tmlkyza
/
nanoparticlesims
1
0
Fork 0
Code Issues Pull Requests Packages Projects Releases Wiki Activity
nanoparticlesims/growth_Melting_Silver_ICO_3269/meltingSims/run_75/melt.log

2034 lines
201 KiB
Plaintext
Raw Blame History

main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_75.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 = 75 ntipo2 = 0
read_input> Finish reading input
main_MD> Allocating global variables
main_MD> Number of outputs that will be created: 1800
main_MD> Size of nv and nvoiz: 75 7500
main_MD> Size of nv and nvoiz: 75 7500
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 = 75
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> 1.5129337695239447E-002 1.0666113577801848E-002 7.1841465714346381E-002 initial drift of cluster / NP1 for coalescence
init> 0.27491394234225436 0.32390251093618294 0.31375254027932975 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8471768148725833E-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) 1.15032 0.86018 2.23030
force_rgl> df(natom) -2.56537 0.94110 0.86307
preparo> THERMALIZATION PROCESS AT 295.07677554744640
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -190.39169658752863 2.3358233388125123 -192.72751992634113 3.6831304830184136E-004
preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
main_MD> Time-loop is starting for melting
main_MD> Now the computation of EXECUTION TIME starts
main_MD> Running from loop 1 to 36
MELTING PROCESS: loop number 1 T-loop= 321.00000000000000
main_MD> interactions number 1 at Temperature= 321.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.01799 -0.91128 -1.20360
force_rgl> df(natom) -0.05699 0.36196 0.39555
5.0000 -192.49725 -189.12404 3.37321 1.78375 -189.52698 301.58313
10.0000 -192.39317 -189.16662 3.22655 1.79098 -189.39839 307.94445
15.0000 -192.71939 -189.79607 2.92332 1.80037 -189.23141 319.01627
20.0000 -192.36851 -189.06386 3.30465 1.80220 -189.19875 318.54443
25.0000 -191.87744 -188.74536 3.13208 1.81508 -188.96975 329.26324
30.0000 -191.77284 -188.77823 2.99462 1.81428 -188.98392 332.54583
35.0000 -192.86837 -189.97311 2.89526 1.79792 -189.27489 319.74911
40.0000 -192.85157 -189.76337 3.08821 1.79264 -189.36889 310.11944
45.0000 -192.42230 -189.21766 3.20464 1.79884 -189.25862 320.59745
50.0000 -192.71257 -189.66907 3.04350 1.79113 -189.39564 311.01875
55.0000 -192.52975 -189.66480 2.86495 1.78898 -189.43394 310.59938
60.0000 -192.10773 -188.57299 3.53474 1.81078 -189.04623 330.05137
65.0000 -192.31532 -189.35057 2.96475 1.82174 -188.85140 338.70112
70.0000 -191.53387 -188.42868 3.10519 1.79032 -189.41008 313.17021
75.0000 -192.43705 -189.24560 3.19144 1.82727 -188.75300 340.51268
80.0000 -192.12201 -189.01993 3.10208 1.80296 -189.18540 318.34050
85.0000 -192.61383 -189.23109 3.38274 1.80084 -189.22299 320.10327
90.0000 -192.23823 -188.68201 3.55622 1.80839 -189.08872 328.38574
95.0000 -192.12974 -189.05994 3.06981 1.83581 -188.60104 352.31323
100.0000 -192.14163 -188.84065 3.30099 1.80409 -189.16516 322.60216
105.0000 -192.49908 -189.31828 3.18080 1.81445 -188.98106 326.96465
110.0000 -192.49975 -189.83943 2.66032 1.79385 -189.34729 313.28891
115.0000 -192.41088 -189.29398 3.11690 1.79077 -189.40220 310.15771
120.0000 -192.28009 -188.86717 3.41292 1.80694 -189.11455 326.19228
125.0000 -192.53464 -189.23392 3.30073 1.81669 -188.94119 334.17542
130.0000 -192.16561 -189.19444 2.97117 1.79631 -189.30360 316.73983
135.0000 -191.81707 -189.06732 2.74975 1.79078 -189.40187 308.41413
140.0000 -192.11432 -189.10128 3.01304 1.81762 -188.92463 329.49557
145.0000 -192.18003 -189.20847 2.97156 1.81669 -188.94118 326.27611
150.0000 -192.05932 -189.37285 2.68647 1.81159 -189.03192 324.76005
155.0000 -192.58059 -190.06634 2.51426 1.77813 -189.62694 298.07071
160.0000 -192.71835 -188.90829 3.81006 1.78342 -189.53275 306.72670
165.0000 -192.07008 -188.70002 3.37006 1.83905 -188.54339 353.14844
170.0000 -192.38087 -189.17793 3.20295 1.82229 -188.84159 335.74589
175.0000 -192.32532 -189.35760 2.96772 1.79964 -189.24428 317.09474
180.0000 -192.30854 -189.17885 3.12969 1.79184 -189.38316 311.21798
185.0000 -191.91062 -188.83270 3.07792 1.81573 -188.95829 330.66375
190.0000 -192.56111 -189.44647 3.11464 1.81962 -188.88896 333.11041
195.0000 -192.71901 -188.96093 3.75808 1.79658 -189.29870 317.96194
200.0000 -191.70118 -188.61362 3.08756 1.83720 -188.57630 351.30824
205.0000 -191.63952 -188.35250 3.28703 1.84228 -188.48607 354.65190
210.0000 -192.16836 -189.16395 3.00441 1.81988 -188.88444 326.81047
215.0000 -192.21157 -188.97857 3.23301 1.82310 -188.82710 337.47040
220.0000 -192.48545 -189.06492 3.42053 1.81770 -188.92321 334.23929
225.0000 -191.90518 -188.75095 3.15423 1.81614 -188.95093 330.49976
230.0000 -192.08133 -188.68836 3.39297 1.82511 -188.79136 343.16336
235.0000 -192.52016 -189.65484 2.86532 1.80392 -189.16825 320.39951
240.0000 -192.33100 -188.89564 3.43536 1.79616 -189.30632 315.56256
245.0000 -191.91956 -189.25651 2.66306 1.79649 -189.30038 318.57039
250.0000 -192.48741 -189.58996 2.89745 1.80377 -189.17096 325.26855
MELTING PROCESS: loop number 2 T-loop= 346.00000000000000
main_MD> interactions number 2 at Temperature= 346.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.59567 -0.09479 0.24452
force_rgl> df(natom) 0.26695 0.86814 1.63935
255.0000 -192.10835 -188.45358 3.65477 1.80564 -189.13770 321.62789
260.0000 -191.88130 -188.44503 3.43627 1.84656 -188.40998 352.31109
265.0000 -192.22676 -189.35047 2.87629 1.79523 -189.32283 318.07889
270.0000 -192.75435 -189.95118 2.80317 1.79023 -189.41172 312.81477
275.0000 -192.17732 -189.27387 2.90345 1.79575 -189.31359 311.52114
280.0000 -192.69222 -189.39670 3.29552 1.79945 -189.24769 316.68358
285.0000 -192.49909 -189.49294 3.00615 1.80684 -189.11638 324.45808
290.0000 -192.24247 -188.85790 3.38457 1.77718 -189.64375 296.35040
295.0000 -192.51909 -189.60538 2.91370 1.78684 -189.47195 307.74522
300.0000 -192.40494 -189.50671 2.89823 1.79675 -189.29584 317.64594
305.0000 -192.43583 -189.16952 3.26631 1.78540 -189.49766 308.90778
310.0000 -192.31862 -189.03837 3.28025 1.82214 -188.84416 337.60991
315.0000 -191.88534 -188.81171 3.07363 1.81988 -188.88437 336.25400
320.0000 -192.17075 -188.75860 3.41214 1.83024 -188.70015 348.38309
325.0000 -192.15146 -189.15503 2.99642 1.82819 -188.73670 341.49759
330.0000 -192.26967 -188.70637 3.56330 1.81941 -188.89274 336.14640
335.0000 -191.57466 -188.24035 3.33431 1.86005 -188.17004 369.88312
340.0000 -191.19421 -187.98790 3.20632 1.84527 -188.43294 353.82925
345.0000 -191.80645 -188.67525 3.13120 1.86049 -188.16223 371.21037
350.0000 -192.62711 -189.32442 3.30269 1.81404 -188.98828 328.99186
355.0000 -192.33598 -188.77493 3.56105 1.81497 -188.97174 331.64625
360.0000 -191.96498 -188.29357 3.67141 1.84252 -188.48175 353.55762
365.0000 -192.12891 -189.11189 3.01702 1.82340 -188.82189 340.99629
370.0000 -192.11418 -188.87214 3.24204 1.82170 -188.85211 337.63206
375.0000 -191.66506 -187.95381 3.71124 1.83467 -188.62140 346.97267
380.0000 -192.29063 -189.03085 3.25979 1.84609 -188.41831 358.56052
385.0000 -191.79224 -188.54184 3.25040 1.83495 -188.61648 346.42036
390.0000 -191.92208 -188.34163 3.58045 1.83974 -188.53128 350.06995
395.0000 -191.30078 -187.43983 3.86095 1.87164 -187.96385 372.83465
400.0000 -191.10800 -188.11150 2.99650 1.88360 -187.75111 375.81894
405.0000 -191.71934 -188.09859 3.62075 1.87333 -187.93382 373.24095
410.0000 -191.11815 -187.81090 3.30726 1.87303 -187.93916 374.67890
415.0000 -191.98878 -188.40141 3.58737 1.84790 -188.38609 350.20959
420.0000 -191.38545 -188.21073 3.17472 1.86293 -188.11880 366.85959
425.0000 -191.53963 -188.34065 3.19898 1.84219 -188.48757 348.48662
430.0000 -191.78476 -188.04821 3.73655 1.85136 -188.32462 360.86319
435.0000 -192.09804 -188.59078 3.50726 1.85003 -188.34822 360.14478
440.0000 -192.18484 -188.86146 3.32338 1.84483 -188.44064 354.72684
445.0000 -192.43151 -189.16048 3.27103 1.80967 -189.06596 326.27848
450.0000 -191.87938 -188.46248 3.41691 1.83076 -188.69094 342.88715
455.0000 -191.69163 -187.66088 4.03076 1.85747 -188.21592 366.80965
460.0000 -191.57052 -188.28990 3.28063 1.86321 -188.11374 372.41832
465.0000 -191.23008 -187.85361 3.37647 1.83725 -188.57548 342.04649
470.0000 -191.78655 -188.20196 3.58459 1.87232 -187.95176 374.19524
475.0000 -191.74819 -188.16569 3.58250 1.86243 -188.12763 368.74404
480.0000 -191.75618 -188.63739 3.11880 1.83885 -188.54709 352.21935
485.0000 -192.56859 -189.11104 3.45755 1.83297 -188.65160 345.32360
490.0000 -191.62272 -188.58761 3.03511 1.82619 -188.77214 342.61969
495.0000 -192.54147 -189.44317 3.09830 1.81049 -189.05140 328.47366
500.0000 -192.07249 -188.82534 3.24715 1.80064 -189.22650 319.55716
MELTING PROCESS: loop number 3 T-loop= 371.00000000000000
main_MD> interactions number 3 at Temperature= 371.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.06046 2.30907 -2.66195
force_rgl> df(natom) -0.57834 0.16655 -1.13717
505.0000 -192.25042 -189.09146 3.15896 1.79642 -189.30155 318.47980
510.0000 -191.25710 -187.33233 3.92477 1.85520 -188.25617 366.44227
515.0000 -191.71881 -187.95929 3.75952 1.89248 -187.59332 388.48883
520.0000 -192.14721 -188.47860 3.66862 1.85925 -188.18418 360.46572
525.0000 -191.72673 -188.45589 3.27083 1.83788 -188.56425 349.83626
530.0000 -192.05809 -188.16444 3.89365 1.83656 -188.58776 346.71188
535.0000 -191.80267 -188.52659 3.27608 1.87944 -187.82511 376.42161
540.0000 -191.71715 -188.16230 3.55485 1.84520 -188.43410 351.61968
545.0000 -191.34165 -187.31459 4.02706 1.88814 -187.67043 389.45637
550.0000 -191.69988 -187.91518 3.78470 1.89057 -187.62730 384.92144
555.0000 -191.89509 -188.42735 3.46774 1.86653 -188.05467 368.33053
560.0000 -191.37635 -187.65581 3.72055 1.86283 -188.12058 364.73616
565.0000 -191.96557 -188.67470 3.29087 1.87493 -187.90530 375.13712
570.0000 -191.57262 -188.28986 3.28277 1.83924 -188.54006 343.80259
575.0000 -191.83834 -188.25862 3.57972 1.85593 -188.24334 356.38997
580.0000 -191.51675 -188.50950 3.00725 1.84742 -188.39462 351.35217
585.0000 -191.61292 -188.33308 3.27983 1.86026 -188.16630 366.32009
590.0000 -191.68097 -188.22140 3.45957 1.85054 -188.33905 356.17895
595.0000 -192.07426 -188.66745 3.40682 1.83367 -188.63919 341.68195
600.0000 -191.83364 -188.17303 3.66061 1.84380 -188.45907 352.52861
605.0000 -191.16563 -187.75571 3.40992 1.85503 -188.25932 361.18500
610.0000 -191.76688 -187.86563 3.90125 1.87895 -187.83395 378.53341
615.0000 -191.57575 -188.06202 3.51373 1.87542 -187.89670 374.63394
620.0000 -191.86765 -187.91827 3.94937 1.87038 -187.98633 370.82847
625.0000 -191.26196 -188.05559 3.20638 1.88118 -187.79425 385.59067
630.0000 -191.44337 -188.05314 3.39023 1.87164 -187.96380 377.04003
635.0000 -191.33263 -187.43483 3.89780 1.88395 -187.74491 386.50635
640.0000 -190.81304 -187.25956 3.55348 1.90614 -187.35029 403.37686
645.0000 -192.17297 -188.33212 3.84084 1.88123 -187.79338 375.72909
650.0000 -191.20233 -186.78782 4.41450 1.87209 -187.95586 372.24820
655.0000 -191.12130 -187.17503 3.94627 1.92009 -187.10217 410.00039
660.0000 -190.46637 -186.61950 3.84687 1.93997 -186.74862 425.49001
665.0000 -191.81349 -188.07288 3.74061 1.92531 -187.00948 411.24340
670.0000 -191.68629 -187.69246 3.99383 1.86586 -188.06664 368.90245
675.0000 -191.22443 -188.06216 3.16227 1.87784 -187.85354 380.21805
680.0000 -191.83404 -188.29760 3.53644 1.84331 -188.46774 348.91154
685.0000 -191.82106 -188.82408 2.99698 1.85372 -188.28251 357.06776
690.0000 -191.17411 -188.02942 3.14469 1.83226 -188.66423 340.60211
695.0000 -191.29462 -187.35034 3.94428 1.87340 -187.93266 372.35921
700.0000 -191.56613 -187.22932 4.33681 1.88250 -187.77075 386.17130
705.0000 -191.26742 -187.26666 4.00076 1.90437 -187.38177 395.64792
710.0000 -191.32261 -187.77708 3.54553 1.90104 -187.44096 403.30190
715.0000 -191.75360 -187.81980 3.93379 1.88422 -187.74019 382.90908
720.0000 -191.84205 -188.66290 3.17915 1.84840 -188.37721 355.68871
725.0000 -192.12318 -188.55832 3.56486 1.87383 -187.92488 368.68766
730.0000 -191.74780 -188.01210 3.73570 1.85285 -188.29798 357.17497
735.0000 -191.95196 -188.32772 3.62423 1.86825 -188.02419 369.09388
740.0000 -191.35156 -187.49651 3.85505 1.85752 -188.21502 368.11102
745.0000 -191.44164 -187.10720 4.33444 1.89917 -187.47435 397.73945
750.0000 -191.51261 -188.10075 3.41186 1.88414 -187.74161 389.64710
MELTING PROCESS: loop number 4 T-loop= 396.00000000000000
main_MD> interactions number 4 at Temperature= 396.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.37799 0.27077 0.55737
force_rgl> df(natom) -0.79982 -0.82856 -1.08842
755.0000 -191.33822 -187.28084 4.05738 1.88290 -187.76358 384.42315
760.0000 -191.57085 -187.67173 3.89912 1.88585 -187.71114 382.12020
765.0000 -191.24876 -187.76293 3.48583 1.87206 -187.95643 377.34589
