550 8.97798 2.71959 -162.81883 935.28034
6740.0000 -169.26852 -159.73472 9.53380 2.75682 -162.18055 949.92657
6745.0000 -171.72289 -161.43041 10.29248 2.85108 -160.56437 1018.44469
6750.0000 -169.83327 -162.05110 7.78217 2.77867 -161.80591 954.66488
MELTING PROCESS: loop number 28 T-loop= 1013.0000000000000
main_MD> interactions number 28 at Temperature= 1013.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.11446 -3.06451 7.57876
force_rgl> df(natom) -2.21039 -3.48862 4.09135
6755.0000 -168.96894 -160.36009 8.60886 2.78039 -161.77643 979.78821
6760.0000 -170.41850 -161.30691 9.11159 2.84036 -160.74821 993.49358
6765.0000 -170.10156 -159.82704 10.27452 2.87994 -160.06954 1053.08514
6770.0000 -168.59537 -159.50435 9.09102 2.90140 -159.70149 1056.50964
6775.0000 -167.82677 -157.47071 10.35607 2.96837 -158.55322 1084.62604
6780.0000 -168.68741 -157.81133 10.87608 2.94004 -159.03906 1033.07615
6785.0000 -169.26583 -157.80606 11.45977 2.95016 -158.86542 1041.10571
6790.0000 -169.84593 -159.41049 10.43544 2.95272 -158.82165 1083.11193
6795.0000 -168.18615 -159.68226 8.50389 2.85509 -160.49560 1025.92098
6800.0000 -168.52149 -159.57098 8.95051 2.91158 -159.52704 1082.76990
6805.0000 -168.17823 -157.80238 10.37586 2.93706 -159.09015 1090.97492
6810.0000 -170.42767 -161.23382 9.19385 2.90334 -159.66833 1048.84023
6815.0000 -172.19918 -163.39051 8.80867 2.75124 -162.27619 967.81757
6820.0000 -170.24580 -159.91265 10.33315 2.76509 -162.03880 961.37608
6825.0000 -171.02419 -161.56845 9.45573 2.79497 -161.52648 980.51657
6830.0000 -169.37533 -159.14998 10.22535 2.83285 -160.87695 1009.15087
6835.0000 -171.06412 -161.05741 10.00671 2.87774 -160.10726 1012.80022
6840.0000 -171.42614 -162.86532 8.56082 2.73937 -162.47972 924.15822
6845.0000 -171.12485 -161.93105 9.19380 2.75546 -162.20379 942.24259
6850.0000 -170.90548 -163.77124 7.13424 2.69035 -163.32032 916.79355
6855.0000 -170.17940 -162.08712 8.09228 2.74334 -162.41173 927.93190
6860.0000 -170.33246 -161.61391 8.71854 2.77339 -161.89650 972.12550
6865.0000 -171.11554 -161.71181 9.40373 2.77796 -161.81806 941.23067
6870.0000 -169.97539 -161.27638 8.69901 2.80711 -161.31832 966.44872
6875.0000 -168.47708 -158.91068 9.56639 2.87512 -160.15221 1001.81381
6880.0000 -171.47588 -160.39932 11.07656 2.88494 -159.98381 1033.56314
6885.0000 -167.32951 -158.75020 8.57931 2.93563 -159.11458 1067.12157
6890.0000 -170.08041 -158.71198 11.36843 2.94565 -158.94282 1061.26309
6895.0000 -169.34522 -159.16807 10.17715 2.92495 -159.29767 1037.91061
6900.0000 -169.87689 -159.73343 10.14345 2.92858 -159.23552 1065.63279
6905.0000 -170.08437 -160.22721 9.85716 2.92176 -159.35234 1069.71195
6910.0000 -170.02992 -160.27632 9.75360 2.89241 -159.85570 1039.39926
6915.0000 -169.27776 -162.05727 7.22049 2.82536 -161.00535 1006.25501
6920.0000 -171.16801 -163.20313 7.96488 2.72510 -162.72444 904.50800
6925.0000 -170.31362 -161.89356 8.42006 2.69543 -163.23310 869.99493
6930.0000 -171.08974 -163.41946 7.67029 2.76828 -161.98400 950.86513
6935.0000 -169.58894 -161.98713 7.60182 2.72867 -162.66315 918.19750
6940.0000 -169.52531 -159.55461 9.97070 2.88228 -160.02939 1017.47947
6945.0000 -170.18179 -161.12775 9.05404 2.89559 -159.80113 1038.41975
6950.0000 -170.57437 -159.31037 11.26400 2.84215 -160.71745 1000.41384
6955.0000 -169.59035 -159.94065 9.64971 2.90108 -159.70701 1028.26380
6960.0000 -167.11195 -158.03172 9.08023 2.93477 -159.12935 1047.45847
6965.0000 -172.18866 -160.47506 11.71360 2.92851 -159.23668 1088.08470
6970.0000 -170.17967 -161.37830 8.80137 2.80700 -161.32007 977.63033
6975.0000 -170.58047 -160.26624 10.31423 2.81159 -161.24143 1018.14262
6980.0000 -169.30007 -160.58081 8.71926 2.90875 -159.57542 1064.48051
6985.0000 -169.37543 -161.14951 8.22592 2.84520 -160.66520 988.89064
6990.0000 -170.82464 -161.17718 9.64746 2.81133 -161.24586 993.58443
6995.0000 -169.96378 -161.24869 8.71509 2.79927 -161.45266 980.41601
7000.0000 -169.71011 -161.15270 8.55741 2.81794 -161.13256 994.40677
MELTING PROCESS: loop number 29 T-loop= 1038.0000000000000
main_MD> interactions number 29 at Temperature= 1038.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.13736 2.11340 -0.45852
force_rgl> df(natom) 0.67004 -3.43893 -1.20030
7005.0000 -170.93361 -161.37841 9.55519 2.82275 -161.05015 984.71643
7010.0000 -170.83168 -162.34104 8.49064 2.72530 -162.72096 941.38976
7015.0000 -168.55020 -160.06711 8.48309 2.83408 -160.85589 1018.27183
7020.0000 -171.76510 -160.83287 10.93223 2.88025 -160.06425 1037.58202
7025.0000 -170.48465 -160.48769 9.99696 2.84467 -160.67431 998.54988
7030.0000 -168.65870 -160.12217 8.53654 2.86437 -160.33649 1006.48461
7035.0000 -170.99007 -161.45872 9.53135 2.86267 -160.36562 1012.08348
7040.0000 -169.86259 -160.25802 9.60456 2.85089 -160.56756 981.41074
7045.0000 -169.66574 -159.31103 10.35471 2.90543 -159.63248 1049.68998
7050.0000 -168.68646 -159.84218 8.84428 2.89921 -159.73911 1047.99088
7055.0000 -169.60869 -159.16681 10.44188 2.92133 -159.35978 1100.58980
7060.0000 -170.05010 -160.63708 9.41302 2.93103 -159.19347 1079.81154
7065.0000 -170.38614 -160.83236 9.55378 2.81379 -161.20366 989.39076
7070.0000 -169.32470 -157.85468 11.47002 2.93077 -159.19788 1076.00298
7075.0000 -168.67518 -158.58927 10.08591 2.97535 -158.43354 1066.19173
7080.0000 -169.41560 -159.36971 10.04590 2.96629 -158.58893 1126.07766
7085.0000 -171.64928 -161.22454 10.42473 2.85371 -160.51917 1038.36884
7090.0000 -169.85579 -159.97962 9.87617 2.83105 -160.90770 988.81951
7095.0000 -167.75157 -158.62733 9.12423 2.94660 -158.92647 1077.59310
7100.0000 -168.27227 -156.92364 11.34863 3.00157 -157.98389 1133.82450
7105.0000 -166.51030 -155.70891 10.80139 3.09626 -156.36042 1215.41162
7110.0000 -168.36172 -157.02644 11.33528 3.08955 -156.47541 1176.06963
7115.0000 -167.82421 -158.13031 9.69391 3.08513 -156.55124 1156.51576
7120.0000 -168.47745 -157.61861 10.85884 3.01953 -157.67604 1138.35908
7125.0000 -169.14027 -159.33909 9.80118 2.96469 -158.61639 1100.89168
7130.0000 -167.20004 -157.03305 10.16698 2.94096 -159.02322 1101.64576
7135.0000 -169.86504 -159.94835 9.91669 2.92455 -159.30460 1067.87228
7140.0000 -170.23565 -161.37374 8.86192 2.85967 -160.41709 1031.55811
7145.0000 -167.35313 -158.57512 8.77801 2.90350 -159.66550 1025.22896
7150.0000 -169.73784 -160.24862 9.48922 2.91764 -159.42309 1024.47996
7155.0000 -168.42438 -158.60470 9.81968 2.88308 -160.01556 1018.06192
7160.0000 -170.58466 -161.66846 8.91620 2.88353 -160.00799 1029.56376
7165.0000 -170.96266 -161.38422 9.57844 2.80916 -161.28303 982.51331
7170.0000 -169.22523 -159.45537 9.76986 2.83787 -160.79080 1024.47866
7175.0000 -168.88681 -158.91112 9.97569 2.94893 -158.88653 1094.82082
7180.0000 -168.61820 -159.38652 9.23167 2.94496 -158.95468 1077.67941
7185.0000 -169.44844 -158.09128 11.35716 2.94991 -158.86971 1079.60446
7190.0000 -170.04547 -159.61053 10.43494 2.99649 -158.07112 1078.62127
7195.0000 -168.80796 -159.34664 9.46132 2.95831 -158.72566 1063.23871
7200.0000 -170.11493 -159.99692 10.11800 2.91318 -159.49962 1074.44120
7205.0000 -169.66225 -159.74934 9.91291 2.91334 -159.49672 1058.57563
7210.0000 -170.51595 -160.43728 10.07867 2.83561 -160.82961 997.67107
7215.0000 -167.28107 -157.95321 9.32787 2.90610 -159.62086 1065.28121
7220.0000 -169.65497 -159.77482 9.88016 2.98150 -158.32808 1110.75115
7225.0000 -170.13911 -159.79230 10.34681 2.84402 -160.68541 1033.95921
7230.0000 -170.46238 -160.20306 10.25933 2.85127 -160.56106 1002.33062
7235.0000 -169.97473 -160.99988 8.97485 2.84414 -160.68333 1012.51795
7240.0000 -169.48578 -160.11796 9.36782 2.84229 -160.71510 1000.66783