770.0000 -192.27930 -188.65014 3.62915 1.87689 -187.87060 384.52114
775.0000 -191.64100 -187.82893 3.81207 1.84705 -188.40123 358.79584
780.0000 -191.92904 -188.34104 3.58800 1.86750 -188.03751 372.93097
785.0000 -190.65843 -186.57561 4.08281 1.89570 -187.53593 394.59356
790.0000 -190.13538 -186.03455 4.10083 1.95800 -186.42794 445.59649
795.0000 -191.49576 -187.92803 3.56774 1.92469 -187.02044 417.07286
800.0000 -192.31248 -188.50419 3.80830 1.86832 -188.02289 376.50096
805.0000 -192.00558 -188.60779 3.39779 1.84470 -188.44303 353.56468
810.0000 -191.45304 -188.03966 3.41338 1.86251 -188.12618 374.90845
815.0000 -191.14559 -187.34467 3.80093 1.90193 -187.42520 404.32382
820.0000 -190.82541 -186.12687 4.69854 1.93541 -186.82983 426.68320
825.0000 -191.51367 -187.37560 4.13807 1.94311 -186.69278 435.56260
830.0000 -191.14789 -187.17831 3.96958 1.93878 -186.76976 427.63246
835.0000 -190.68684 -186.83923 3.84761 1.92674 -186.98395 409.21345
840.0000 -191.41300 -187.87198 3.54102 1.92164 -187.07472 407.15248
845.0000 -191.50319 -187.80354 3.69965 1.88742 -187.68331 382.93237
850.0000 -191.36345 -187.81714 3.54631 1.88954 -187.64560 385.74986
855.0000 -190.61648 -186.70493 3.91155 1.91316 -187.22542 414.07315
860.0000 -190.67203 -186.55722 4.11481 1.92664 -186.98574 419.43230
865.0000 -191.21362 -187.45684 3.75678 1.90150 -187.43279 399.21590
870.0000 -191.80294 -187.98927 3.81367 1.90766 -187.32327 405.90343
875.0000 -192.21339 -188.47751 3.73588 1.87478 -187.90805 382.68592
880.0000 -191.15168 -187.42932 3.72236 1.87271 -187.94479 373.52119
885.0000 -191.94757 -188.49347 3.45410 1.86113 -188.15083 370.40541
890.0000 -191.46875 -186.71841 4.75034 1.88780 -187.67655 393.44147
895.0000 -191.31493 -187.46610 3.84884 1.90871 -187.30468 399.82821
900.0000 -190.95032 -187.03320 3.91713 1.90617 -187.34980 394.63976
905.0000 -191.09366 -187.05225 4.04140 1.91699 -187.15742 415.60636
910.0000 -191.17752 -186.98676 4.19076 1.90898 -187.29981 414.03248
915.0000 -190.99353 -187.65451 3.33902 1.89821 -187.49138 399.86525
920.0000 -191.20269 -187.18814 4.01455 1.91173 -187.25098 413.47031
925.0000 -191.49183 -186.94323 4.54860 1.93600 -186.81925 435.19796
930.0000 -191.42821 -187.71983 3.70837 1.91439 -187.20351 412.00384
935.0000 -191.26009 -187.43248 3.82760 1.90009 -187.45796 401.74212
940.0000 -191.77818 -188.10668 3.67150 1.88144 -187.78958 384.02778
945.0000 -191.66309 -188.29631 3.36678 1.84288 -188.47530 354.84331
950.0000 -191.40007 -188.08255 3.31753 1.86873 -188.01562 376.14637
955.0000 -191.67033 -188.28422 3.38610 1.87554 -187.89444 380.88170
960.0000 -190.83731 -187.14122 3.69609 1.90152 -187.43248 403.48049
965.0000 -191.32668 -187.52593 3.80074 1.90779 -187.32105 403.29606
970.0000 -191.20431 -186.60997 4.59435 1.92997 -186.92645 421.60684
975.0000 -190.85360 -186.59649 4.25711 1.93771 -186.78893 420.03644
980.0000 -190.92230 -186.67039 4.25191 1.93108 -186.90675 409.17947
985.0000 -190.10408 -186.69631 3.40777 1.95412 -186.49710 419.82691
990.0000 -190.86359 -187.74824 3.11535 1.92360 -187.03983 388.24507
995.0000 -191.42959 -187.50074 3.92885 1.88614 -187.70601 382.44804
1000.0000 -191.28815 -187.40965 3.87849 1.89624 -187.52635 393.42815
MELTING PROCESS: loop number 5 T-loop= 421.00000000000000
main_MD> interactions number 5 at Temperature= 421.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.23681 -2.27461 1.64562
force_rgl> df(natom) 3.29218 -0.43329 -0.39041
1005.0000 -190.98260 -186.94945 4.03315 1.90235 -187.41774 397.39623
1010.0000 -191.52798 -188.29945 3.22853 1.88732 -187.68493 383.77864
1015.0000 -191.42002 -188.21372 3.20630 1.84831 -188.37872 347.84298
1020.0000 -190.74399 -187.04760 3.69639 1.87451 -187.91286 374.56845
1025.0000 -190.99501 -187.40834 3.58667 1.93098 -186.90847 410.26807
1030.0000 -190.53682 -186.80405 3.73277 1.91783 -187.14234 405.14289
1035.0000 -190.45706 -185.97864 4.47842 1.95446 -186.49089 437.58209
1040.0000 -190.56490 -185.75386 4.81104 1.98555 -185.93812 461.09694
1045.0000 -190.95484 -187.05653 3.89831 1.95558 -186.47113 440.30035
1050.0000 -190.95621 -187.18834 3.76788 1.93510 -186.83524 425.33842
1055.0000 -190.93733 -186.81210 4.12523 1.93055 -186.91628 412.93719
1060.0000 -191.77486 -188.19352 3.58133 1.91050 -187.27282 396.34151
1065.0000 -191.97933 -187.96769 4.01164 1.87025 -187.98864 371.04661
1070.0000 -192.02253 -187.38803 4.63449 1.87994 -187.81626 380.50793
1075.0000 -190.56214 -186.93056 3.63158 1.91561 -187.18189 404.44520
1080.0000 -191.24521 -187.55572 3.68949 1.90893 -187.30076 397.41074
1085.0000 -191.39392 -187.42027 3.97365 1.91502 -187.19236 405.84478
1090.0000 -191.41241 -187.10019 4.31222 1.93313 -186.87027 408.88156
1095.0000 -191.14036 -187.16338 3.97698 1.89847 -187.48667 392.14072
1100.0000 -191.37846 -186.88313 4.49533 1.90601 -187.35262 393.80652
1105.0000 -190.71502 -186.57887 4.13614 1.92260 -187.05760 405.93040
1110.0000 -190.59927 -185.93030 4.66898 1.97142 -186.18935 446.04413
1115.0000 -190.20097 -185.96145 4.23952 1.98605 -185.92923 437.09150
1120.0000 -190.36055 -185.99714 4.36340 1.99019 -185.85558 454.56703
1125.0000 -190.05111 -186.57870 3.47241 1.99912 -185.69671 471.13996
1130.0000 -190.43949 -186.47575 3.96374 1.94753 -186.61414 425.33038
1135.0000 -191.13954 -187.02052 4.11902 1.94505 -186.65824 415.24855
1140.0000 -190.40141 -186.71367 3.68773 1.95157 -186.54245 416.74492
1145.0000 -190.78981 -186.51115 4.27866 1.94503 -186.65865 402.44062
1150.0000 -190.59962 -186.89879 3.70084 1.93070 -186.91359 406.20561
1155.0000 -190.86008 -186.77269 4.08739 1.95500 -186.48146 432.76698
1160.0000 -190.65314 -186.85303 3.80011 1.93858 -186.77346 417.84725
1165.0000 -190.79850 -186.88256 3.91594 1.93205 -186.88946 412.38524
1170.0000 -190.77544 -187.33650 3.43895 1.92377 -187.03685 408.53424
1175.0000 -191.03021 -187.22728 3.80293 1.91842 -187.13189 402.47679
1180.0000 -191.08240 -186.62526 4.45713 1.93569 -186.82472 421.32783
1185.0000 -190.67382 -186.33651 4.33731 1.94988 -186.57249 426.66962
1190.0000 -190.59335 -186.18185 4.41150 1.94017 -186.74519 407.69651
1195.0000 -191.32304 -187.18536 4.13768 1.96168 -186.36263 427.81477
1200.0000 -190.73513 -186.44884 4.28629 1.94320 -186.69130 408.41869
1205.0000 -190.42999 -187.10793 3.32206 1.94551 -186.65021 410.87905
1210.0000 -190.80179 -186.66623 4.13556 1.93722 -186.79758 412.70758
1215.0000 -190.84542 -186.96797 3.87744 1.95839 -186.42112 422.81929
1220.0000 -190.05878 -186.21084 3.84794 1.93610 -186.81757 394.21099
1225.0000 -189.83368 -186.03245 3.80123 1.97015 -186.21186 432.23884
1230.0000 -189.71697 -185.99556 3.72142 1.97181 -186.18244 431.26053
1235.0000 -189.54400 -185.69964 3.84436 2.00592 -185.57580 453.36913
1240.0000 -190.56407 -185.80264 4.76142 1.97624 -186.10359 434.54303
1245.0000 -190.68855 -186.91896 3.76959 1.96839 -186.24330 428.97214
1250.0000 -190.11490 -185.80706 4.30784 1.94853 -186.59638 399.89352
MELTING PROCESS: loop number 6 T-loop= 446.00000000000000
main_MD> interactions number 6 at Temperature= 446.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.30064 2.39234 -5.34230
force_rgl> df(natom) -0.29204 1.50308 -2.45762
1255.0000 -189.62027 -185.00183 4.61845 2.02007 -185.32411 456.05588
1260.0000 -189.76955 -185.53843 4.23111 2.00721 -185.55285 462.16569
1265.0000 -189.77582 -185.49597 4.27985 1.98625 -185.92566 438.97544
1270.0000 -189.53209 -185.00663 4.52546 1.99606 -185.75110 449.55445
1275.0000 -190.49054 -186.41517 4.07537 2.00196 -185.64628 447.46591
1280.0000 -190.09490 -185.99179 4.10312 1.96033 -186.38655 413.50121
1285.0000 -189.40613 -185.44901 3.95712 1.98890 -185.87849 438.50276
1290.0000 -190.81785 -186.60307 4.21478 2.00596 -185.57514 449.79466
1295.0000 -190.31062 -186.59284 3.71778 1.95980 -186.39604 410.63480
1300.0000 -190.32239 -186.11956 4.20283 1.95039 -186.56344 404.24305
1305.0000 -190.78389 -186.27762 4.50627 1.99588 -185.75431 443.81028
1310.0000 -190.82579 -186.42415 4.40164 1.95509 -186.47976 406.98178
1315.0000 -190.53128 -185.91080 4.62047 1.97724 -186.08591 444.33542
1320.0000 -190.11467 -185.18774 4.92693 2.01194 -185.46877 475.99622
1325.0000 -190.76603 -185.95898 4.80705 2.00839 -185.53190 465.63918
1330.0000 -189.52871 -185.66309 3.86562 1.99624 -185.74795 449.98819
1335.0000 -189.60431 -185.42438 4.17993 2.02224 -185.28550 470.36362
1340.0000 -190.37145 -186.24407 4.12738 2.00291 -185.62925 459.01340
1345.0000 -190.83911 -186.98896 3.85015 1.95453 -186.48980 416.70635
1350.0000 -190.38677 -186.15590 4.23087 1.94330 -186.68952 408.05465
1355.0000 -190.74598 -187.06622 3.67976 1.96212 -186.35471 425.85955
1360.0000 -190.87221 -186.90380 3.96842 1.93226 -186.88588 401.81136
1365.0000 -190.44638 -186.74826 3.69812 1.92975 -186.93036 404.29740
1370.0000 -190.81880 -186.24277 4.57603 1.95112 -186.55037 411.90899
1375.0000 -190.45349 -186.49045 3.96304 1.97366 -186.14956 432.94937
1380.0000 -189.80778 -185.69985 4.10792 1.98400 -185.96560 446.37474
1385.0000 -191.15385 -186.91880 4.23505 1.97334 -186.15519 450.76515
1390.0000 -190.86418 -186.65109 4.21309 1.95371 -186.50434 436.69327
1395.0000 -190.31876 -186.56567 3.75309 1.95830 -186.42262 434.19384
1400.0000 -190.98138 -186.60893 4.37245 1.97139 -186.18996 438.26631
1405.0000 -190.36216 -186.02259 4.33957 1.94864 -186.59455 422.22722
1410.0000 -190.54788 -186.66814 3.87974 1.97764 -186.07868 455.25226
1415.0000 -190.52952 -186.82580 3.70372 1.92995 -186.92688 415.33249
1420.0000 -190.62135 -186.48959 4.13176 1.95820 -186.42450 425.30851
1425.0000 -190.42562 -185.88176 4.54386 1.96856 -186.24020 446.98732
1430.0000 -190.32807 -186.52902 3.79905 1.98840 -185.88736 447.26865
1435.0000 -190.29685 -186.37074 3.92612 1.93547 -186.82878 422.03841
1440.0000 -190.24950 -186.70310 3.54640 1.96862 -186.23922 450.59929
1445.0000 -190.70265 -186.60340 4.09926 1.93881 -186.76934 420.13658
1450.0000 -190.49012 -185.73967 4.75045 1.97763 -186.07896 456.85278
1455.0000 -191.74078 -187.48581 4.25498 1.96071 -186.37981 450.00412
1460.0000 -190.38755 -186.35109 4.03646 1.94013 -186.74590 435.72122
1465.0000 -190.16958 -186.03937 4.13022 1.97213 -186.17674 459.51200
1470.0000 -189.77752 -185.66981 4.10771 1.96883 -186.23536 455.14408
1475.0000 -190.35567 -185.36775 4.98793 1.99774 -185.72122 467.95445
1480.0000 -190.71781 -185.64498 5.07283 2.01395 -185.43298 487.57581
1485.0000 -191.00452 -185.98461 5.01990 1.99506 -185.76891 477.77218
1490.0000 -189.75513 -185.66225 4.09288 1.97701 -186.08988 444.18301
1495.0000 -191.01432 -186.58725 4.42707 1.96676 -186.27222 440.12331
1500.0000 -189.92215 -186.11177 3.81038 1.96770 -186.25548 458.11939
MELTING PROCESS: loop number 7 T-loop= 471.00000000000000
main_MD> interactions number 7 at Temperature= 471.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.32240 0.89603 0.38604
force_rgl> df(natom) -0.86982 -0.26760 -2.10154
1505.0000 -190.57941 -184.81946 5.75995 2.00153 -185.65381 477.04184
1510.0000 -189.55563 -185.20509 4.35055 2.00945 -185.51301 494.08973
1515.0000 -190.68942 -185.51208 5.17735 2.00044 -185.67322 512.50933
1520.0000 -190.73128 -186.44454 4.28675 1.96870 -186.23773 486.02313
1525.0000 -190.86595 -186.93962 3.92633 1.97520 -186.12204 490.76041
1530.0000 -191.50062 -186.72470 4.77591 1.94447 -186.66871 460.06213
1535.0000 -191.50840 -186.84934 4.65905 1.93833 -186.77778 458.26000
1540.0000 -190.46202 -185.92762 4.53441 1.97503 -186.12517 481.97931
1545.0000 -190.61728 -186.16606 4.45122 2.02866 -185.17135 505.23136
1550.0000 -190.50923 -185.29821 5.21102 1.98935 -185.87054 479.99587
1555.0000 -190.71124 -185.10374 5.60750 2.01786 -185.36340 498.76918
1560.0000 -190.61362 -186.18816 4.42546 2.00226 -185.64085 483.18643
1565.0000 -190.86791 -186.46854 4.39937 1.99100 -185.84116 475.07214
1570.0000 -191.74639 -187.22747 4.51891 1.91442 -187.20303 432.05663
1575.0000 -190.63337 -185.93629 4.69708 2.00097 -185.66380 496.42793
1580.0000 -190.32178 -185.76937 4.55241 1.98960 -185.86608 477.30969
1585.0000 -189.22230 -184.73094 4.49137 2.03773 -185.00999 499.57181
1590.0000 -190.07816 -185.28365 4.79450 2.03138 -185.12297 505.94960
1595.0000 -190.05035 -186.07069 3.97966 2.02046 -185.31728 492.21668
1600.0000 -190.69909 -186.14988 4.54921 1.99683 -185.73740 462.78759
1605.0000 -190.23877 -185.72548 4.51329 1.96776 -186.25436 432.88508
1610.0000 -190.26662 -186.46466 3.80196 1.99056 -185.84894 452.03219
1615.0000 -190.11965 -185.28315 4.83650 1.96664 -186.27432 426.35173
1620.0000 -189.53721 -184.88498 4.65223 2.03116 -185.12687 469.19702
1625.0000 -190.13248 -185.28580 4.84668 2.06979 -184.43989 493.78222
1630.0000 -188.99147 -185.15960 3.83187 2.01985 -185.32807 452.44166
1635.0000 -189.38469 -184.97795 4.40675 2.02732 -185.19517 448.07698
1640.0000 -189.20118 -184.38344 4.81774 2.05615 -184.68253 486.30056