7245.0000 -168.52216 -158.91812 9.60404 2.93094 -159.19508 1093.98952
7250.0000 -168.33424 -158.28090 10.05334 2.95979 -158.70041 1082.44703
MELTING PROCESS: loop number 30 T-loop= 1063.0000000000000
main_MD> interactions number 30 at Temperature= 1063.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.01100 4.17521 3.09149
force_rgl> df(natom) 2.16690 -0.18501 1.20739
7255.0000 -168.79232 -159.57075 9.22157 2.96760 -158.56647 1129.15129
7260.0000 -168.40992 -158.77210 9.63782 2.90640 -159.61579 1025.42594
7265.0000 -170.39880 -160.64726 9.75155 2.91485 -159.47097 1064.66271
7270.0000 -167.88223 -157.89898 9.98326 2.96298 -158.64558 1079.86355
7275.0000 -168.78161 -158.00604 10.77556 3.02626 -157.56067 1110.22653
7280.0000 -169.49655 -160.60793 8.88862 2.94733 -158.91400 1075.00890
7285.0000 -171.71499 -162.66692 9.04807 2.75991 -162.12757 969.16837
7290.0000 -170.33441 -160.56204 9.77237 2.78388 -161.71656 959.00174
7295.0000 -170.43702 -161.42397 9.01305 2.80605 -161.33644 972.72736
7300.0000 -169.09989 -160.94972 8.15017 2.82497 -161.01206 993.20642
7305.0000 -169.91885 -161.16071 8.75815 2.78748 -161.65484 1012.78475
7310.0000 -167.77552 -158.56946 9.20607 2.87252 -160.19666 1009.45741
7315.0000 -169.76203 -160.04768 9.71435 2.96289 -158.64719 1063.95699
7320.0000 -170.96959 -159.85825 11.11134 2.91523 -159.46433 1055.10208
7325.0000 -170.45233 -161.32957 9.12276 2.81528 -161.17809 986.18409
7330.0000 -169.11579 -161.37418 7.74160 2.80706 -161.31916 993.28122
7335.0000 -168.64502 -159.64580 8.99922 2.78012 -161.78096 956.01167
7340.0000 -168.50021 -157.57874 10.92147 2.93154 -159.18472 1062.92011
7345.0000 -168.02900 -157.74363 10.28537 3.01421 -157.76717 1104.77247
7350.0000 -168.74495 -157.39870 11.34625 2.99429 -158.10883 1130.41875
7355.0000 -168.73315 -158.73766 9.99549 2.95809 -158.72953 1097.72184
7360.0000 -169.99412 -160.59311 9.40101 2.86896 -160.25779 1046.25259
7365.0000 -170.59613 -161.52652 9.06961 2.82435 -161.02265 973.71886
7370.0000 -169.32860 -160.41163 8.91698 2.80621 -161.33368 994.64652
7375.0000 -172.03924 -162.28713 9.75212 2.85851 -160.43691 1032.32819
7380.0000 -169.34484 -159.87660 9.46824 2.79260 -161.56709 1001.43701
7385.0000 -170.03607 -160.44638 9.58969 2.89608 -159.79280 1010.76314
7390.0000 -170.53805 -160.94433 9.59371 2.78791 -161.64743 973.32571
7395.0000 -167.62880 -157.46702 10.16178 2.92243 -159.34100 1054.59722
7400.0000 -167.94355 -157.66679 10.27676 3.05336 -157.09600 1142.44891
7405.0000 -170.03668 -158.98877 11.04792 3.00899 -157.85666 1120.22490
7410.0000 -168.19627 -158.84967 9.34660 2.94683 -158.92251 1092.18402
7415.0000 -169.14440 -158.91285 10.23156 2.93529 -159.12039 1060.33606
7420.0000 -170.36562 -163.44621 6.91941 2.83421 -160.85366 982.63729
7425.0000 -171.30137 -161.63124 9.67014 2.77035 -161.94853 967.38324
7430.0000 -169.65881 -157.49541 12.16339 2.92959 -159.21820 1055.91356
7435.0000 -169.31129 -158.16624 11.14505 2.95901 -158.71371 1084.08947
7440.0000 -168.27141 -157.42206 10.84934 3.02397 -157.59984 1099.38486
7445.0000 -170.02591 -159.99400 10.03191 2.93909 -159.05534 1077.60431
7450.0000 -169.39654 -159.58153 9.81501 2.92813 -159.24318 1052.07558
7455.0000 -166.19607 -157.21970 8.97637 3.03849 -157.35090 1123.58790
7460.0000 -169.22869 -158.31098 10.91771 2.98139 -158.33002 1084.12804
7465.0000 -169.49298 -160.87773 8.61525 2.90231 -159.68592 1048.65907
7470.0000 -168.13948 -159.89572 8.24376 2.83683 -160.80869 998.66168
7475.0000 -169.63150 -159.75100 9.88051 2.84947 -160.59186 1028.38470
7480.0000 -167.59224 -157.07368 10.51857 2.93898 -159.05711 1051.77891
7485.0000 -168.35855 -158.33084 10.02771 3.03602 -157.39336 1110.50543
7490.0000 -169.64106 -159.48166 10.15940 2.92002 -159.38219 1063.61317
7495.0000 -169.13904 -159.66508 9.47396 2.87308 -160.18717 1013.16366