1645.0000 -188.75803 -183.79029 4.96774 2.09794 -183.93928 515.00268
1650.0000 -189.52691 -184.53023 4.99668 2.07779 -184.29766 518.23385
1655.0000 -190.74493 -185.56312 5.18181 2.02951 -185.15622 479.51193
1660.0000 -188.88580 -184.98986 3.89594 2.01398 -185.43236 467.85648
1665.0000 -189.28308 -184.94207 4.34101 2.02477 -185.24058 450.47049
1670.0000 -189.39895 -184.75660 4.64235 2.04748 -184.83669 475.59969
1675.0000 -189.44887 -185.08486 4.36401 2.05815 -184.64693 486.97587
1680.0000 -189.85096 -184.28365 5.56731 2.04793 -184.82870 490.20604
1685.0000 -189.24997 -184.11745 5.13253 2.05785 -184.65226 494.72095
1690.0000 -189.05081 -184.66696 4.38385 2.05073 -184.77892 487.27728
1695.0000 -189.54729 -185.09010 4.45719 2.04439 -184.89160 482.77156
1700.0000 -188.96572 -184.69552 4.27020 2.06023 -184.60987 482.07147
1705.0000 -188.56673 -184.00521 4.56151 2.08492 -184.17079 496.23833
1710.0000 -188.77972 -184.39557 4.38414 2.11396 -183.65430 491.55068
1715.0000 -189.02212 -184.69545 4.32667 2.09803 -183.93757 490.42792
1720.0000 -188.94668 -183.80190 5.14478 2.08697 -184.13435 492.34753
1725.0000 -189.36949 -184.34614 5.02335 2.07578 -184.33334 496.86550
1730.0000 -189.64245 -184.92515 4.71730 2.07540 -184.34016 487.96456
1735.0000 -188.47553 -184.06835 4.40718 2.09384 -184.01224 503.48552
1740.0000 -188.65002 -184.14536 4.50466 2.08069 -184.24606 530.01884
1745.0000 -190.25749 -185.46196 4.79553 2.02026 -185.32081 484.72600
1750.0000 -190.04771 -185.40083 4.64688 2.01226 -185.46298 479.32271
MELTING PROCESS: loop number 8 T-loop= 496.00000000000000
main_MD> interactions number 8 at Temperature= 496.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.13373 2.47898 -1.35755
force_rgl> df(natom) 0.34715 -1.53134 1.70961
1755.0000 -190.13023 -185.37330 4.75693 2.02064 -185.31395 484.36115
1760.0000 -189.98813 -185.42613 4.56200 2.04260 -184.92338 510.40714
1765.0000 -189.58824 -185.34825 4.23999 2.06116 -184.59338 526.49691
1770.0000 -189.92572 -185.09200 4.83372 2.02994 -185.14853 507.53342
1775.0000 -189.61503 -185.18065 4.43437 2.03331 -185.08866 499.80554
1780.0000 -189.90136 -185.43513 4.46623 2.00922 -185.51718 477.37504
1785.0000 -189.72178 -185.99674 3.72504 2.00846 -185.53052 471.68574
1790.0000 -190.26831 -185.22201 5.04630 1.99956 -185.68891 456.62219
1795.0000 -189.90474 -185.16694 4.73780 2.05594 -184.68615 508.71299
1800.0000 -190.10327 -185.34897 4.75430 2.03008 -185.14607 477.84230
1805.0000 -191.16684 -186.47687 4.68997 1.96447 -186.31289 454.97157
1810.0000 -190.23250 -185.70254 4.52995 1.99280 -185.80903 487.23642
1815.0000 -190.73400 -185.80255 4.93145 1.99583 -185.75526 490.49837
1820.0000 -191.17366 -186.84963 4.32403 1.95893 -186.41150 460.36682
1825.0000 -190.60183 -185.76345 4.83838 1.97197 -186.17959 473.49288
1830.0000 -190.81702 -185.15933 5.65769 1.99483 -185.77306 485.73097
1835.0000 -190.62816 -185.46110 5.16706 2.02252 -185.28063 493.96649
1840.0000 -189.34446 -184.52108 4.82338 2.04708 -184.84381 505.99681
1845.0000 -188.94152 -184.53514 4.40638 2.06020 -184.61047 508.66901
1850.0000 -189.49368 -183.90546 5.58823 2.06314 -184.55820 516.86976
1855.0000 -189.93548 -184.13479 5.80069 2.07174 -184.40522 515.12655
1860.0000 -189.60734 -184.73197 4.87537 2.02709 -185.19937 476.69486
1865.0000 -189.98087 -185.23118 4.74969 2.02284 -185.27487 471.45792
1870.0000 -190.34288 -185.43035 4.91253 2.00655 -185.56464 479.46662
1875.0000 -190.35336 -185.70402 4.64933 1.99213 -185.82106 478.35538
1880.0000 -189.85293 -185.37423 4.47870 2.02799 -185.18325 513.85933
1885.0000 -189.45689 -184.50394 4.95295 2.04019 -184.96638 512.84654
1890.0000 -190.00441 -185.38468 4.61974 2.04263 -184.92296 520.19014
1895.0000 -190.32605 -185.74054 4.58551 2.00827 -185.53405 478.48078
1900.0000 -190.41839 -185.45675 4.96164 1.99684 -185.73722 482.89320
1905.0000 -190.37423 -185.64613 4.72811 1.98634 -185.92407 479.83432
1910.0000 -189.62073 -185.07925 4.54148 2.01396 -185.43287 495.26408
1915.0000 -189.74389 -185.00575 4.73815 2.01591 -185.39806 484.33528
1920.0000 -189.56434 -184.35869 5.20565 2.02316 -185.26911 494.84631
1925.0000 -190.28337 -184.67825 5.60512 2.07645 -184.32147 541.37657
1930.0000 -190.20398 -184.28939 5.91459 2.05117 -184.77099 508.38726
1935.0000 -189.42681 -184.46639 4.96042 2.07631 -184.32397 521.28372
1940.0000 -189.86587 -185.15074 4.71513 2.03901 -184.98721 486.68445
1945.0000 -190.41748 -185.48811 4.92937 2.03709 -185.02143 476.00031
1950.0000 -188.42889 -183.58196 4.84693 2.07272 -184.38776 489.99947
1955.0000 -187.97975 -182.16992 5.80983 2.15863 -182.85998 530.17940
1960.0000 -187.80854 -182.61872 5.18982 2.15146 -182.98752 525.51400
1965.0000 -188.67761 -183.80930 4.86831 2.12861 -183.39374 491.32806
1970.0000 -188.09102 -182.97643 5.11459 2.11723 -183.59614 505.39949
1975.0000 -189.33678 -183.24091 6.09587 2.10686 -183.78065 494.03043
1980.0000 -189.00907 -184.17049 4.83857 2.10610 -183.79405 500.80961
1985.0000 -190.19038 -185.49319 4.69719 2.04916 -184.80684 476.43418
1990.0000 -189.26570 -184.51966 4.74605 2.04147 -184.94362 493.80185
1995.0000 -191.38916 -185.61455 5.77461 2.03800 -185.00534 501.97931
2000.0000 -191.42049 -186.75421 4.66628 1.97359 -186.15084 474.24881
MELTING PROCESS: loop number 9 T-loop= 521.00000000000000
main_MD> interactions number 9 at Temperature= 521.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.29777 -1.68887 3.32842
force_rgl> df(natom) -0.48155 0.81718 1.15076
2005.0000 -190.57758 -185.96289 4.61469 1.98892 -185.87812 490.59326
2010.0000 -190.75579 -185.92603 4.82977 2.02504 -185.23573 501.43272
2015.0000 -190.88119 -186.40114 4.48005 1.99650 -185.74326 502.92070
2020.0000 -190.02771 -185.51135 4.51636 1.97202 -186.17863 471.56177
2025.0000 -190.46696 -186.51006 3.95690 1.97763 -186.07887 473.11759
2030.0000 -190.46036 -185.92678 4.53357 1.99615 -185.74955 488.64390
2035.0000 -190.77636 -186.33869 4.43767 1.98212 -185.99908 473.77615
2040.0000 -189.71314 -184.02076 5.69237 2.02270 -185.27730 514.41871
2045.0000 -190.80042 -185.54295 5.25747 2.06374 -184.54753 531.92633
2050.0000 -190.82794 -185.59751 5.23043 2.00512 -185.59005 496.38162
2055.0000 -189.69051 -184.58879 5.10172 2.04226 -184.92947 520.55805
2060.0000 -190.00300 -184.78926 5.21375 2.05841 -184.64231 532.30458
2065.0000 -190.62761 -186.16199 4.46561 2.02462 -185.24321 501.59738
2070.0000 -189.43781 -184.67591 4.76190 2.03362 -185.08319 496.92392
2075.0000 -189.21736 -184.35949 4.85787 2.06403 -184.54233 522.71631
2080.0000 -189.61949 -183.51742 6.10207 2.09426 -184.00478 548.19884
2085.0000 -189.51664 -184.81891 4.69773 2.05652 -184.67588 499.13085
2090.0000 -187.94765 -182.32299 5.62466 2.11947 -183.55639 545.25005
2095.0000 -188.41049 -183.75983 4.65066 2.12146 -183.52099 544.77991
2100.0000 -188.36751 -183.90824 4.45926 2.11909 -183.56306 527.30788
2105.0000 -189.00174 -184.24548 4.75626 2.08830 -184.11074 496.96976
2110.0000 -189.71662 -184.90829 4.80834 2.06360 -184.55004 497.06340
2115.0000 -190.23485 -184.29149 5.94336 2.05234 -184.75022 493.78229
2120.0000 -188.36541 -183.18953 5.17588 2.13053 -183.35974 555.38511
2125.0000 -188.48888 -183.46239 5.02648 2.12697 -183.42305 547.27318
2130.0000 -187.85594 -182.83048 5.02545 2.14129 -183.16828 540.11273
2135.0000 -187.84543 -183.09377 4.75166 2.13392 -183.29945 526.87823
2140.0000 -188.69586 -183.53182 5.16405 2.10854 -183.75082 513.11626
2145.0000 -189.36444 -183.88451 5.47993 2.10547 -183.80540 507.66470
2150.0000 -188.03150 -183.45051 4.58099 2.12508 -183.45666 518.51076
2155.0000 -188.42588 -183.74277 4.68312 2.12554 -183.44838 510.39326
2160.0000 -188.92372 -183.90728 5.01644 2.10909 -183.74098 503.17753
2165.0000 -188.83621 -183.85764 4.97857 2.10421 -183.82783 515.86933
2170.0000 -188.21185 -183.11098 5.10087 2.12531 -183.45241 528.68305
2175.0000 -188.30909 -183.17242 5.13667 2.14676 -183.07096 535.15944
2180.0000 -189.51756 -184.14352 5.37404 2.11748 -183.59177 534.37843
2185.0000 -188.69333 -183.34716 5.34617 2.08339 -184.19808 502.74211
2190.0000 -187.92636 -183.12022 4.80613 2.10238 -183.86031 501.31588
2195.0000 -188.69946 -183.97873 4.72073 2.11751 -183.59114 537.24915
2200.0000 -189.02799 -184.35751 4.67049 2.09480 -183.99518 490.85511
2205.0000 -189.09039 -184.22594 4.86445 2.08963 -184.08700 497.95376
2210.0000 -188.59378 -183.71069 4.88309 2.09359 -184.01657 489.57810
2215.0000 -189.00812 -184.79291 4.21521 2.08833 -184.11020 485.27793
2220.0000 -188.72430 -184.10428 4.62001 2.09610 -183.97194 509.00660
2225.0000 -188.51822 -183.01178 5.50644 2.09122 -184.05871 502.26733
2230.0000 -188.97171 -184.05864 4.91307 2.11257 -183.67906 516.98754
2235.0000 -188.74529 -183.74231 5.00298 2.09224 -184.04067 497.15834
2240.0000 -188.82365 -183.90519 4.91846 2.10702 -183.77784 509.37769
2245.0000 -188.66866 -183.72559 4.94307 2.13732 -183.23882 526.26525
2250.0000 -187.97978 -183.39151 4.58826 2.12927 -183.38212 508.19109
MELTING PROCESS: loop number 10 T-loop= 546.00000000000000
main_MD> interactions number 10 at Temperature= 546.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07040 -0.18405 0.20461
force_rgl> df(natom) 2.86779 -0.96210 1.32318
2255.0000 -188.33795 -183.43668 4.90127 2.11386 -183.65618 505.10623
2260.0000 -187.55421 -182.39729 5.15691 2.14812 -183.04680 535.07905
2265.0000 -187.50334 -182.98685 4.51649 2.18071 -182.46731 541.69258
2270.0000 -187.70396 -182.81513 4.88884 2.12640 -183.43318 501.59038
2275.0000 -187.37929 -181.56324 5.81606 2.19363 -182.23741 569.54079
2280.0000 -188.07703 -182.58565 5.49138 2.19069 -182.28979 562.46049
2285.0000 -187.01252 -181.39931 5.61321 2.17491 -182.57046 555.92514
2290.0000 -188.51173 -182.57278 5.93895 2.19093 -182.28540 590.56280
2295.0000 -187.88734 -181.89385 5.99350 2.19771 -182.16498 572.63520
2300.0000 -188.52408 -182.53986 5.98421 2.17468 -182.57452 569.42063
2305.0000 -187.22727 -181.04625 6.18101 2.20500 -182.03524 590.67050
2310.0000 -186.17437 -180.58778 5.58659 2.31135 -180.14387 635.43874
2315.0000 -187.15587 -181.39893 5.75694 2.26264 -181.01024 596.48806
2320.0000 -186.76654 -181.75218 5.01436 2.24966 -181.24104 583.55505
2325.0000 -187.46236 -182.69155 4.77080 2.18139 -182.45507 545.23638
2330.0000 -187.28923 -182.08811 5.20112 2.19865 -182.14825 553.25583
2335.0000 -187.78796 -182.72036 5.06760 2.17671 -182.53845 558.86300
2340.0000 -188.13160 -182.71098 5.42062 2.19056 -182.29203 580.29779
2345.0000 -188.62289 -183.47033 5.15256 2.12826 -183.40007 537.34030
2350.0000 -187.42303 -182.02121 5.40181 2.12169 -183.51692 520.21226
2355.0000 -187.61940 -181.80516 5.81424 2.20098 -182.10678 584.45696
2360.0000 -187.95848 -182.80607 5.15241 2.18985 -182.30461 590.87909
2365.0000 -188.65026 -184.16620 4.48407 2.13511 -183.27814 548.93004
2370.0000 -189.66507 -184.14045 5.52462 2.07086 -184.42088 496.28213
2375.0000 -188.77037 -183.41319 5.35718 2.12371 -183.48097 561.52596
2380.0000 -189.62977 -183.46674 6.16302 2.12422 -183.47186 563.62108
2385.0000 -188.10863 -183.28080 4.82784 2.12566 -183.44635 553.64829
2390.0000 -187.92582 -182.64243 5.28339 2.15862 -182.86003 549.25813
2395.0000 -187.46075 -182.14667 5.31409 2.21663 -181.82833 573.64248
2400.0000 -188.49438 -183.50283 4.99155 2.14766 -183.05504 527.67759
2405.0000 -188.30406 -183.25795 5.04611 2.15828 -182.86615 536.88768
2410.0000 -188.36350 -182.77824 5.58527 2.15380 -182.94588 539.08698
2415.0000 -188.08494 -182.34589 5.73905 2.18845 -182.32963 566.13834
2420.0000 -188.52295 -182.83988 5.68307 2.18673 -182.36022 562.06633
2425.0000 -188.99447 -183.33411 5.66035 2.15494 -182.92549 553.36816
2430.0000 -188.59082 -182.71100 5.87983 2.14066 -183.17945 550.98273
2435.0000 -188.62046 -182.94465 5.67582 2.15083 -182.99857 562.69396
2440.0000 -187.59853 -182.73854 4.85999 2.15796 -182.87181 552.38420
2445.0000 -187.66150 -182.29231 5.36918 2.16058 -182.82515 565.33423
2450.0000 -188.14639 -182.71878 5.42761 2.16054 -182.82590 579.89310
2455.0000 -188.43292 -183.18496 5.24795 2.14621 -183.08078 564.58862
2460.0000 -189.10830 -184.08353 5.02477 2.14022 -183.18732 536.88150
2465.0000 -187.97622 -183.23648 4.73974 2.12132 -183.52338 529.53749
2470.0000 -186.95889 -181.63940 5.31949 2.17157 -182.62978 577.57320
2475.0000 -187.88918 -183.10284 4.78634 2.17922 -182.49372 550.63367
2480.0000 -188.03008 -182.83052 5.19956 2.14484 -183.10521 537.23183
2485.0000 -187.95901 -182.28613 5.67288 2.17761 -182.52240 549.28848
2490.0000 -187.50320 -182.66820 4.83500 2.18379 -182.41248 537.42151
2495.0000 -187.82373 -181.92271 5.90103 2.20029 -182.11897 571.40108
2500.0000 -188.05577 -183.05981 4.99596 2.17283 -182.60742 558.85884
MELTING PROCESS: loop number 11 T-loop= 571.00000000000000
main_MD> interactions number 11 at Temperature= 571.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.47523 1.75235 1.93636
force_rgl> df(natom) -1.71576 4.99157 0.30830
2505.0000 -187.28467 -182.51764 4.76704 2.14787 -183.05130 545.56475
2510.0000 -185.77405 -180.46090 5.31315 2.23557 -181.49163 584.52657
2515.0000 -187.04202 -181.43767 5.60435 2.25533 -181.14020 595.67739
2520.0000 -188.18389 -181.73200 6.45189 2.23560 -181.49096 579.15890
2525.0000 -186.84485 -181.17560 5.66925 2.24791 -181.27218 608.02975
2530.0000 -187.54042 -181.29079 6.24963 2.27553 -180.78085 594.93566
2535.0000 -186.73170 -181.35430 5.37740 2.25262 -181.18840 598.39688
2540.0000 -186.43853 -180.48915 5.94938 2.25791 -181.09427 619.41036
2545.0000 -186.89592 -180.99874 5.89718 2.25793 -181.09400 614.39326
2550.0000 -188.05558 -183.05840 4.99719 2.21542 -181.84989 563.33558
2555.0000 -186.78037 -181.81863 4.96174 2.20523 -182.03108 582.99855
2560.0000 -187.29884 -181.85573 5.44311 2.17551 -182.55964 577.09286
2565.0000 -187.77307 -181.92960 5.84347 2.17960 -182.48694 586.30718
2570.0000 -187.35225 -181.81518 5.53707 2.21616 -181.83672 590.51002
2575.0000 -188.97585 -183.57175 5.40409 2.20307 -182.06949 583.98172
2580.0000 -187.59245 -182.73609 4.85636 2.10006 -183.90155 503.72409
2585.0000 -187.42973 -181.18854 6.24120 2.20941 -181.95677 574.33325
2590.0000 -186.88921 -181.49549 5.39372 2.21399 -181.87529 577.93241
2595.0000 -188.71648 -181.99832 6.71816 2.24741 -181.28107 613.47996
2600.0000 -187.34444 -181.70759 5.63684 2.20294 -182.07191 578.80718
2605.0000 -187.83531 -182.57672 5.25859 2.19987 -182.12645 578.90598
2610.0000 -187.08694 -181.40181 5.68512 2.18252 -182.43504 560.68257
2615.0000 -187.71697 -182.18870 5.52827 2.20954 -181.95448 603.70388
2620.0000 -187.07459 -181.28349 5.79110 2.20778 -181.98587 593.28139
2625.0000 -187.93445 -182.66549 5.26896 2.20339 -182.06382 596.36299
2630.0000 -188.87124 -183.80654 5.06470 2.13767 -183.23265 570.05145
2635.0000 -189.09566 -183.39419 5.70147 2.10749 -183.76939 541.52508
2640.0000 -188.12857 -182.86169 5.26688 2.17512 -182.56661 601.68848
2645.0000 -188.96056 -183.84011 5.12045 2.14447 -183.11176 531.56747
2650.0000 -187.96395 -183.39599 4.56795 2.12374 -183.48036 516.68715
2655.0000 -188.09845 -182.65522 5.44324 2.13406 -183.29689 527.78868
2660.0000 -188.63403 -182.41112 6.22291 2.18157 -182.45199 591.01426
2665.0000 -187.66974 -182.38775 5.28199 2.18403 -182.40811 604.84905
2670.0000 -187.36637 -181.88117 5.48521 2.21410 -181.87340 598.11291
2675.0000 -188.05960 -182.21670 5.84290 2.20048 -182.11556 571.15374
2680.0000 -188.08371 -182.97240 5.11131 2.17094 -182.64104 566.62936
2685.0000 -189.17469 -184.31971 4.85498 2.12055 -183.53709 529.64632
2690.0000 -188.39371 -184.23694 4.15677 2.08434 -184.18117 501.58036
2695.0000 -187.71236 -182.14000 5.57236 2.13498 -183.28046 526.71094
2700.0000 -189.07533 -183.02606 6.04927 2.19191 -182.26796 580.38983
2705.0000 -189.10987 -183.68716 5.42271 2.12856 -183.39465 539.56230
2710.0000 -188.13306 -182.66857 5.46449 2.14860 -183.03836 557.30780
2715.0000 -188.48416 -183.58064 4.90352 2.14790 -183.05068 544.86300
2720.0000 -187.69393 -182.72476 4.96916 2.15481 -182.92779 538.43147
2725.0000 -187.78347 -182.50216 5.28131 2.16273 -182.78703 541.23450
2730.0000 -186.72265 -180.58033 6.14232 2.23772 -181.45327 588.75674
2735.0000 -186.70414 -181.71871 4.98543 2.29199 -180.48814 631.96574
2740.0000 -187.02624 -181.80091 5.22533 2.22888 -181.61057 585.40384
2745.0000 -188.01108 -182.53746 5.47362 2.22651 -181.65278 577.57566
2750.0000 -188.20072 -182.99433 5.20640 2.17591 -182.55262 583.83799
MELTING PROCESS: loop number 12 T-loop= 596.00000000000000
main_MD> interactions number 12 at Temperature= 596.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.95479 2.24559 -0.48690
force_rgl> df(natom) -2.20238 -0.89957 0.04016
2755.0000 -188.02202 -182.33883 5.68319 2.16740 -182.70394 564.59052
2760.0000 -187.97723 -183.65880 4.31843 2.16428 -182.75940 560.91905
2765.0000 -188.70049 -183.44893 5.25156 2.12560 -183.44736 528.86097
2770.0000 -187.78481 -182.85641 4.92840 2.14625 -183.08012 552.44196
2775.0000 -186.99918 -180.14775 6.85143 2.23603 -181.48335 598.87300
2780.0000 -187.93761 -181.59031 6.34730 2.25506 -181.14489 609.47543
2785.0000 -187.41840 -181.70351 5.71489 2.19900 -182.14195 548.51608
2790.0000 -186.56313 -181.66515 4.89798 2.21931 -181.78081 577.31995
2795.0000 -186.77943 -180.71080 6.06863 2.25552 -181.13670 619.88692
2800.0000 -187.69040 -182.02839 5.66201 2.23844 -181.44059 627.02172
2805.0000 -187.48243 -181.16471 6.31771 2.22190 -181.73468 579.83208
2810.0000 -187.76945 -181.67754 6.09191 2.23187 -181.55740 592.74147
2815.0000 -187.94742 -181.03184 6.91558 2.24380 -181.34530 604.91170
2820.0000 -187.18116 -180.66597 6.51519 2.26470 -180.97353 625.15157
2825.0000 -186.18982 -179.68532 6.50450 2.28621 -180.59104 627.50996
2830.0000 -187.21910 -181.04938 6.16971 2.27376 -180.81234 608.52376
2835.0000 -187.58541 -181.39946 6.18595 2.25009 -181.23341 581.76240
2840.0000 -186.77722 -180.15187 6.62535 2.25182 -181.20257 580.59696
2845.0000 -186.74242 -180.55792 6.18450 2.24036 -181.40637 602.91223
2850.0000 -187.22254 -180.70687 6.51566 2.27924 -180.71498 627.51125
2855.0000 -187.26509 -182.07173 5.19336 2.22557 -181.66945 595.02449
2860.0000 -188.12152 -183.03921 5.08231 2.17158 -182.62963 567.71495
2865.0000 -188.37443 -182.31369 6.06074 2.20338 -182.06407 572.44129
2870.0000 -187.42983 -181.62848 5.80135 2.23671 -181.47131 607.30585
2875.0000 -188.36062 -183.39420 4.96643 2.15566 -182.91276 545.45679
2880.0000 -187.79869 -182.41195 5.38674 2.18946 -182.31171 574.82473
2885.0000 -186.73006 -180.72574 6.00432 2.21058 -181.93607 588.99553
2890.0000 -187.23774 -182.01434 5.22340 2.24448 -181.33307 593.68723
2895.0000 -186.03926 -180.97327 5.06599 2.24435 -181.33538 591.18432
2900.0000 -186.32326 -180.57973 5.74353 2.28282 -180.65130 605.80782
2905.0000 -188.32081 -182.45794 5.86287 2.26567 -180.95618 609.17941
2910.0000 -187.23132 -181.12484 6.10648 2.23383 -181.52259 608.85564
2915.0000 -186.53140 -180.64334 5.88806 2.28202 -180.66557 624.99814
2920.0000 -186.77595 -180.98057 5.79538 2.27585 -180.77527 643.80925
2925.0000 -187.14691 -181.30841 5.83851 2.23586 -181.48648 601.82280
2930.0000 -187.55578 -181.56613 5.98965 2.26925 -180.89260 612.91542
2935.0000 -187.29903 -182.07769 5.22134 2.21258 -181.90042 575.79146
2940.0000 -188.51485 -182.18998 6.32487 2.17571 -182.55622 559.21034
2945.0000 -188.24175 -182.12054 6.12121 2.19504 -182.21247 589.39446
2950.0000 -187.64806 -181.63512 6.01294 2.21556 -181.84738 602.59103
2955.0000 -188.97274 -183.82428 5.14847 2.15151 -182.98646 566.03061
2960.0000 -187.60104 -182.25764 5.34340 2.13676 -183.24878 544.95424
2965.0000 -186.88643 -180.72270 6.16373 2.24693 -181.28947 615.17899
2970.0000 -186.32476 -179.88279 6.44197 2.32713 -179.86317 669.90646
2975.0000 -186.54604 -180.57095 5.97509 2.32246 -179.94631 652.36915
2980.0000 -187.08172 -181.24188 5.83985 2.28586 -180.59717 634.40347
2985.0000 -187.27003 -181.81299 5.45704 2.21323 -181.88897 589.74467
2990.0000 -188.00844 -182.46455 5.54389 2.19611 -182.19342 632.50964
2995.0000 -187.96964 -180.93691 7.03273 2.24337 -181.35279 622.83620
3000.0000 -188.55019 -182.83719 5.71300 2.23566 -181.48997 616.41920
MELTING PROCESS: loop number 13 T-loop= 621.00000000000000
main_MD> interactions number 13 at Temperature= 621.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.60205 -4.76465 1.50210
force_rgl> df(natom) -0.42507 -0.25512 -1.34827
3005.0000 -188.27446 -183.09009 5.18437 2.11827 -183.57765 515.31761
3010.0000 -186.95201 -181.02161 5.93040 2.22494 -181.68069 584.92717
3015.0000 -186.29293 -180.91555 5.37738 2.27880 -180.72278 631.40429
3020.0000 -186.21521 -180.43324 5.78197 2.27875 -180.72363 610.64811
3025.0000 -186.78331 -180.29227 6.49104 2.26428 -180.98096 599.12651
3030.0000 -186.30732 -180.58897 5.71835 2.30486 -180.25921 626.92181
3035.0000 -186.34324 -180.40273 5.94051 2.26071 -181.04444 597.22996
3040.0000 -185.25415 -179.69504 5.55911 2.32175 -179.95899 638.17404
3045.0000 -186.92039 -180.68391 6.23648 2.30402 -180.27432 613.73479
3050.0000 -187.04904 -180.33736 6.71168 2.30739 -180.21428 628.79031
3055.0000 -184.89224 -179.74286 5.14938 2.31376 -180.10105 633.29100
3060.0000 -185.95937 -179.19741 6.76197 2.33885 -179.65477 649.09684
3065.0000 -185.62800 -179.25639 6.37162 2.32266 -179.94268 645.31951
3070.0000 -187.31322 -180.87870 6.43453 2.34752 -179.50053 693.93418
3075.0000 -187.76888 -182.14618 5.62270 2.26498 -180.96857 614.41928
3080.0000 -187.22709 -181.93609 5.29100 2.21507 -181.85622 574.86788
3085.0000 -187.96799 -182.33121 5.63677 2.19708 -182.17612 588.12590
3090.0000 -188.04442 -183.37605 4.66838 2.15511 -182.92260 540.21680
3095.0000 -186.70235 -181.08686 5.61549 2.22273 -181.71991 582.54504
3100.0000 -187.45968 -181.36470 6.09498 2.27891 -180.72078 605.11195
3105.0000 -185.12734 -179.44434 5.68300 2.30228 -180.30516 616.48192
3110.0000 -186.02123 -180.35667 5.66456 2.31932 -180.00219 635.88357
3115.0000 -186.22326 -180.71747 5.50578 2.25143 -181.20956 596.01695
3120.0000 -186.99512 -180.83748 6.15764 2.27925 -180.71480 594.98183
3125.0000 -186.78117 -180.45603 6.32514 2.27055 -180.86953 616.28878
3130.0000 -186.52025 -180.71427 5.80598 2.23230 -181.54977 591.30586
3135.0000 -186.23359 -179.57944 6.65415 2.27481 -180.79380 600.56720
3140.0000 -186.56218 -180.89244 5.66974 2.30863 -180.19220 660.34651
3145.0000 -186.52842 -179.47866 7.04976 2.31120 -180.14657 648.88446
3150.0000 -186.76546 -180.80966 5.95580 2.30999 -180.16807 669.42114
3155.0000 -187.24963 -180.00760 7.24203 2.28500 -180.61256 646.40584
3160.0000 -188.07780 -181.98194 6.09586 2.24505 -181.32298 613.82555
3165.0000 -186.92933 -181.43291 5.49643 2.24553 -181.31446 631.79762
3170.0000 -187.57755 -181.63820 5.93935 2.20910 -181.96226 575.94280
3175.0000 -187.93472 -182.13814 5.79657 2.19685 -182.18018 593.24041
3180.0000 -188.61511 -182.79718 5.81793 2.18081 -182.46539 593.08974
3185.0000 -188.65055 -183.27556 5.37499 2.12483 -183.46109 563.18767
3190.0000 -188.81754 -183.21762 5.59992 2.16679 -182.71480 613.75994
3195.0000 -187.73740 -181.97128 5.76613 2.17008 -182.65621 595.61919
3200.0000 -187.17918 -180.79889 6.38030 2.23395 -181.52034 623.60774
3205.0000 -187.27057 -181.48150 5.78907 2.23023 -181.58660 577.90618
3210.0000 -187.20225 -181.40399 5.79825 2.24137 -181.38840 610.87208
3215.0000 -185.60001 -179.62253 5.97748 2.29898 -180.36391 658.43963
3220.0000 -185.88186 -180.17608 5.70578 2.31260 -180.12158 631.65798
3225.0000 -186.69619 -180.13970 6.55649 2.28685 -180.57966 601.60393
3230.0000 -187.52731 -181.63609 5.89122 2.24355 -181.34959 583.78654
3235.0000 -186.58137 -180.68679 5.89458 2.25059 -181.22448 573.08442
3240.0000 -186.36988 -180.86258 5.50730 2.27892 -180.72062 626.79402
3245.0000 -185.90583 -179.89757 6.00826 2.29942 -180.35607 632.95951
3250.0000 -187.06816 -181.32422 5.74393 2.31698 -180.04373 640.58499
MELTING PROCESS: loop number 14 T-loop= 646.00000000000000
main_MD> interactions number 14 at Temperature= 646.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.60622 -0.25533 1.43307
force_rgl> df(natom) -2.45453 0.94930 1.06929
3255.0000 -186.46800 -179.50329 6.96471 2.27125 -180.85695 621.34145
3260.0000 -185.57043 -178.47690 7.09354 2.34989 -179.45845 653.05918
3265.0000 -185.16160 -178.43839 6.72321 2.37604 -178.99344 707.17860
3270.0000 -187.05808 -181.29924 5.75883 2.33599 -179.70563 646.24472
3275.0000 -185.77937 -179.89599 5.88338 2.28755 -180.56723 608.91995
3280.0000 -186.87554 -179.60797 7.26757 2.34347 -179.57262 655.04870
3285.0000 -185.71692 -179.58014 6.13678 2.32110 -179.97048 648.11228
3290.0000 -186.37908 -179.66215 6.71694 2.33091 -179.79603 671.87401
3295.0000 -186.73115 -180.83611 5.89505 2.29789 -180.38319 638.43814
3300.0000 -186.88581 -180.68678 6.19904 2.33213 -179.77429 663.29923
3305.0000 -186.32947 -179.83301 6.49645 2.31667 -180.04935 649.14633
3310.0000 -185.31591 -179.61208 5.70383 2.35292 -179.40449 649.91340
3315.0000 -185.29812 -178.46168 6.83643 2.37911 -178.93873 671.18858
3320.0000 -187.46507 -180.96791 6.49716 2.35429 -179.38029 672.56350
3325.0000 -187.97734 -181.54819 6.42915 2.25427 -181.15896 620.63884
3330.0000 -186.58537 -179.48275 7.10262 2.28208 -180.66434 627.40699
3335.0000 -186.46810 -180.31309 6.15501 2.32328 -179.93169 653.33711
3340.0000 -185.63884 -179.66878 5.97007 2.29983 -180.34870 635.54795
3345.0000 -184.40796 -178.22518 6.18277 2.33831 -179.66442 637.78357
3350.0000 -185.36134 -178.57266 6.78868 2.44089 -177.84005 704.85163
3355.0000 -185.65605 -179.72766 5.92839 2.38202 -178.88702 696.71727
3360.0000 -186.43043 -180.11747 6.31296 2.35243 -179.41337 654.62538
3365.0000 -185.64020 -179.40356 6.23664 2.33683 -179.69077 658.94128
3370.0000 -185.33982 -179.17189 6.16793 2.33073 -179.79919 665.19854