7500.0000 -169.66602 -160.79563 8.87039 2.86030 -160.40622 1008.61673
MELTING PROCESS: loop number 31 T-loop= 1088.0000000000000
main_MD> interactions number 31 at Temperature= 1088.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.76874 2.15633 2.95484
force_rgl> df(natom) 0.90979 -1.91685 -2.57207
7505.0000 -170.32885 -160.13965 10.18921 2.87519 -160.15084 1035.80992
7510.0000 -169.32969 -160.36140 8.96829 2.85313 -160.52923 1024.10514
7515.0000 -168.06293 -159.60218 8.46075 2.90624 -159.61847 1038.76174
7520.0000 -169.20251 -159.78658 9.41593 2.87098 -160.22303 1017.64087
7525.0000 -167.75432 -156.87360 10.88072 3.01227 -157.80057 1117.38433
7530.0000 -167.44316 -157.32498 10.11818 3.05737 -157.02718 1126.06213
7535.0000 -169.32895 -158.66674 10.66221 3.00978 -157.84313 1107.28057
7540.0000 -166.62658 -157.30673 9.31985 2.98977 -158.18633 1076.21362
7545.0000 -167.55115 -157.06026 10.49090 2.99030 -158.17714 1099.99276
7550.0000 -166.66627 -156.32465 10.34163 3.05728 -157.02868 1151.17139
7555.0000 -166.71779 -156.28625 10.43153 3.14510 -155.52297 1223.22087
7560.0000 -168.53696 -158.82590 9.71106 2.97734 -158.39943 1113.94547
7565.0000 -169.05492 -160.27942 8.77550 2.86889 -160.25902 1029.20909
7570.0000 -168.99104 -156.98198 12.00907 2.95941 -158.70678 1104.85031
7575.0000 -169.58174 -159.50906 10.07268 3.01029 -157.83444 1153.36091
7580.0000 -168.18857 -159.35115 8.83742 2.93766 -159.07978 1104.32170
7585.0000 -170.12685 -161.84724 8.27961 2.90397 -159.65745 1059.41415
7590.0000 -171.07999 -161.54914 9.53085 2.76043 -162.11865 953.43251
7595.0000 -169.07808 -159.68938 9.38869 2.82107 -161.07895 996.30284
7600.0000 -168.58619 -158.48499 10.10120 2.93389 -159.14441 1082.71997
7605.0000 -169.74792 -159.41988 10.32804 2.89852 -159.75084 1017.42353
7610.0000 -168.65522 -157.30985 11.34537 2.90251 -159.68252 1025.90810
7615.0000 -166.62299 -156.39243 10.23056 3.09815 -156.32789 1195.72011
7620.0000 -169.91949 -159.07421 10.84528 2.99517 -158.09365 1118.51177
7625.0000 -171.45841 -160.05465 11.40376 2.94576 -158.94082 1092.29478
7630.0000 -169.12886 -158.96057 10.16829 2.92429 -159.30902 1099.13813
7635.0000 -169.74027 -159.80189 9.93838 2.90422 -159.65322 1039.06443
7640.0000 -167.92967 -158.06982 9.85985 2.95786 -158.73351 1081.56840
7645.0000 -168.56194 -158.69096 9.87098 2.93752 -159.08213 1057.59518
7650.0000 -167.78370 -157.66944 10.11426 3.02931 -157.50836 1117.97723
7655.0000 -166.58673 -156.16558 10.42114 3.03904 -157.34143 1096.64330
7660.0000 -167.47517 -157.58336 9.89181 3.06087 -156.96721 1124.81787
7665.0000 -165.10621 -156.55098 8.55524 3.10017 -156.29339 1177.92847
7670.0000 -167.92986 -156.29040 11.63946 3.02611 -157.56316 1145.76197
7675.0000 -168.96225 -158.24453 10.71772 3.02614 -157.56263 1121.25795
7680.0000 -166.91245 -157.40486 9.50760 3.09057 -156.45802 1164.86852
7685.0000 -167.01587 -156.57491 10.44095 3.04009 -157.32346 1106.68415
7690.0000 -169.20388 -160.45220 8.75168 2.93273 -159.16426 1035.48311
7695.0000 -170.26990 -160.81550 9.45440 2.86044 -160.40387 1004.97990
7700.0000 -168.56248 -158.24533 10.31715 2.87988 -160.07051 1039.68179
7705.0000 -168.18657 -158.60312 9.58345 3.01609 -157.73494 1123.50505
7710.0000 -168.46183 -156.99273 11.46910 3.02137 -157.64440 1165.91965
7715.0000 -169.58243 -159.84587 9.73656 2.92612 -159.27760 1047.72360
7720.0000 -166.31545 -156.01990 10.29555 3.04805 -157.18707 1133.00931
7725.0000 -169.05676 -157.94964 11.10712 2.96146 -158.67172 1084.19436
7730.0000 -167.94055 -159.17818 8.76237 2.99892 -158.02936 1120.95131
7735.0000 -168.03189 -157.89895 10.13293 2.99032 -158.17690 1131.78324
7740.0000 -168.21371 -157.05897 11.15474 3.00018 -158.00779 1100.15211
7745.0000 -168.47973 -159.45890 9.02083 2.97843 -158.38075 1111.12951
7750.0000 -168.81113 -160.08839 8.72273 2.89749 -159.76852 1020.54706