3375.0000 -186.18082 -179.95728 6.22354 2.30797 -180.20391 634.07471
3380.0000 -185.82242 -179.64416 6.17826 2.29554 -180.42507 636.77564
3385.0000 -186.60495 -180.90742 5.69753 2.31586 -180.06371 644.47491
3390.0000 -187.35234 -180.87418 6.47816 2.24113 -181.39266 594.44416
3395.0000 -186.52311 -180.81773 5.70538 2.27554 -180.78081 636.24152
3400.0000 -186.41055 -180.05443 6.35612 2.29247 -180.47964 636.28827
3405.0000 -186.64662 -181.84593 4.80070 2.28868 -180.54696 612.00876
3410.0000 -187.43997 -181.21528 6.22469 2.26927 -180.89218 611.65064
3415.0000 -185.91059 -179.78399 6.12660 2.28486 -180.61507 606.35058
3420.0000 -186.00413 -179.72657 6.27755 2.34244 -179.59089 667.62337
3425.0000 -187.56062 -180.81446 6.74616 2.30807 -180.20220 661.50107
3430.0000 -188.14830 -181.90917 6.23913 2.25179 -181.20306 617.41169
3435.0000 -186.03507 -180.44982 5.58525 2.25217 -181.19641 610.59789
3440.0000 -187.03915 -181.31428 5.72486 2.29790 -180.38311 622.12146
3445.0000 -186.13754 -180.00244 6.13509 2.29528 -180.42963 607.55274
3450.0000 -185.82135 -179.44662 6.37473 2.37207 -179.06406 674.40442
3455.0000 -186.08189 -180.28537 5.79652 2.32457 -179.90873 654.30612
3460.0000 -186.37590 -179.54035 6.83554 2.28190 -180.66759 623.71686
3465.0000 -185.81241 -179.95152 5.86090 2.36119 -179.25752 667.21416
3470.0000 -186.25703 -179.86163 6.39540 2.33861 -179.65914 657.09252
3475.0000 -186.73003 -180.72122 6.00881 2.32434 -179.91283 667.38805
3480.0000 -185.52219 -180.20275 5.31944 2.30106 -180.32692 624.29791
3485.0000 -185.85694 -180.27583 5.58111 2.29854 -180.37177 613.00176
3490.0000 -185.89324 -179.93347 5.95977 2.29685 -180.40170 623.41754
3495.0000 -185.96567 -179.26053 6.70514 2.32661 -179.87255 636.48937
3500.0000 -186.04379 -179.76705 6.27674 2.33410 -179.73931 638.19862
MELTING PROCESS: loop number 15 T-loop= 671.00000000000000
main_MD> interactions number 15 at Temperature= 671.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.47578 1.30385 1.43021
force_rgl> df(natom) 0.20100 -3.97381 1.42165
3505.0000 -186.66191 -181.16264 5.49926 2.32465 -179.90741 644.81692
3510.0000 -185.95351 -180.48312 5.47039 2.25191 -181.20090 583.48221
3515.0000 -186.45529 -179.91391 6.54138 2.31260 -180.12166 629.01677
3520.0000 -187.24488 -179.47586 7.76902 2.36646 -179.16371 681.67791
3525.0000 -186.36638 -178.73145 7.63493 2.31360 -180.10393 649.80754
3530.0000 -186.83333 -180.36924 6.46408 2.32615 -179.88064 654.11346
3535.0000 -187.31457 -180.73356 6.58101 2.26414 -180.98342 616.49688
3540.0000 -186.37129 -179.90803 6.46326 2.27319 -180.82249 638.03029
3545.0000 -186.71896 -179.44896 7.27000 2.31032 -180.16226 658.05110
3550.0000 -185.95397 -180.03820 5.91577 2.33131 -179.78898 662.10328
3555.0000 -185.75531 -178.08323 7.67208 2.36934 -179.11262 679.71120
3560.0000 -185.25661 -178.76287 6.49374 2.38469 -178.83953 692.30044
3565.0000 -185.34830 -177.97830 7.37000 2.39872 -178.59007 706.64530
3570.0000 -184.93565 -178.56296 6.37269 2.42000 -178.21165 705.41059
3575.0000 -184.98289 -178.30100 6.68189 2.40527 -178.47352 713.57640
3580.0000 -186.50726 -178.42222 8.08504 2.40696 -178.44351 707.55216
3585.0000 -185.56241 -179.29493 6.26748 2.37011 -179.09881 699.47529
3590.0000 -186.20218 -179.29548 6.90670 2.38725 -178.79409 700.19926
3595.0000 -185.47374 -178.92234 6.55141 2.38178 -178.89137 679.91619
3600.0000 -186.36722 -179.77342 6.59380 2.36233 -179.23720 668.63665
3605.0000 -185.82151 -178.80908 7.01243 2.37181 -179.06856 677.49189
3610.0000 -184.94699 -177.85381 7.09317 2.39882 -178.58823 677.75527
3615.0000 -185.95743 -179.32829 6.62913 2.39925 -178.58067 689.59995
3620.0000 -186.36297 -179.00468 7.35828 2.36301 -179.22513 669.36005
3625.0000 -185.44106 -179.11945 6.32161 2.38200 -178.88744 692.59779
3630.0000 -184.93000 -178.75402 6.17598 2.38937 -178.75630 694.86352
3635.0000 -185.87125 -179.01638 6.85488 2.37658 -178.98371 699.22935
3640.0000 -185.80936 -178.50584 7.30352 2.38797 -178.78118 716.45521
3645.0000 -185.51475 -178.79554 6.71921 2.36160 -179.25022 659.85438
3650.0000 -184.44701 -178.03922 6.40779 2.38899 -178.76302 691.23675
3655.0000 -185.57670 -178.28952 7.28718 2.41836 -178.24083 707.92093
3660.0000 -186.50794 -178.79058 7.71736 2.42425 -178.13594 729.51744
3665.0000 -185.42176 -178.70357 6.71819 2.39988 -178.56944 715.44052
3670.0000 -184.96233 -178.62243 6.33990 2.39626 -178.63378 694.45828
3675.0000 -187.49636 -179.38176 8.11460 2.38823 -178.77666 691.69557
3680.0000 -185.61014 -179.77604 5.83411 2.36606 -179.17081 666.88498
3685.0000 -185.62820 -178.44731 7.18089 2.35711 -179.33003 664.02718
3690.0000 -185.31457 -179.48304 5.83153 2.36967 -179.10671 659.94479
3695.0000 -187.27310 -180.76770 6.50540 2.32906 -179.82890 637.98625
3700.0000 -187.40978 -181.01536 6.39443 2.28948 -180.53284 650.78655
3705.0000 -186.27053 -180.00603 6.26450 2.28305 -180.64722 643.23557
3710.0000 -185.18807 -178.45345 6.73462 2.40919 -178.40391 716.62110
3715.0000 -186.66392 -179.65096 7.01296 2.34718 -179.50662 653.76925
3720.0000 -186.43468 -180.78661 5.64807 2.31829 -180.02053 652.74466
3725.0000 -186.15996 -180.15681 6.00315 2.27837 -180.73041 626.71423
3730.0000 -186.35961 -180.00151 6.35809 2.33966 -179.64046 657.38023
3735.0000 -183.99548 -177.51214 6.48334 2.40243 -178.52408 719.46938
3740.0000 -185.59924 -179.09035 6.50889 2.38110 -178.90342 713.02908
3745.0000 -185.69943 -178.86974 6.82969 2.35742 -179.32453 673.40313
3750.0000 -186.95017 -180.33720 6.61297 2.32536 -179.89477 651.30327
MELTING PROCESS: loop number 16 T-loop= 696.00000000000000
main_MD> interactions number 16 at Temperature= 696.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.12634 1.88947 2.51868
force_rgl> df(natom) 1.76105 -1.36444 1.68728
3755.0000 -186.00458 -179.46938 6.53520 2.32373 -179.92363 663.03344
3760.0000 -185.56944 -178.75037 6.81907 2.36419 -179.20423 676.18383
3765.0000 -184.41313 -178.30563 6.10751 2.40230 -178.52637 682.64986
3770.0000 -184.22432 -178.77614 5.44818 2.39909 -178.58350 700.96059
3775.0000 -185.32678 -179.03429 6.29248 2.37916 -178.93790 663.24876
3780.0000 -185.61203 -177.91223 7.69980 2.39697 -178.62108 677.58784
3785.0000 -185.87592 -178.63736 7.23856 2.42069 -178.19928 703.25033
3790.0000 -184.03007 -178.42586 5.60422 2.43088 -178.01810 709.69718
3795.0000 -182.61541 -176.58489 6.03052 2.47963 -177.15102 749.78934
3800.0000 -183.50388 -176.39429 7.10959 2.50314 -176.73298 756.20566
3805.0000 -186.52828 -178.98256 7.54571 2.42178 -178.17996 713.87059
3810.0000 -186.09423 -179.28701 6.80722 2.33822 -179.66594 685.36919
3815.0000 -185.20346 -178.47087 6.73259 2.42298 -178.15859 736.57796
3820.0000 -184.99879 -177.66568 7.33311 2.40344 -178.50615 709.23345
3825.0000 -184.84135 -178.51364 6.32771 2.42058 -178.20121 724.43857
3830.0000 -185.41713 -178.79591 6.62122 2.36608 -179.17051 659.30812
3835.0000 -185.07174 -177.55322 7.51852 2.42578 -178.10886 718.05857
3840.0000 -186.06717 -178.56592 7.50124 2.43082 -178.01916 724.26821
3845.0000 -185.61400 -177.94759 7.66641 2.39994 -178.56839 703.73517
3850.0000 -185.45934 -178.75214 6.70720 2.39275 -178.69619 686.65187
3855.0000 -185.63920 -178.71109 6.92810 2.40719 -178.43936 704.43500
3860.0000 -186.19392 -179.88133 6.31259 2.38495 -178.83495 690.81011
3865.0000 -185.13606 -178.96218 6.17388 2.34450 -179.55437 661.15068
3870.0000 -185.84070 -179.58286 6.25784 2.39215 -178.70692 718.06003
3875.0000 -185.70632 -178.18820 7.51813 2.33985 -179.63695 684.16947
3880.0000 -184.95426 -178.32449 6.62977 2.43131 -178.01041 728.06167
3885.0000 -185.92168 -180.29007 5.63160 2.38037 -178.91631 675.01716
3890.0000 -185.76620 -179.09413 6.67207 2.35033 -179.45063 677.48087
3895.0000 -185.97197 -179.33506 6.63691 2.38381 -178.85517 704.51786
3900.0000 -185.38965 -178.53135 6.85830 2.40589 -178.46250 703.06372
3905.0000 -185.01004 -178.33149 6.67854 2.40342 -178.50641 703.82805
3910.0000 -184.90616 -178.89525 6.01091 2.40992 -178.39093 722.74636
3915.0000 -184.89393 -178.73290 6.16103 2.40141 -178.54213 697.13916
3920.0000 -185.06446 -178.60666 6.45779 2.41891 -178.23091 690.78417
3925.0000 -185.09967 -178.22678 6.87289 2.39848 -178.59440 704.31003
3930.0000 -184.68157 -178.16570 6.51586 2.43920 -177.87018 728.80616
3935.0000 -184.62452 -178.91581 5.70872 2.40845 -178.41699 701.57404
3940.0000 -184.52291 -177.82820 6.69471 2.45609 -177.56973 751.57570
3945.0000 -184.22720 -177.85548 6.37172 2.42201 -178.17579 728.84059
3950.0000 -185.03617 -177.87524 7.16093 2.41849 -178.23844 721.13457
3955.0000 -184.17878 -177.55585 6.62293 2.40776 -178.42921 699.75910
3960.0000 -185.76042 -178.12344 7.63699 2.47093 -177.30591 732.14639
3965.0000 -185.29388 -178.59325 6.70063 2.39371 -178.67922 690.30947
3970.0000 -185.59422 -179.14622 6.44800 2.37948 -178.93220 691.53567
3975.0000 -185.48098 -179.44779 6.03318 2.34976 -179.46086 665.88368
3980.0000 -184.95120 -179.37336 5.57784 2.36944 -179.11079 668.62581
3985.0000 -184.57395 -177.65173 6.92222 2.43159 -178.00541 720.79865
3990.0000 -185.15733 -177.92801 7.22932 2.46318 -177.44358 746.67392
3995.0000 -186.12769 -180.05291 6.07479 2.37468 -179.01751 685.76819
4000.0000 -186.26504 -180.24265 6.02239 2.35470 -179.37301 660.54119
MELTING PROCESS: loop number 17 T-loop= 721.00000000000000
main_MD> interactions number 17 at Temperature= 721.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.08831 0.14072 -1.34106
force_rgl> df(natom) 1.35157 -1.40311 1.30403
4005.0000 -185.24656 -178.91521 6.33135 2.30947 -180.17739 660.54021
4010.0000 -183.63098 -176.70993 6.92105 2.47485 -177.23607 767.67131
4015.0000 -186.00048 -178.18006 7.82042 2.43426 -177.95795 722.30559
4020.0000 -184.31968 -178.74744 5.57224 2.44940 -177.68876 748.55461
4025.0000 -184.05923 -178.09013 5.96910 2.41743 -178.25725 703.21302
4030.0000 -185.43869 -178.36709 7.07160 2.39730 -178.61535 694.46792
4035.0000 -184.96221 -178.03546 6.92675 2.39400 -178.67392 696.30790
4040.0000 -184.70695 -177.70453 7.00242 2.45478 -177.59300 739.01571
4045.0000 -185.61306 -177.93356 7.67951 2.43656 -177.91705 713.88647
4050.0000 -183.85967 -176.73150 7.12817 2.43593 -177.92828 715.59807
4055.0000 -183.33393 -176.86068 6.47325 2.48848 -176.99365 756.01547
4060.0000 -183.80068 -177.33130 6.46938 2.46235 -177.45848 697.96309
4065.0000 -185.68861 -179.01331 6.67530 2.44556 -177.75703 713.32938
4070.0000 -185.51135 -179.18802 6.32334 2.37809 -178.95696 667.82268
4075.0000 -186.26748 -179.65784 6.60964 2.34898 -179.47468 635.63963
4080.0000 -185.39968 -177.91490 7.48477 2.38195 -178.88832 692.77528
4085.0000 -185.20622 -178.12246 7.08376 2.38447 -178.84346 704.54550
4090.0000 -185.95507 -178.71998 7.23509 2.40135 -178.54331 698.94365
4095.0000 -186.12415 -178.23321 7.89094 2.41484 -178.30334 697.20455
4100.0000 -186.01948 -178.96362 7.05586 2.40106 -178.54850 712.16458
4105.0000 -185.55396 -180.28616 5.26781 2.32109 -179.97071 643.15830
4110.0000 -185.71804 -179.29341 6.42462 2.34479 -179.54915 671.54164
4115.0000 -185.78094 -178.80890 6.97204 2.35238 -179.41416 651.24018
4120.0000 -184.83863 -179.16207 5.67656 2.39600 -178.63847 697.55188
4125.0000 -185.81444 -178.40989 7.40456 2.39664 -178.62702 682.86765
4130.0000 -184.33234 -177.43652 6.89582 2.42771 -178.07439 723.83782
4135.0000 -185.07867 -177.95665 7.12202 2.45702 -177.55316 748.47291
4140.0000 -184.35968 -177.87244 6.48724 2.43743 -177.90156 731.07178
4145.0000 -185.33194 -177.00990 8.32204 2.43633 -177.92109 744.32415
4150.0000 -184.41534 -177.91891 6.49643 2.45249 -177.63382 742.07126
4155.0000 -185.33063 -178.27203 7.05860 2.45014 -177.67563 704.45619
4160.0000 -185.48438 -178.89550 6.58888 2.39206 -178.70855 690.85812
4165.0000 -186.17798 -178.25113 7.92685 2.40167 -178.53760 699.31928
4170.0000 -184.44729 -177.13573 7.31156 2.44142 -177.83057 719.36269
4175.0000 -185.99491 -178.39796 7.59695 2.42613 -178.10251 716.15441
4180.0000 -185.59669 -179.88934 5.70735 2.36458 -179.19713 675.28943
4185.0000 -185.64249 -178.52810 7.11439 2.36697 -179.15462 668.51787
4190.0000 -184.70867 -177.71995 6.98872 2.43701 -177.90908 723.09685
4195.0000 -185.36675 -178.59447 6.77228 2.42079 -178.19751 712.26512
4200.0000 -186.43412 -179.46066 6.97346 2.36453 -179.19818 687.41433
4205.0000 -186.49008 -179.44536 7.04472 2.33180 -179.78011 686.38710
4210.0000 -184.81484 -177.81856 6.99628 2.41599 -178.28291 730.86190
4215.0000 -184.18385 -177.80940 6.37445 2.44218 -177.81717 729.52054
4220.0000 -186.12430 -178.52347 7.60084 2.43539 -177.93785 724.61767
4225.0000 -184.38323 -177.79284 6.59039 2.42792 -178.07073 722.75173
4230.0000 -185.53872 -179.00116 6.53756 2.41725 -178.26048 709.78394
4235.0000 -185.21433 -178.13336 7.08097 2.40789 -178.42688 690.94987
4240.0000 -184.99199 -177.42496 7.56703 2.44529 -177.76186 739.48867
4245.0000 -184.79019 -177.00373 7.78646 2.50797 -176.64718 771.91280
4250.0000 -184.38938 -176.68238 7.70700 2.51774 -176.47340 758.71419
MELTING PROCESS: loop number 18 T-loop= 746.00000000000000
main_MD> interactions number 18 at Temperature= 746.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.82894 0.31628 -3.26205
force_rgl> df(natom) -4.60226 -5.40552 4.68468
4255.0000 -185.47505 -178.71425 6.76080 2.43270 -177.98580 707.88989
4260.0000 -185.26931 -178.65010 6.61921 2.38122 -178.90125 705.94589
4265.0000 -185.62210 -177.50308 8.11902 2.43211 -177.99616 760.32076
4270.0000 -184.24858 -177.31617 6.93240 2.47093 -177.30591 749.83595
4275.0000 -185.90230 -178.11816 7.78414 2.44803 -177.71300 729.07698
4280.0000 -184.69306 -178.09701 6.59605 2.42604 -178.10424 713.79747
4285.0000 -183.14160 -176.51456 6.62704 2.44688 -177.73359 737.93724
4290.0000 -184.24735 -177.02530 7.22205 2.51782 -176.47187 775.34163
4295.0000 -184.33784 -177.69503 6.64281 2.50553 -176.69040 768.37220
4300.0000 -184.67139 -177.25086 7.42054 2.44993 -177.67928 723.98987
4305.0000 -184.62136 -177.32942 7.29194 2.47724 -177.19362 756.41989
4310.0000 -184.40401 -177.35158 7.05244 2.44480 -177.77048 725.26206
4315.0000 -182.26109 -176.16055 6.10054 2.48735 -177.01376 738.48861
4320.0000 -182.43142 -174.84954 7.58188 2.55837 -175.75078 772.90145
4325.0000 -184.95934 -177.29984 7.65950 2.57311 -175.48870 787.61027
4330.0000 -184.06619 -177.29359 6.77260 2.51061 -176.60015 762.86349
4335.0000 -185.51809 -178.32107 7.19702 2.47704 -177.19712 759.76657
4340.0000 -184.51012 -176.88794 7.62219 2.47971 -177.14971 759.75117
4345.0000 -186.45551 -178.15515 8.30036 2.48728 -177.01505 761.15720
4350.0000 -183.87021 -176.64795 7.22225 2.47516 -177.23053 759.22068
4355.0000 -182.82906 -175.58269 7.24638 2.53095 -176.23846 773.01398
4360.0000 -184.89128 -177.07957 7.81171 2.52553 -176.33472 772.43376
4365.0000 -184.42618 -176.15632 8.26985 2.46433 -177.42317 707.88111
4370.0000 -183.38779 -175.96478 7.42301 2.56701 -175.59706 818.53729
4375.0000 -185.79183 -177.37619 8.41564 2.51622 -176.50032 787.37981
4380.0000 -186.10733 -178.23160 7.87573 2.43769 -177.89701 731.28642
4385.0000 -184.80854 -177.40676 7.40178 2.44629 -177.74401 720.50562
4390.0000 -184.70970 -178.22082 6.48888 2.44159 -177.82766 740.28157
4395.0000 -184.22893 -176.86333 7.36559 2.45022 -177.67423 725.28894
4400.0000 -185.03750 -178.20877 6.82873 2.45087 -177.66257 745.39714
4405.0000 -185.81463 -178.96223 6.85240 2.43414 -177.96019 740.63328
4410.0000 -185.46146 -178.66020 6.80126 2.37399 -179.02983 700.37476
4415.0000 -184.56726 -178.18193 6.38533 2.40780 -178.42853 705.25924
4420.0000 -185.80635 -177.59637 8.20998 2.40165 -178.53798 719.87216
4425.0000 -184.08266 -176.92224 7.16043 2.47027 -177.31759 761.12103
4430.0000 -184.50495 -176.53386 7.97109 2.49181 -176.93443 769.72405
4435.0000 -185.05860 -178.39199 6.66661 2.44000 -177.85597 732.64860
4440.0000 -185.33201 -178.93402 6.39799 2.42813 -178.06705 698.57178
4445.0000 -185.93928 -179.42218 6.51709 2.35243 -179.41325 647.85640
4450.0000 -184.18203 -177.09578 7.08625 2.43719 -177.90595 716.67843
4455.0000 -184.33693 -177.30773 7.02920 2.46455 -177.41934 743.24589
4460.0000 -183.43712 -176.08173 7.35539 2.49253 -176.92177 756.46694
4465.0000 -182.96413 -175.16341 7.80071 2.55432 -175.82278 806.81099
4470.0000 -184.40138 -176.69035 7.71104 2.53581 -176.15190 744.83454
4475.0000 -184.18963 -176.49859 7.69104 2.54866 -175.92349 820.57636
4480.0000 -184.15860 -177.45738 6.70121 2.45594 -177.57233 716.23139
4485.0000 -186.06018 -178.85639 7.20379 2.43319 -177.97699 715.01746
4490.0000 -186.05736 -179.99089 6.06647 2.36831 -179.13089 683.67674
4495.0000 -185.31930 -178.29019 7.02911 2.37748 -178.96771 718.69833
4500.0000 -184.15064 -177.96246 6.18819 2.42519 -178.11922 733.56052
MELTING PROCESS: loop number 19 T-loop= 771.00000000000000
main_MD> interactions number 19 at Temperature= 771.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.37654 0.89775 -0.49526
force_rgl> df(natom) 1.11841 -0.50491 0.15665
4505.0000 -184.58996 -176.42967 8.16029 2.47266 -177.27513 749.26276
4510.0000 -182.64213 -175.50484 7.13729 2.58321 -175.30898 827.31953
4515.0000 -184.15118 -175.50337 8.64782 2.52100 -176.41542 785.64102
4520.0000 -181.92893 -174.15007 7.77886 2.59723 -175.05963 803.67937
4525.0000 -183.75998 -175.61341 8.14658 2.57873 -175.38868 835.12700
4530.0000 -183.60878 -176.98766 6.62112 2.52266 -176.38591 798.19255
4535.0000 -182.91666 -175.10979 7.80687 2.51230 -176.57003 764.17878
4540.0000 -183.67227 -176.79789 6.87438 2.53350 -176.19302 787.67851
4545.0000 -183.87013 -176.95455 6.91558 2.58280 -175.31622 824.68955
4550.0000 -183.61336 -176.67312 6.94024 2.50989 -176.61287 741.90508
4555.0000 -182.79191 -173.33246 9.45945 2.58870 -175.21137 787.89969
4560.0000 -182.88439 -174.93103 7.95337 2.63067 -174.46497 831.43070
4565.0000 -183.12371 -176.26958 6.85413 2.59848 -175.03750 834.68194
4570.0000 -183.66926 -175.61180 8.05747 2.55337 -175.83963 799.55523
4575.0000 -183.09618 -174.93576 8.16042 2.56648 -175.60655 793.41765
4580.0000 -181.81119 -174.34362 7.46757 2.61649 -174.71716 818.77088
4585.0000 -183.66578 -176.29457 7.37120 2.57715 -175.41668 807.33578
4590.0000 -184.67735 -177.60513 7.07222 2.51351 -176.54854 798.86383
4595.0000 -182.95550 -175.41331 7.54219 2.52183 -176.40059 811.63720
4600.0000 -184.14804 -176.68961 7.45843 2.57080 -175.52961 810.02840
4605.0000 -185.29514 -176.21727 9.07787 2.54265 -176.03025 804.49233
4610.0000 -185.90465 -177.77894 8.12570 2.45943 -177.51041 761.53691
4615.0000 -184.60339 -178.05940 6.54400 2.46118 -177.47926 749.03302
4620.0000 -183.73087 -177.18559 6.54528 2.46929 -177.33492 732.92600
4625.0000 -184.27252 -176.87344 7.39908 2.46101 -177.48218 744.23791
4630.0000 -186.00742 -177.55250 8.45492 2.47032 -177.31664 765.40917
4635.0000 -184.89093 -177.54093 7.35000 2.44926 -177.69115 744.26890
4640.0000 -183.91537 -176.83771 7.07766 2.45160 -177.64959 727.27611
4645.0000 -182.37657 -175.89203 6.48454 2.53450 -176.17523 788.81363
4650.0000 -184.56926 -176.32882 8.24044 2.51968 -176.43887 770.00100
4655.0000 -184.94874 -177.55012 7.39863 2.49844 -176.81652 742.44344
4660.0000 -184.27484 -176.44048 7.83436 2.47285 -177.27171 737.90177
4665.0000 -184.53314 -177.04259 7.49055 2.48719 -177.01659 756.16869
4670.0000 -183.57684 -175.65957 7.91726 2.50435 -176.71147 754.29672
4675.0000 -182.08160 -176.15433 5.92727 2.57780 -175.40517 807.58305
4680.0000 -183.93117 -176.28491 7.64625 2.53362 -176.19100 776.15517
4685.0000 -184.99087 -175.86185 9.12901 2.54736 -175.94664 769.76992
4690.0000 -181.72551 -174.43369 7.29182 2.58849 -175.21513 786.26045
4695.0000 -184.78480 -176.25771 8.52708 2.57291 -175.49217 807.81293
4700.0000 -182.30581 -174.56581 7.74000 2.57777 -175.40568 824.30566
4705.0000 -184.50867 -177.59469 6.91398 2.55501 -175.81052 811.60974
4710.0000 -183.70112 -175.98501 7.71612 2.50958 -176.61844 775.79039
4715.0000 -183.67665 -176.28163 7.39502 2.51616 -176.50151 761.29466
4720.0000 -184.95913 -178.08826 6.87087 2.45879 -177.52173 778.28396
4725.0000 -184.47969 -178.25841 6.22129 2.41358 -178.32583 735.32759
4730.0000 -185.40698 -178.58306 6.82392 2.43698 -177.90958 729.95302
4735.0000 -185.75043 -177.67031 8.08012 2.44457 -177.77458 736.00375
4740.0000 -184.76678 -176.95434 7.81244 2.45665 -177.55983 753.27960
4745.0000 -182.64888 -174.37507 8.27382 2.55228 -175.85905 781.71776
4750.0000 -182.81854 -174.65953 8.15900 2.61287 -174.78142 845.92343
MELTING PROCESS: loop number 20 T-loop= 796.00000000000000
main_MD> interactions number 20 at Temperature= 796.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.44373 0.93352 1.97061
force_rgl> df(natom) -5.70885 1.41603 -0.43833
4755.0000 -184.05697 -175.51052 8.54646 2.59802 -175.04556 821.69104
4760.0000 -184.46229 -176.50136 7.96093 2.54212 -176.03979 780.21722
4765.0000 -183.54273 -176.17963 7.36310 2.51111 -176.59117 775.33759
4770.0000 -182.41985 -175.36152 7.05833 2.51922 -176.44710 764.34174
4775.0000 -182.70805 -174.99599 7.71206 2.59632 -175.07583 819.36693
4780.0000 -184.28615 -176.37750 7.90865 2.58993 -175.18951 817.34938
4785.0000 -184.47447 -177.56430 6.91017 2.49434 -176.88953 748.07209
4790.0000 -183.38434 -176.61820 6.76613 2.48513 -177.05331 749.34544
4795.0000 -185.04803 -178.03693 7.01110 2.51947 -176.44261 781.94234
4800.0000 -183.82712 -176.56030 7.26681 2.49628 -176.85505 757.74231
4805.0000 -183.37980 -175.33377 8.04603 2.57000 -175.54397 822.33009
4810.0000 -184.23372 -176.42197 7.81175 2.51532 -176.51632 783.66311
4815.0000 -185.27331 -177.49084 7.78247 2.46542 -177.40390 750.06855
4820.0000 -183.04928 -175.16139 7.88789 2.51403 -176.53931 751.18431
4825.0000 -184.44695 -176.94397 7.50298 2.56404 -175.64996 809.01551
4830.0000 -183.91948 -176.25817 7.66131 2.55839 -175.75045 780.95778
4835.0000 -183.43417 -175.96148 7.47269 2.51762 -176.47548 779.24674
4840.0000 -183.02385 -176.09759 6.92626 2.55806 -175.75626 795.89973
4845.0000 -183.49914 -175.16760 8.33155 2.58351 -175.30360 812.47873
4850.0000 -183.46996 -175.24180 8.22815 2.59188 -175.15478 805.91854
4855.0000 -183.66459 -177.32258 6.34201 2.51299 -176.55784 793.42159
4860.0000 -183.31116 -176.13146 7.17970 2.46969 -177.32785 767.86115
4865.0000 -183.98210 -177.17171 6.81039 2.58381 -175.29833 846.90372
4870.0000 -183.59921 -175.73211 7.86710 2.54203 -176.04139 803.63852
4875.0000 -184.51103 -177.80396 6.70707 2.48961 -176.97368 755.61284
4880.0000 -184.47691 -176.97019 7.50672 2.46407 -177.42780 752.21148
4885.0000 -182.81768 -175.14122 7.67646 2.54510 -175.98677 779.20299
4890.0000 -183.47829 -176.18455 7.29375 2.56874 -175.56629 808.59936
4895.0000 -184.04662 -176.46080 7.58582 2.54716 -175.95015 806.35842
4900.0000 -183.36387 -176.92892 6.43494 2.45689 -177.55550 749.03040
4905.0000 -183.97065 -177.58092 6.38973 2.47620 -177.21213 743.36183
4910.0000 -183.60291 -177.79296 5.80995 2.52003 -176.43264 759.89213
4915.0000 -182.86623 -176.27480 6.59143 2.53223 -176.21571 788.53843
4920.0000 -183.23769 -176.23592 7.00176 2.51560 -176.51142 762.39569
4925.0000 -184.40139 -177.09096 7.31043 2.50192 -176.75472 774.81920
4930.0000 -183.79698 -175.87926 7.91772 2.49992 -176.79017 768.65004
4935.0000 -181.26156 -174.16072 7.10084 2.61558 -174.73330 847.51075
4940.0000 -183.81691 -175.76852 8.04838 2.58131 -175.34284 822.66303
4945.0000 -184.10112 -176.54902 7.55209 2.52476 -176.34848 783.81226
4950.0000 -184.57062 -176.83176 7.73886 2.51471 -176.52717 766.61136
4955.0000 -183.43169 -176.79909 6.63259 2.52033 -176.42724 791.35647
4960.0000 -183.57546 -176.82302 6.75244 2.48707 -177.01886 731.74165
4965.0000 -184.89223 -176.29545 8.59678 2.53055 -176.24559 780.65565
4970.0000 -185.47264 -177.35556 8.11708 2.52119 -176.41206 776.11897
4975.0000 -184.30913 -176.72037 7.58876 2.48311 -177.08929 751.19130
4980.0000 -182.65450 -175.04346 7.61104 2.56044 -175.71403 787.19213
4985.0000 -182.99962 -175.73982 7.25980 2.54467 -175.99439 773.62938
4990.0000 -182.70167 -175.01644 7.68522 2.61289 -174.78123 811.25677
4995.0000 -182.90080 -175.47621 7.42458 2.56135 -175.69767 806.98363
5000.0000 -182.78995 -174.91934 7.87061 2.63290 -174.42529 848.00252
MELTING PROCESS: loop number 21 T-loop= 821.00000000000000
main_MD> interactions number 21 at Temperature= 821.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.96029 -1.06664 0.58445
force_rgl> df(natom) 0.74288 -1.95544 -0.60905
5005.0000 -183.38707 -175.02624 8.36083 2.57257 -175.49830 811.97843
5010.0000 -182.86006 -176.01902 6.84104 2.60822 -174.86427 835.64596
5015.0000 -184.82382 -177.86160 6.96222 2.51673 -176.49137 776.06810
5020.0000 -183.50138 -177.29980 6.20157 2.47107 -177.30342 769.68468
5025.0000 -185.26044 -177.11458 8.14587 2.47466 -177.23950 767.55143
5030.0000 -183.62141 -176.87561 6.74580 2.48451 -177.06434 751.29341
5035.0000 -183.57512 -175.58730 7.98782 2.51195 -176.57639 763.62576
5040.0000 -183.14637 -174.82619 8.32018 2.59549 -175.09060 810.49851
5045.0000 -181.37528 -174.17744 7.19784 2.59552 -175.09006 808.78029
5050.0000 -183.11562 -174.64751 8.46811 2.62716 -174.52740 860.94281
5055.0000 -182.82401 -174.18015 8.64386 2.63681 -174.35570 872.32243
5060.0000 -182.83850 -174.52869 8.30981 2.60643 -174.89599 818.59176
5065.0000 -183.39010 -175.17963 8.21047 2.58103 -175.34780 802.58909
5070.0000 -180.59028 -173.38115 7.20913 2.64486 -174.21258 856.87584
5075.0000 -182.55668 -174.60540 7.95128 2.62832 -174.50674 834.13961
5080.0000 -184.03004 -176.14474 7.88530 2.57698 -175.41972 807.21960
5085.0000 -182.75691 -174.55042 8.20649 2.61404 -174.76065 828.70615
5090.0000 -183.87931 -176.30845 7.57086 2.51651 -176.49522 798.91284
5095.0000 -182.62805 -175.54579 7.08226 2.55921 -175.73577 793.65573
5100.0000 -182.45336 -173.75397 8.69940 2.62040 -174.64754 853.65127