MELTING PROCESS: loop number 32 T-loop= 1113.0000000000000
main_MD> interactions number 32 at Temperature= 1113.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.21750 1.96925 -0.00373
force_rgl> df(natom) 2.31487 -1.44254 -1.28769
7755.0000 -167.97196 -156.09531 11.87666 2.98918 -158.19636 1096.13938
7760.0000 -169.82879 -158.94142 10.88737 3.03883 -157.34511 1173.01385
7765.0000 -167.61155 -156.39973 11.21182 3.00477 -157.92911 1114.45621
7770.0000 -168.58242 -156.57817 12.00425 3.11894 -155.97151 1195.22211
7775.0000 -168.35685 -158.12328 10.23358 3.03662 -157.38302 1147.40247
7780.0000 -168.80682 -160.27596 8.53086 3.02770 -157.53593 1124.60392
7785.0000 -169.51890 -158.22980 11.28909 2.92687 -159.26479 1053.10114
7790.0000 -168.67224 -160.45864 8.21359 2.96883 -158.54530 1118.94761
7795.0000 -169.52145 -160.54154 8.97992 2.81626 -161.16140 971.14878
7800.0000 -169.99322 -158.93304 11.06019 2.91902 -159.39934 1076.77697
7805.0000 -169.54697 -159.21570 10.33128 2.97489 -158.44139 1112.93759
7810.0000 -167.32609 -157.74537 9.58071 2.99466 -158.10241 1160.69858
7815.0000 -169.17588 -159.27209 9.90378 2.95559 -158.77242 1075.59602
7820.0000 -168.23089 -160.10757 8.12332 2.92253 -159.33920 1052.15283
7825.0000 -169.04311 -158.68977 10.35334 2.95729 -158.74328 1085.33851
7830.0000 -168.29889 -159.14134 9.15755 2.94439 -158.96438 1107.61092
7835.0000 -167.20648 -157.29407 9.91240 3.03754 -157.36727 1140.77815
7840.0000 -165.07812 -154.40425 10.67387 3.05424 -157.08093 1158.98311
7845.0000 -168.14305 -157.52663 10.61642 3.13370 -155.71839 1168.83702
7850.0000 -168.89893 -158.63666 10.26227 3.03683 -157.37943 1133.76749
7855.0000 -164.99198 -152.83885 12.15314 3.10260 -156.25160 1230.65295
7860.0000 -167.40099 -155.96575 11.43524 3.25336 -153.66665 1270.12554
7865.0000 -169.27303 -156.94494 12.32810 3.08371 -156.57548 1186.75979
7870.0000 -167.80078 -157.16941 10.63137 3.02346 -157.60859 1126.08776
7875.0000 -170.35245 -159.44350 10.90896 2.96306 -158.64422 1064.51230
7880.0000 -167.22034 -158.26953 8.95080 2.96166 -158.66822 1098.43883
7885.0000 -169.38748 -160.87049 8.51700 2.90747 -159.59748 1045.04220
7890.0000 -168.05287 -157.87752 10.17535 2.94926 -158.88085 1067.08469
7895.0000 -166.49447 -156.78204 9.71243 3.07258 -156.76638 1081.92235
7900.0000 -166.79010 -156.93218 9.85792 3.09175 -156.43771 1174.97386
7905.0000 -168.00146 -157.56827 10.43319 3.05542 -157.06059 1154.09005
7910.0000 -169.13613 -159.17660 9.95953 2.97311 -158.47203 1118.55996
7915.0000 -168.24280 -159.31457 8.92823 2.93973 -159.04427 1065.88149
7920.0000 -166.84881 -156.04256 10.80624 2.99590 -158.08123 1097.59729
7925.0000 -167.57232 -157.33255 10.23977 3.02536 -157.57597 1120.52569
7930.0000 -167.05996 -156.14061 10.91936 3.03009 -157.49503 1130.83841
7935.0000 -162.68351 -153.36427 9.31924 3.23513 -153.97920 1279.83398
7940.0000 -170.30436 -161.59363 8.71073 3.03853 -157.35018 1128.07273
7945.0000 -169.86145 -160.74386 9.11759 2.80761 -161.30966 1003.72687
7950.0000 -165.82603 -157.04495 8.78108 2.93730 -159.08597 1101.86459
7955.0000 -166.98231 -155.71069 11.27163 3.11483 -156.04202 1178.40644
7960.0000 -167.24609 -157.12338 10.12271 3.09905 -156.31247 1182.92192
7965.0000 -167.07723 -158.09894 8.97829 3.06179 -156.95140 1156.49177
7970.0000 -168.85033 -159.32003 9.53030 2.97002 -158.52494 1082.06355
7975.0000 -168.96617 -157.57145 11.39472 3.02297 -157.61710 1106.72591
7980.0000 -169.12280 -159.58449 9.53830 2.99423 -158.10974 1102.87674
7985.0000 -168.16225 -158.79631 9.36594 2.94447 -158.96307 1036.12850
7990.0000 -167.77297 -157.62101 10.15196 2.98035 -158.34789 1066.09333
7995.0000 -168.57289 -155.81071 12.76218 3.03955 -157.33277 1150.09231
8000.0000 -168.02845 -157.18594 10.84251 3.05631 -157.04533 1174.46100
MELTING PROCESS: loop number 33 T-loop= 1138.0000000000000
main_MD> interactions number 33 at Temperature= 1138.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.71814 -1.87571 -0.91330
force_rgl> df(natom) -2.08091 0.35800 -1.24303
8005.0000 -167.05590 -156.04604 11.00986 3.06271 -156.93567 1131.32187
8010.0000 -167.64581 -158.27077 9.37503 3.09290 -156.41795 1182.12986
8015.0000 -167.48496 -155.92948 11.55548 3.09975 -156.30047 1195.94599
8020.0000 -168.23114 -158.52619 9.70495 2.98580 -158.25443 1119.06861
8025.0000 -168.32305 -157.19547 11.12759 2.97686 -158.40766 1139.22823
8030.0000 -169.10886 -157.04964 12.05922 3.11653 -156.01282 1242.41004
8035.0000 -168.84949 -159.06213 9.78737 3.03042 -157.48937 1120.30313
8040.0000 -168.37582 -158.07602 10.29979 3.02473 -157.58677 1155.77575
8045.0000 -168.10017 -157.71524 10.38493 3.01531 -157.74837 1130.87061
8050.0000 -168.15202 -158.06875 10.08328 2.98620 -158.24752 1103.16670
8055.0000 -170.00482 -161.12950 8.87532 2.91894 -159.40073 1059.42979
8060.0000 -169.25281 -160.47263 8.78018 2.84154 -160.72788 974.68067
8065.0000 -169.21215 -159.67846 9.53369 2.81760 -161.13836 994.91048
8070.0000 -166.01127 -154.66675 11.34452 3.05748 -157.02531 1146.17947
8075.0000 -167.23172 -155.70558 11.52614 3.11065 -156.11359 1178.47069
8080.0000 -167.44724 -155.54087 11.90637 3.16890 -155.11493 1222.62138
8085.0000 -169.15035 -158.58364 10.56671 3.00955 -157.84714 1107.69737
8090.0000 -166.91068 -156.07931 10.83137 3.06757 -156.85227 1186.45206
8095.0000 -167.20025 -158.25224 8.94802 3.02343 -157.60907 1098.06375
8100.0000 -168.22958 -157.39346 10.83612 3.03040 -157.48970 1146.39545
8105.0000 -164.99008 -154.16295 10.82713 3.08885 -156.48743 1168.55732
8110.0000 -168.20247 -156.55129 11.65118 3.04221 -157.28716 1116.46727
8115.0000 -167.22538 -157.29149 9.93389 3.03068 -157.48485 1141.43827
8120.0000 -167.44037 -157.40642 10.03395 3.06314 -156.92826 1187.09592
8125.0000 -168.34630 -157.61664 10.72966 3.03379 -157.43154 1110.93637
8130.0000 -166.61979 -156.06528 10.55451 3.04541 -157.23227 1128.14477
8135.0000 -165.20991 -155.75525 9.45466 3.13551 -155.68740 1190.70583
8140.0000 -169.73449 -158.44645 11.28805 3.03875 -157.34652 1119.31650
8145.0000 -167.71119 -158.37474 9.33645 2.96912 -158.54041 1098.96657
8150.0000 -169.33695 -157.49466 11.84229 2.96821 -158.55591 1093.08991
8155.0000 -167.86035 -157.41100 10.44935 3.01630 -157.73142 1142.73578
8160.0000 -166.10251 -157.30766 8.79485 3.03189 -157.46405 1149.71756
8165.0000 -165.69116 -154.39074 11.30042 3.04135 -157.30189 1128.15977
8170.0000 -165.23941 -154.98946 10.24994 3.23511 -153.97960 1240.05357
8175.0000 -167.46080 -157.76426 9.69654 3.02384 -157.60209 1118.92558
8180.0000 -167.73334 -159.02135 8.71199 3.02293 -157.61778 1136.05425
8185.0000 -170.46459 -160.22306 10.24153 2.91807 -159.41572 1067.53539
8190.0000 -169.18191 -158.50554 10.67637 2.89076 -159.88401 1030.06430
8195.0000 -168.58142 -158.92042 9.66100 2.89693 -159.77821 1048.36907
8200.0000 -165.82453 -154.75835 11.06618 3.02798 -157.53118 1126.99082
8205.0000 -166.35951 -156.59271 9.76679 3.13130 -155.75953 1222.12671
8210.0000 -163.99034 -153.58001 10.41033 3.18035 -154.91860 1232.49689
8215.0000 -166.97546 -157.35637 9.61909 3.11993 -155.95447 1216.32845
8220.0000 -168.06305 -156.70876 11.35429 3.07489 -156.72673 1168.02764
8225.0000 -166.93632 -156.72776 10.20856 3.05131 -157.13117 1136.49543
8230.0000 -169.16215 -160.42838 8.73377 2.94918 -158.88228 1071.10127
8235.0000 -167.49992 -157.37305 10.12687 2.97117 -158.50518 1054.30825
8240.0000 -169.02855 -158.69106 10.33749 2.95662 -158.75470 1070.79303
8245.0000 -167.32203 -159.83006 7.49197 2.87502 -160.15388 1024.90458
8250.0000 -168.99521 -159.28937 9.70583 2.93553 -159.11628 1090.37433
MELTING PROCESS: loop number 34 T-loop= 1163.0000000000000