5105.0000 -182.92064 -175.30571 7.61493 2.63505 -174.38703 861.55178
5110.0000 -183.99832 -176.67196 7.32636 2.55502 -175.81027 793.75306
5115.0000 -183.87317 -176.28167 7.59150 2.51153 -176.58382 753.75244
5120.0000 -183.42456 -175.09240 8.33216 2.54422 -176.00232 788.06660
5125.0000 -182.66817 -173.74806 8.92011 2.66402 -173.87177 881.07923
5130.0000 -182.98292 -174.97069 8.01223 2.65979 -173.94698 872.86825
5135.0000 -183.74739 -176.41393 7.33346 2.60385 -174.94198 832.41249
5140.0000 -183.22137 -176.20305 7.01832 2.50064 -176.77749 764.04370
5145.0000 -184.41243 -177.37732 7.03511 2.53834 -176.10701 784.68937
5150.0000 -183.85304 -176.91244 6.94060 2.48231 -177.10342 747.81423
5155.0000 -181.80777 -174.21679 7.59098 2.53427 -176.17945 765.72871
5160.0000 -182.45442 -173.84367 8.61074 2.64458 -174.21754 868.58082
5165.0000 -181.44509 -173.06493 8.38016 2.65695 -173.99757 877.81346
5170.0000 -182.10529 -174.16902 7.93627 2.70978 -173.05792 906.06049
5175.0000 -183.37430 -175.81786 7.55645 2.64233 -174.25750 855.84877
5180.0000 -181.90227 -174.33603 7.56624 2.61484 -174.74650 833.19840
5185.0000 -183.09090 -175.37843 7.71247 2.61799 -174.69046 830.98825
5190.0000 -184.46000 -175.86513 8.59486 2.57568 -175.44297 813.60802
5195.0000 -184.17843 -176.90143 7.27700 2.53768 -176.11874 790.29009
5200.0000 -184.47271 -176.22949 8.24322 2.47228 -177.28185 758.32098
5205.0000 -183.28830 -175.94280 7.34549 2.53390 -176.18588 770.96905
5210.0000 -183.70381 -176.33972 7.36410 2.50689 -176.66631 758.45892
5215.0000 -184.14362 -175.71249 8.43113 2.49920 -176.80300 761.79204
5220.0000 -184.48169 -176.36993 8.11176 2.53906 -176.09411 803.44294
5225.0000 -184.25884 -176.17624 8.08260 2.51949 -176.44213 781.98569
5230.0000 -183.09003 -175.46918 7.62085 2.57519 -175.45169 803.99088
5235.0000 -183.74064 -175.97851 7.76212 2.58898 -175.20637 816.44659
5240.0000 -183.59460 -175.93481 7.65979 2.54278 -176.02808 809.64684
5245.0000 -182.72361 -174.24963 8.47399 2.63214 -174.43882 840.37925
5250.0000 -184.42646 -176.81345 7.61301 2.61216 -174.79410 838.51728
MELTING PROCESS: loop number 22 T-loop= 846.00000000000000
main_MD> interactions number 22 at Temperature= 846.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.61787 -1.13559 2.50295
force_rgl> df(natom) 0.37401 4.29183 -3.89455
5255.0000 -183.13030 -175.28883 7.84147 2.55581 -175.79637 802.92617
5260.0000 -181.40143 -174.23013 7.17130 2.60890 -174.85210 822.45454
5265.0000 -184.16608 -176.35781 7.80827 2.63300 -174.42357 873.21864
5270.0000 -183.84740 -176.56396 7.28344 2.51682 -176.48969 787.23071
5275.0000 -185.67918 -177.02336 8.65583 2.55552 -175.80144 822.09555
5280.0000 -183.10735 -175.30566 7.80169 2.57664 -175.42582 839.92236
5285.0000 -182.41273 -174.95122 7.46151 2.64601 -174.19206 861.59970
5290.0000 -183.39397 -175.18825 8.20572 2.63430 -174.40040 851.68764
5295.0000 -182.05669 -173.27146 8.78523 2.68638 -173.47422 854.07790
5300.0000 -182.66963 -174.28734 8.38229 2.65754 -173.98707 854.84692
5305.0000 -181.92033 -172.19190 9.72843 2.67613 -173.65653 885.72719
5310.0000 -181.85875 -174.41064 7.44811 2.72747 -172.74336 907.03439
5315.0000 -182.68620 -174.58855 8.09766 2.66480 -173.85793 857.92523
5320.0000 -182.81576 -175.40234 7.41343 2.59350 -175.12604 807.62645
5325.0000 -181.55330 -173.48755 8.06575 2.62843 -174.50477 839.29540
5330.0000 -182.14204 -174.23190 7.91014 2.65349 -174.05918 853.43279
5335.0000 -182.71905 -175.38227 7.33678 2.61007 -174.83133 834.39437
5340.0000 -183.20228 -174.39825 8.80403 2.62423 -174.57950 852.68876
5345.0000 -183.28175 -173.63696 9.64479 2.65905 -173.96022 855.16231
5350.0000 -182.81521 -174.54991 8.26530 2.60144 -174.98470 839.38851
5355.0000 -182.20356 -175.07140 7.13216 2.58547 -175.26874 811.95371
5360.0000 -183.31636 -175.78889 7.52746 2.55651 -175.78385 788.42994
5365.0000 -179.13580 -171.11137 8.02443 2.73738 -172.56724 949.26197
5370.0000 -183.50690 -173.14914 10.35776 2.77496 -171.89888 924.69721
5375.0000 -183.54024 -174.81773 8.72252 2.62650 -174.53908 851.92574
5380.0000 -183.10619 -173.53715 9.56905 2.64373 -174.23272 848.85473
5385.0000 -183.30157 -174.75847 8.54310 2.66719 -173.81545 826.85471
5390.0000 -181.84194 -173.22720 8.61474 2.62758 -174.51993 836.39109
5395.0000 -182.71682 -175.10616 7.61066 2.67704 -173.64036 872.08938
5400.0000 -183.36211 -176.28900 7.07311 2.56164 -175.69264 804.38683
5405.0000 -183.93543 -176.60939 7.32603 2.55942 -175.73205 817.61049
5410.0000 -184.03008 -175.57711 8.45297 2.54563 -175.97728 800.20148
5415.0000 -181.37276 -173.10906 8.26370 2.61808 -174.68887 855.76715
5420.0000 -182.82008 -174.92109 7.89899 2.65192 -174.08709 854.76636
5425.0000 -183.51563 -176.11823 7.39741 2.56764 -175.58585 823.57655
5430.0000 -183.47831 -175.09500 8.38331 2.52758 -176.29827 769.59361
5435.0000 -182.34699 -174.13064 8.21636 2.63177 -174.44530 863.78646
5440.0000 -183.23769 -174.34599 8.89169 2.66464 -173.86071 867.55297
5445.0000 -182.71682 -175.48968 7.22714 2.63533 -174.38207 876.35090
5450.0000 -182.33798 -172.19079 10.14719 2.68097 -173.57030 899.09311
5455.0000 -182.68820 -173.50144 9.18676 2.69619 -173.29968 922.56511
5460.0000 -182.34315 -174.19451 8.14864 2.65383 -174.05306 849.30873
5465.0000 -180.73869 -171.60493 9.13376 2.73162 -172.66957 910.98871
5470.0000 -182.03012 -172.30963 9.72049 2.77139 -171.96228 945.82144
5475.0000 -182.15345 -174.05079 8.10266 2.66501 -173.85429 866.07220
5480.0000 -182.70198 -173.38546 9.31652 2.67184 -173.73268 883.98950
5485.0000 -181.45580 -173.45474 8.00106 2.67956 -173.59537 884.59639
5490.0000 -181.84693 -173.84341 8.00352 2.65762 -173.98566 870.26666
5495.0000 -182.67052 -173.51484 9.15568 2.69305 -173.35563 897.86984
5500.0000 -184.17348 -175.72958 8.44389 2.58862 -175.21286 822.04796
MELTING PROCESS: loop number 23 T-loop= 871.00000000000000
main_MD> interactions number 23 at Temperature= 871.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.09532 -1.32275 -0.90334
force_rgl> df(natom) -1.71325 2.30313 0.45511
5505.0000 -182.58967 -175.77750 6.81217 2.60307 -174.95577 804.45053
5510.0000 -183.46969 -175.15900 8.31069 2.59701 -175.06357 829.17829
5515.0000 -181.94645 -173.54105 8.40540 2.64204 -174.26279 821.74613
5520.0000 -181.82004 -173.59012 8.22992 2.64851 -174.14769 897.61034
5525.0000 -180.03197 -171.67143 8.36055 2.69942 -173.24232 909.89801
5530.0000 -182.35232 -173.92629 8.42603 2.73501 -172.60935 906.93725
5535.0000 -181.29540 -173.45440 7.84100 2.62825 -174.50805 843.99481
5540.0000 -182.61350 -176.29024 6.32326 2.58829 -175.21872 801.24649
5545.0000 -183.70597 -175.57716 8.12880 2.54537 -175.98194 778.87309
5550.0000 -183.42459 -175.47048 7.95411 2.56460 -175.63998 802.39362
5555.0000 -183.22115 -176.09294 7.12821 2.55688 -175.77719 792.49390
5560.0000 -182.25585 -173.63919 8.61665 2.64521 -174.20640 880.85205
5565.0000 -184.83480 -175.64569 9.18911 2.61591 -174.72747 852.31535
5570.0000 -181.68366 -172.81002 8.87364 2.65441 -174.04269 882.40901
5575.0000 -182.95633 -173.78479 9.17154 2.64151 -174.27210 853.08321
5580.0000 -182.14954 -173.82742 8.32212 2.68341 -173.52705 861.27111
5585.0000 -181.75204 -174.19407 7.55797 2.65841 -173.97159 863.08748
5590.0000 -183.74056 -175.60089 8.13967 2.62562 -174.55483 853.00102
5595.0000 -183.99078 -174.74710 9.24368 2.60466 -174.92747 842.74702
5600.0000 -180.16830 -172.22174 7.94656 2.74305 -172.46629 922.19940
5605.0000 -183.24890 -174.20940 9.03950 2.69013 -173.40748 903.80581
5610.0000 -181.58187 -173.38673 8.19514 2.67430 -173.68897 861.47277
5615.0000 -182.62786 -173.53899 9.08887 2.73104 -172.67991 906.00054
5620.0000 -181.73862 -173.53613 8.20249 2.68787 -173.44762 888.68914
5625.0000 -182.54901 -173.61163 8.93737 2.66021 -173.93965 872.40737
5630.0000 -182.04003 -174.23436 7.80568 2.66304 -173.88919 879.03967
5635.0000 -183.47726 -173.37962 10.09764 2.64303 -174.24515 871.01822
5640.0000 -180.78198 -173.30115 7.48083 2.68002 -173.58725 893.06148
5645.0000 -182.27029 -173.97661 8.29368 2.66559 -173.84391 904.02092
5650.0000 -182.27674 -174.11960 8.15714 2.66408 -173.87083 883.29876
5655.0000 -182.45287 -174.75983 7.69304 2.64398 -174.22823 859.07663
5660.0000 -182.37779 -173.21070 9.16709 2.61538 -174.73683 842.36586
5665.0000 -180.48792 -172.39795 8.08997 2.75181 -172.31052 927.06147
5670.0000 -181.59331 -174.22859 7.36472 2.67883 -173.60845 898.65145
5675.0000 -181.79931 -173.81674 7.98257 2.67579 -173.66248 872.58358
5680.0000 -181.98184 -173.63748 8.34436 2.65946 -173.95295 870.15739
5685.0000 -181.50124 -173.54219 7.95904 2.67685 -173.64369 856.42525
5690.0000 -181.77344 -173.49843 8.27501 2.65853 -173.96947 871.59217
5695.0000 -180.80806 -172.15181 8.65625 2.72494 -172.78843 919.65407
5700.0000 -181.13645 -171.41735 9.71910 2.81638 -171.16219 972.26371
5705.0000 -182.75484 -172.41029 10.34455 2.75141 -172.31767 944.51386
5710.0000 -183.36373 -174.17833 9.18540 2.76545 -172.06799 942.72455
5715.0000 -182.39664 -174.35759 8.03905 2.63547 -174.37961 854.32846
5720.0000 -185.42687 -176.83418 8.59269 2.58494 -175.27829 838.61294
5725.0000 -183.70031 -174.98777 8.71254 2.53321 -176.19821 798.49122
5730.0000 -181.99380 -172.81931 9.17449 2.66232 -173.90205 888.17822
5735.0000 -183.37424 -176.28750 7.08674 2.64261 -174.25257 865.10328
5740.0000 -183.40844 -176.25826 7.15018 2.55677 -175.77914 792.23716
5745.0000 -184.56574 -176.15635 8.40939 2.53237 -176.21321 785.03648
5750.0000 -184.05469 -176.53148 7.52321 2.51752 -176.47720 797.08486
MELTING PROCESS: loop number 24 T-loop= 896.00000000000000
main_MD> interactions number 24 at Temperature= 896.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.06588 2.23211 -2.11268
force_rgl> df(natom) 2.41448 1.59588 -0.76804
5755.0000 -183.11859 -175.30727 7.81132 2.55791 -175.75895 818.14042
5760.0000 -183.98336 -175.97355 8.00981 2.56951 -175.55257 838.09810
5765.0000 -181.93174 -174.18056 7.75119 2.63764 -174.34105 848.33798
5770.0000 -183.76924 -174.40046 9.36879 2.67354 -173.70259 888.22930
5775.0000 -183.70253 -175.41488 8.28765 2.64505 -174.20921 870.74486
5780.0000 -182.16078 -174.24716 7.91362 2.61734 -174.70205 823.27911
5785.0000 -182.31446 -173.54072 8.77374 2.67520 -173.67306 888.33425
5790.0000 -182.78360 -173.78706 8.99654 2.69156 -173.38213 914.87315
5795.0000 -182.22104 -173.10059 9.12045 2.66445 -173.86422 896.53297
5800.0000 -183.64295 -174.27613 9.36682 2.63078 -174.46305 864.76925
5805.0000 -183.33988 -174.81399 8.52589 2.58340 -175.30563 814.64903
5810.0000 -180.98903 -173.39628 7.59276 2.66179 -173.91150 878.57214
5815.0000 -181.96513 -173.75933 8.20580 2.68623 -173.47688 886.04910
5820.0000 -181.62679 -172.40418 9.22261 2.71520 -172.96155 896.21484
5825.0000 -182.01588 -173.84261 8.17327 2.70143 -173.20645 896.26938
5830.0000 -180.97332 -172.38169 8.59163 2.69446 -173.33039 871.47132
5835.0000 -182.80269 -172.34239 10.46030 2.77720 -171.85900 948.92257
5840.0000 -181.74276 -173.15879 8.58397 2.69223 -173.37013 880.88170
5845.0000 -183.92691 -175.34339 8.58352 2.69885 -173.25247 898.88934
5850.0000 -180.42209 -172.49714 7.92495 2.67097 -173.74823 881.61702
5855.0000 -180.23310 -171.31874 8.91436 2.75010 -172.34100 910.65704
5860.0000 -180.79044 -171.83251 8.95793 2.80298 -171.40049 940.94878
5865.0000 -181.46734 -172.68514 8.78220 2.73839 -172.54923 933.90538
5870.0000 -180.81937 -170.19654 10.62283 2.86585 -170.28246 991.82700
5875.0000 -181.81714 -172.37069 9.44645 2.80475 -171.36896 970.02792
5880.0000 -184.32164 -174.97764 9.34400 2.71513 -172.96285 906.78915
5885.0000 -182.57937 -175.12783 7.45154 2.59875 -175.03267 823.62863
5890.0000 -182.06233 -173.78796 8.27437 2.64148 -174.27264 851.00744
5895.0000 -184.79890 -175.02599 9.77290 2.63507 -174.38673 880.53883
5900.0000 -181.23130 -173.08039 8.15091 2.65841 -173.97165 893.19785
5905.0000 -183.89401 -175.53404 8.35997 2.65192 -174.08709 892.99084
5910.0000 -182.56979 -173.88250 8.68729 2.63322 -174.41958 871.22072
5915.0000 -183.54214 -174.56976 8.97237 2.66627 -173.83182 885.95874
5920.0000 -182.82880 -173.67753 9.15127 2.60885 -174.85294 841.01839
5925.0000 -182.03043 -172.93730 9.09313 2.69337 -173.34979 877.35936
5930.0000 -181.39842 -172.21441 9.18401 2.77036 -171.98063 936.92991
5935.0000 -181.17330 -171.33475 9.83855 2.76372 -172.09871 918.38582
5940.0000 -181.52474 -172.92748 8.59726 2.71773 -172.91666 909.08067
5945.0000 -182.70090 -173.02853 9.67238 2.72537 -172.78067 921.96878
5950.0000 -180.94405 -172.36025 8.58380 2.71467 -172.97109 922.10045
5955.0000 -180.64803 -171.16122 9.48681 2.77294 -171.93474 922.85771
5960.0000 -181.04753 -171.02148 10.02605 2.81036 -171.26921 939.42847
5965.0000 -181.05588 -171.46418 9.59170 2.81654 -171.15942 961.26079
5970.0000 -180.44385 -170.55973 9.88412 2.77224 -171.94712 919.68310
5975.0000 -179.36722 -168.87307 10.49415 2.90326 -169.61707 1004.78985