main_MD> interactions number 34 at Temperature= 1163.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -8.51949 1.77427 6.53781
force_rgl> df(natom) -5.28442 -1.21090 -3.95182
8255.0000 -169.56724 -158.72980 10.83745 2.93279 -159.16332 1041.19960
8260.0000 -168.65139 -157.94262 10.70877 2.99856 -158.03560 1088.44010
8265.0000 -168.83152 -159.06188 9.76964 2.97772 -158.39286 1098.86727
8270.0000 -166.04027 -155.71888 10.32139 2.99968 -158.01629 1093.47575
8275.0000 -168.03201 -157.53560 10.49641 3.10625 -156.18904 1171.42869
8280.0000 -167.93199 -156.75067 11.18132 2.99180 -158.15150 1091.37802
8285.0000 -164.05339 -154.90509 9.14830 3.10995 -156.12563 1188.66379
8290.0000 -166.88570 -156.61951 10.26620 3.11275 -156.07767 1186.47574
8295.0000 -166.44121 -156.70751 9.73369 3.06436 -156.90742 1158.02860
8300.0000 -166.48034 -156.81595 9.66439 3.03739 -157.36978 1150.84810
8305.0000 -168.87387 -158.64243 10.23145 2.98829 -158.21164 1077.17002
8310.0000 -167.40287 -157.34380 10.05907 3.00549 -157.91679 1141.59529
8315.0000 -166.98636 -156.28517 10.70119 3.05844 -157.00880 1158.08424
8320.0000 -164.75834 -154.82836 9.92998 3.11079 -156.11115 1222.78335
8325.0000 -168.59514 -156.49459 12.10056 3.21515 -154.32191 1255.14307
8330.0000 -170.09840 -158.36097 11.73743 3.00001 -158.01073 1130.17488
8335.0000 -166.68521 -156.22889 10.45632 2.99329 -158.12602 1139.34655
8340.0000 -165.19775 -154.71761 10.48014 3.17465 -155.01622 1262.04292
8345.0000 -167.56309 -156.25398 11.30911 3.24849 -153.75016 1305.62251
8350.0000 -166.66373 -155.72285 10.94088 3.14144 -155.58573 1218.43996
8355.0000 -168.44173 -157.99539 10.44634 3.10569 -156.19869 1180.32701
8360.0000 -164.53219 -154.96978 9.56241 3.07237 -156.77008 1191.11125
8365.0000 -164.54647 -155.34897 9.19750 3.17909 -154.94023 1221.30991
8370.0000 -166.23980 -155.36128 10.87852 3.15193 -155.40587 1217.77552
8375.0000 -167.01700 -153.83561 13.18139 3.21544 -154.31680 1247.96892
8380.0000 -165.24237 -152.59306 12.64930 3.24245 -153.85376 1272.03413
8385.0000 -165.71870 -152.56601 13.15269 3.26046 -153.54501 1333.49886
8390.0000 -164.02341 -150.78733 13.23608 3.33291 -152.30264 1332.89522
8395.0000 -164.98398 -153.87535 11.10864 3.32004 -152.52344 1322.45564
8400.0000 -167.07798 -155.85989 11.21809 3.18767 -154.79304 1251.05114
8405.0000 -168.77971 -156.54759 12.23211 3.05751 -157.02474 1164.72973
8410.0000 -165.62375 -156.10859 9.51516 3.15680 -155.32227 1240.84130
8415.0000 -165.47869 -155.45536 10.02333 3.14601 -155.50731 1188.14078
8420.0000 -166.06953 -154.73191 11.33762 3.18491 -154.84031 1247.72803
8425.0000 -168.63285 -159.08348 9.54936 3.06369 -156.91878 1124.20967
8430.0000 -165.77597 -155.28911 10.48686 3.00003 -158.01036 1105.22581
8435.0000 -166.55319 -154.77791 11.77528 3.16914 -155.11080 1236.65916
8440.0000 -164.70745 -154.46494 10.24251 3.17362 -155.03388 1235.21815
8445.0000 -164.96179 -154.85936 10.10243 3.19549 -154.65896 1284.78182
8450.0000 -166.17053 -154.47606 11.69447 3.13396 -155.71397 1206.38140
8455.0000 -165.25602 -156.61999 8.63604 3.08103 -156.62149 1127.49950
8460.0000 -167.19602 -156.02572 11.17030 3.04930 -157.16557 1124.00426
8465.0000 -168.44160 -156.37072 12.07088 3.13948 -155.61934 1242.64659
8470.0000 -165.82861 -153.92468 11.90393 3.18079 -154.91092 1239.40656
8475.0000 -167.05127 -156.82277 10.22850 3.10605 -156.19246 1196.14371
8480.0000 -167.41468 -157.76229 9.65239 3.06262 -156.93716 1162.92203
8485.0000 -165.16858 -154.47680 10.69178 3.21308 -154.35729 1276.29040
8490.0000 -168.02911 -156.05178 11.97733 3.14933 -155.45043 1225.03303
8495.0000 -166.62160 -157.02114 9.60046 3.08393 -156.57184 1152.62457
8500.0000 -167.41148 -157.31688 10.09460 3.04322 -157.26990 1141.47998
MELTING PROCESS: loop number 35 T-loop= 1188.0000000000000
main_MD> interactions number 35 at Temperature= 1188.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.81463 -2.58889 2.11252
force_rgl> df(natom) -3.29964 2.76762 -0.13391
8505.0000 -168.34784 -158.67244 9.67539 2.96580 -158.59731 1092.03765
8510.0000 -170.89239 -160.64472 10.24767 2.97260 -158.48065 1088.68127
8515.0000 -167.43625 -158.14981 9.28644 2.93013 -159.20893 1060.87675
8520.0000 -166.95273 -157.22204 9.73069 3.00563 -157.91430 1151.13213
8525.0000 -167.11445 -155.24069 11.87376 3.11085 -156.11015 1181.56010
8530.0000 -165.57439 -156.69826 8.87613 3.09976 -156.30037 1198.12902
8535.0000 -166.70718 -155.56017 11.14701 3.11080 -156.11101 1182.42004
8540.0000 -165.71911 -153.65505 12.06406 3.18152 -154.89841 1243.16922
8545.0000 -166.45066 -156.31931 10.13136 3.18121 -154.90382 1273.36118
8550.0000 -166.63599 -154.75985 11.87613 3.13643 -155.67164 1226.94020
8555.0000 -167.49897 -153.89769 13.60128 3.17420 -155.02403 1229.68804
8560.0000 -165.52034 -154.15783 11.36251 3.24651 -153.78421 1308.16281
8565.0000 -165.48130 -153.48601 11.99529 3.22931 -154.07909 1280.53027
8570.0000 -167.32601 -156.02438 11.30163 3.19102 -154.73551 1249.41066
8575.0000 -165.66499 -152.80324 12.86175 3.20990 -154.41191 1250.39487
8580.0000 -166.90427 -154.92071 11.98357 3.23729 -153.94219 1284.59819
8585.0000 -166.92302 -154.93041 11.99261 3.11566 -156.02771 1191.52763
8590.0000 -165.58524 -155.41468 10.17055 3.10674 -156.18070 1202.40243
8595.0000 -167.96796 -156.14758 11.82038 3.18591 -154.82328 1242.57303
8600.0000 -167.72584 -156.92324 10.80260 3.06111 -156.96302 1154.09595
8605.0000 -168.37450 -157.84069 10.53381 2.98420 -158.28186 1103.75138
8610.0000 -165.61624 -155.88574 9.73050 3.05235 -157.11328 1149.74300
8615.0000 -167.13231 -156.21010 10.92220 3.18015 -154.92194 1223.67269
8620.0000 -166.68392 -156.16911 10.51481 3.20314 -154.52778 1239.14010
8625.0000 -167.03106 -155.13752 11.89354 3.14486 -155.52699 1192.75457
8630.0000 -166.31259 -155.89213 10.42046 3.11700 -156.00471 1189.46113
8635.0000 -165.67927 -153.96041 11.71886 3.08331 -156.58249 1155.02910
8640.0000 -166.18483 -154.40371 11.78112 3.22157 -154.21171 1271.64600
8645.0000 -166.31069 -156.83017 9.48052 3.15583 -155.33905 1220.56855
8650.0000 -165.56840 -156.19175 9.37665 3.07482 -156.72797 1134.28542
8655.0000 -166.66846 -157.07515 9.59332 3.13939 -155.62085 1174.31241
8660.0000 -166.78243 -155.60545 11.17698 3.10271 -156.24974 1194.46294
8665.0000 -167.01343 -157.01724 9.99620 3.09469 -156.38722 1179.84832
8670.0000 -167.30473 -156.51413 10.79060 3.02618 -157.56200 1132.22750
8675.0000 -169.13880 -158.37620 10.76260 3.06320 -156.92721 1156.78480
8680.0000 -170.48872 -160.93639 9.55232 2.91225 -159.51551 1068.96471
8685.0000 -168.05072 -159.23403 8.81669 2.88358 -160.00704 1044.53371
8690.0000 -168.30208 -156.76902 11.53306 2.93483 -159.12836 1058.66738
8695.0000 -166.31330 -154.83933 11.47397 3.13226 -155.74313 1195.52285
8700.0000 -168.61342 -155.49572 13.11769 3.17405 -155.02662 1248.60069
8705.0000 -166.58542 -155.21305 11.37237 3.22225 -154.20007 1271.69316
8710.0000 -166.68311 -154.00207 12.68104 3.18889 -154.77210 1209.43908
8715.0000 -163.52541 -152.23606 11.28934 3.30713 -152.74470 1330.36216
8720.0000 -168.24973 -155.92013 12.32960 3.22952 -154.07537 1273.05065
8725.0000 -168.52871 -157.23860 11.29011 3.09732 -156.34227 1208.15260
8730.0000 -168.21383 -156.73160 11.48222 3.08673 -156.52381 1162.81241
8735.0000 -166.63092 -155.24001 11.39091 3.10714 -156.17374 1174.68257
8740.0000 -167.18394 -156.91576 10.26817 3.08582 -156.53934 1188.63853
8745.0000 -168.80451 -156.38569 12.41883 3.12735 -155.82733 1207.32477
8750.0000 -164.24555 -155.22363 9.02192 3.12416 -155.88198 1186.26989
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 13.8393367 [s].
main_MD> Deallocating global variables
Reference in New Issue View Git Blame Copy Permalink