5980.0000 -181.84892 -174.18384 7.66508 2.75389 -172.27355 936.57216
5985.0000 -180.37943 -172.28390 8.09553 2.70391 -173.16246 890.31050
5990.0000 -182.08238 -172.60385 9.47853 2.75381 -172.27498 915.88234
5995.0000 -180.81385 -171.49609 9.31776 2.79354 -171.56834 960.63982
6000.0000 -181.62336 -172.91162 8.71173 2.69871 -173.25489 896.60505
MELTING PROCESS: loop number 25 T-loop= 921.00000000000000
main_MD> interactions number 25 at Temperature= 921.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.58525 -0.16227 -0.92019
force_rgl> df(natom) 1.50945 -0.24911 -0.07136
6005.0000 -180.61933 -172.63775 7.98158 2.73013 -172.69618 928.34833
6010.0000 -184.02870 -174.11884 9.90986 2.66401 -173.87204 891.10919
6015.0000 -181.60552 -173.66027 7.94525 2.65701 -173.99645 897.86564
6020.0000 -180.61787 -172.64882 7.96905 2.70636 -173.11888 893.13660
6025.0000 -180.78335 -171.45210 9.33125 2.79961 -171.46042 958.21394
6030.0000 -182.13767 -172.00877 10.12890 2.79033 -171.62549 957.85261
6035.0000 -180.67287 -171.75650 8.91637 2.81418 -171.20138 977.81662
6040.0000 -182.17696 -173.43980 8.73717 2.73420 -172.62370 919.01142
6045.0000 -181.32415 -171.69093 9.63322 2.75023 -172.33868 942.08513
6050.0000 -180.08232 -171.53887 8.54345 2.81106 -171.25677 950.55021
6055.0000 -182.05776 -172.97901 9.07875 2.75906 -172.18151 933.60547
6060.0000 -180.78435 -171.68139 9.10296 2.77082 -171.97236 948.42479
6065.0000 -181.93978 -173.40127 8.53851 2.76188 -172.13144 963.62834
6070.0000 -182.29756 -173.95419 8.34338 2.71286 -173.00328 919.85014
6075.0000 -184.22131 -177.25189 6.96942 2.53674 -176.13542 796.26469
6080.0000 -181.63381 -174.77268 6.86113 2.53785 -176.11561 791.25684
6085.0000 -182.26612 -173.40611 8.86000 2.62074 -174.64163 856.50422
6090.0000 -182.17198 -172.65676 9.51523 2.73258 -172.65248 917.36606
6095.0000 -180.30866 -172.33227 7.97639 2.73370 -172.63257 908.82365
6100.0000 -179.87420 -171.92176 7.95244 2.79467 -171.54822 931.84429
6105.0000 -181.32968 -172.68452 8.64516 2.73884 -172.54122 911.92845
6110.0000 -181.95777 -172.34386 9.61391 2.71566 -172.95338 899.74364
6115.0000 -179.84269 -172.13614 7.70655 2.74089 -172.50478 942.77626
6120.0000 -181.19214 -171.14634 10.04580 2.76552 -172.06662 958.81739
6125.0000 -181.09490 -171.98539 9.10952 2.84299 -170.68888 997.70515
6130.0000 -181.43870 -172.52857 8.91013 2.78757 -171.67452 941.78655
6135.0000 -183.03337 -174.71214 8.32123 2.64954 -174.12928 852.12204
6140.0000 -181.98708 -172.20981 9.77727 2.68653 -173.47149 885.02743
6145.0000 -183.80851 -174.24534 9.56317 2.68199 -173.55217 878.92349
6150.0000 -181.96570 -173.28844 8.67727 2.65037 -174.11467 866.63043
6155.0000 -179.76614 -172.06411 7.70203 2.70338 -173.17178 884.65066
6160.0000 -181.23883 -172.58434 8.65450 2.70777 -173.09384 908.94427
6165.0000 -182.61091 -173.68033 8.93058 2.67656 -173.64884 881.39459
6170.0000 -181.84087 -173.55124 8.28964 2.66973 -173.77034 871.80471
6175.0000 -182.95314 -174.05580 8.89734 2.65741 -173.98941 872.17408
6180.0000 -181.96125 -173.43170 8.52955 2.65752 -173.98749 862.52042
6185.0000 -180.98438 -170.59484 10.38954 2.73050 -172.68949 911.83632
6190.0000 -181.44381 -171.38362 10.06019 2.82725 -170.96879 982.15122
6195.0000 -179.43821 -170.09131 9.34690 2.83474 -170.83564 998.58504
6200.0000 -181.45953 -172.19712 9.26242 2.74267 -172.47310 902.05556
6205.0000 -180.63561 -171.06357 9.57204 2.81249 -171.23128 976.37221
6210.0000 -180.32620 -172.22244 8.10376 2.80037 -171.44696 964.39094
6215.0000 -182.04455 -172.44591 9.59864 2.82109 -171.07836 967.45911
6220.0000 -181.57803 -171.02429 10.55374 2.76907 -172.00353 925.84783
6225.0000 -180.63734 -171.73272 8.90462 2.86284 -170.33591 994.93087
6230.0000 -181.37174 -172.70054 8.67120 2.75964 -172.17125 957.86430
6235.0000 -182.96382 -174.62731 8.33652 2.69452 -173.32934 898.37439
6240.0000 -183.41163 -174.63353 8.77810 2.62030 -174.64937 841.39051
6245.0000 -180.87298 -171.28756 9.58542 2.69485 -173.32361 884.56054
6250.0000 -181.67943 -172.76998 8.90944 2.76240 -172.12226 944.53705
MELTING PROCESS: loop number 26 T-loop= 946.00000000000000
main_MD> interactions number 26 at Temperature= 946.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.08926 -0.73311 2.11453
force_rgl> df(natom) -1.81248 0.29687 -0.95968
6255.0000 -181.59796 -172.53802 9.05994 2.68444 -173.50859 868.16541
6260.0000 -180.40657 -171.41087 8.99571 2.74799 -172.37853 916.24121
6265.0000 -178.44365 -169.22225 9.22140 2.83966 -170.74817 980.00371
6270.0000 -180.51311 -171.29220 9.22091 2.84485 -170.65593 972.98651
6275.0000 -181.73405 -171.37298 10.36106 2.80706 -171.32790 993.51777
6280.0000 -177.97545 -170.42182 7.55363 2.78081 -171.79478 945.85139
6285.0000 -181.24949 -173.36586 7.88363 2.76973 -171.99186 924.76661
6290.0000 -180.91805 -171.51220 9.40585 2.74564 -172.42018 907.44065
6295.0000 -180.31546 -172.02201 8.29345 2.79815 -171.48646 959.06086
6300.0000 -181.45617 -172.82706 8.62911 2.83855 -170.76796 996.28308
6305.0000 -183.73658 -173.50375 10.23284 2.66345 -173.88198 862.46311
6310.0000 -181.89233 -173.31067 8.58166 2.71512 -172.96303 891.87516
6315.0000 -181.83270 -173.02700 8.80570 2.70238 -173.18968 911.94277
6320.0000 -181.54783 -173.57840 7.96944 2.72629 -172.76437 943.98262
6325.0000 -182.80362 -174.21374 8.58988 2.67441 -173.68704 861.23655
6330.0000 -181.51182 -172.63614 8.87568 2.68830 -173.44008 887.52075
6335.0000 -182.17556 -173.67760 8.49797 2.69196 -173.37488 885.14280
6340.0000 -183.72822 -176.35547 7.37275 2.66229 -173.90252 857.22373
6345.0000 -182.98170 -174.41138 8.57033 2.60732 -174.88019 786.45236
6350.0000 -182.07545 -173.09229 8.98316 2.67306 -173.71104 855.74523
6355.0000 -179.45404 -171.43386 8.02017 2.76894 -172.00594 963.89340
6360.0000 -182.86551 -173.22085 9.64466 2.76499 -172.07605 938.98048
6365.0000 -182.31860 -173.06150 9.25710 2.65992 -173.94466 869.51581
6370.0000 -181.98787 -172.43472 9.55315 2.74683 -172.39918 917.37289
6375.0000 -182.41869 -173.39859 9.02010 2.70058 -173.22166 910.10560
6380.0000 -182.14404 -173.70103 8.44301 2.65705 -173.99585 880.99003
6385.0000 -182.15835 -173.90919 8.24915 2.64410 -174.22601 871.28411
6390.0000 -183.27726 -175.04380 8.23346 2.64921 -174.13525 906.63262
6395.0000 -182.27829 -174.96122 7.31707 2.57011 -175.54189 829.16676
6400.0000 -183.41331 -174.87601 8.53730 2.60626 -174.89910 823.32199
6405.0000 -180.91366 -172.94563 7.96803 2.67917 -173.60247 887.24143
6410.0000 -181.25287 -171.00470 10.24816 2.78143 -171.78376 959.94706
6415.0000 -179.15234 -170.06697 9.08537 2.86452 -170.30604 1002.60983
6420.0000 -182.45329 -173.01112 9.44217 2.77994 -171.81028 936.72567
6425.0000 -181.22946 -170.96496 10.26450 2.71907 -172.89281 919.29497
6430.0000 -180.30828 -171.86088 8.44740 2.77932 -171.82121 958.55571
6435.0000 -180.14326 -171.12520 9.01806 2.76525 -172.07143 936.76276
6440.0000 -179.65637 -169.64801 10.00836 2.92866 -169.16527 1045.69816
6445.0000 -179.64276 -170.63588 9.00687 2.88499 -169.94206 1036.20368
6450.0000 -180.23618 -169.90563 10.33055 2.82715 -170.97058 964.41598
6455.0000 -178.41761 -169.11351 9.30410 2.85902 -170.40382 988.00799
6460.0000 -179.93686 -169.98834 9.94852 2.94254 -168.91843 1032.87751
6465.0000 -179.87748 -171.21829 8.65918 2.87199 -170.17325 995.18356
6470.0000 -179.94728 -170.58936 9.35793 2.82798 -170.95596 974.44233
6475.0000 -181.02149 -171.57620 9.44529 2.83568 -170.81902 999.56666
6480.0000 -179.93388 -171.57566 8.35822 2.73622 -172.58783 929.03789
6485.0000 -181.45422 -171.16645 10.28778 2.81959 -171.10511 971.96947
6490.0000 -180.87727 -172.23794 8.63932 2.79154 -171.60395 961.09219
6495.0000 -182.90680 -173.83546 9.07134 2.73723 -172.56974 931.81465
6500.0000 -180.99815 -170.89458 10.10357 2.75485 -172.25641 949.00145
MELTING PROCESS: loop number 27 T-loop= 971.00000000000000
main_MD> interactions number 27 at Temperature= 971.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.37871 0.56091 0.46711
force_rgl> df(natom) 4.08878 2.36993 2.58967
6505.0000 -179.28437 -168.65973 10.62464 2.86154 -170.35907 994.88419
6510.0000 -177.47013 -168.85612 8.61401 2.93618 -169.03153 1056.75124
6515.0000 -181.39115 -171.21282 10.17833 2.81133 -171.25206 980.85459
6520.0000 -180.74256 -171.85477 8.88779 2.75737 -172.21166 929.07965
6525.0000 -182.71556 -172.75093 9.96463 2.74076 -172.50706 931.43118
6530.0000 -180.02038 -171.47255 8.54783 2.79290 -171.57976 947.53031
6535.0000 -181.20426 -171.13787 10.06639 2.81068 -171.26356 966.42135
6540.0000 -179.67945 -170.58675 9.09270 2.84816 -170.59694 969.59605
6545.0000 -179.00448 -170.00322 9.00126 2.91405 -169.42515 999.52591
6550.0000 -180.57782 -170.88979 9.68803 2.85058 -170.55393 972.35843
6555.0000 -183.37049 -173.01192 10.35857 2.77965 -171.81548 957.14861
6560.0000 -178.64368 -168.37008 10.27360 2.86294 -170.33419 1036.57531
6565.0000 -180.86115 -172.22083 8.64033 2.84449 -170.66221 976.25482
6570.0000 -180.15990 -170.41377 9.74613 2.80934 -171.28733 930.95994
6575.0000 -180.35223 -169.57372 10.77851 2.84668 -170.62331 1005.69162
6580.0000 -180.99740 -171.43786 9.55954 2.87961 -170.03764 1022.04305
6585.0000 -178.88186 -170.74578 8.13609 2.81053 -171.26615 940.40341
6590.0000 -179.49679 -170.02349 9.47330 2.83751 -170.78638 946.02068
6595.0000 -178.71668 -167.82476 10.89192 2.88428 -169.95461 1022.67588
6600.0000 -179.69559 -169.21884 10.47675 2.89275 -169.80407 1033.38745
6605.0000 -178.24176 -168.67417 9.56759 2.90322 -169.61786 1035.87912
6610.0000 -178.56520 -168.57390 9.99130 2.95173 -168.75501 1099.50046
6615.0000 -178.70618 -169.98008 8.72609 2.94982 -168.78899 1084.88855
6620.0000 -179.10268 -171.13909 7.96359 2.79686 -171.50934 911.02686
6625.0000 -179.03432 -169.62427 9.41005 2.82011 -171.09589 952.21786
6630.0000 -179.68996 -169.05551 10.63446 2.94467 -168.88069 1083.82850
6635.0000 -180.73531 -171.92536 8.80995 2.89459 -169.77119 998.64690
6640.0000 -182.44038 -173.96366 8.47671 2.73413 -172.62501 922.73820
6645.0000 -181.80728 -172.89836 8.90892 2.72215 -172.83805 907.97304
6650.0000 -182.06896 -173.79432 8.27463 2.70758 -173.09714 895.54452
6655.0000 -181.09796 -172.70388 8.39408 2.67090 -173.74948 877.25771
6660.0000 -184.43343 -176.07506 8.35837 2.64917 -174.13590 855.43932
6665.0000 -180.50105 -171.62196 8.87909 2.64608 -174.19080 874.46150
6670.0000 -180.09317 -171.54562 8.54754 2.82103 -171.07955 952.96556
6675.0000 -181.26769 -170.42992 10.83777 2.78882 -171.65239 950.18965
6680.0000 -180.61320 -171.50628 9.10692 2.80926 -171.28888 943.33324
6685.0000 -180.54327 -171.44799 9.09528 2.85297 -170.51147 1017.86129
6690.0000 -179.97686 -171.26960 8.70726 2.78750 -171.67576 944.52365
6695.0000 -177.39293 -169.77211 7.62082 2.85812 -170.41982 984.14847
6700.0000 -178.87327 -170.84373 8.02953 2.80536 -171.35812 950.61639
6705.0000 -179.80547 -169.17716 10.62831 2.94603 -168.85644 1052.69474
6710.0000 -179.18918 -170.80301 8.38617 2.85834 -170.41597 982.82776
6715.0000 -181.48465 -171.60278 9.88187 2.79156 -171.60361 966.44726
6720.0000 -179.81169 -171.61027 8.20142 2.84647 -170.62712 962.05162
6725.0000 -179.57396 -168.70880 10.86516 2.86669 -170.26740 991.06886
6730.0000 -181.69645 -171.58491 10.11154 2.84068 -170.73008 1000.95860
6735.0000 -181.20682 -170.37778 10.82904 2.88138 -170.00612 979.08972
6740.0000 -181.20182 -171.78228 9.41954 2.74790 -172.38006 950.65725
6745.0000 -178.68230 -169.03823 9.64407 2.84907 -170.58089 1001.00265
6750.0000 -180.75704 -172.35804 8.39899 2.81462 -171.19340 960.27911
MELTING PROCESS: loop number 28 T-loop= 996.00000000000000
main_MD> interactions number 28 at Temperature= 996.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.52063 -0.11610 1.26602
force_rgl> df(natom) 0.54370 -0.31456 2.33728
6755.0000 -181.93722 -172.39137 9.54585 2.70269 -173.18407 892.53350
6760.0000 -180.16078 -168.88384 11.27694 2.80956 -171.28342 944.69768
6765.0000 -180.82335 -171.84202 8.98132 2.90335 -169.61544 1028.50909
6770.0000 -180.16734 -172.10401 8.06333 2.79689 -171.50877 983.18280
6775.0000 -182.61758 -172.70615 9.91143 2.78721 -171.68096 953.50785
6780.0000 -180.13265 -168.55180 11.58084 2.83566 -170.81928 976.91639
6785.0000 -179.67078 -169.94142 9.72936 2.89316 -169.79674 1041.63854
6790.0000 -180.62364 -169.34148 11.28216 2.91005 -169.49629 1033.52731
6795.0000 -180.90932 -170.14224 10.76708 2.86523 -170.29335 1015.98543
6800.0000 -179.72781 -170.19115 9.53667 2.86052 -170.37720 987.82265
6805.0000 -178.03915 -168.36190 9.67725 2.95995 -168.60878 1091.34876
6810.0000 -177.83678 -167.94332 9.89346 2.98524 -168.15910 1084.61107
6815.0000 -178.59052 -169.26780 9.32272 2.94235 -168.92179 1015.01148
6820.0000 -180.96017 -169.51618 11.44399 2.86314 -170.33050 978.72289
6825.0000 -180.87994 -170.45598 10.42396 2.88245 -169.98719 1029.11644
6830.0000 -181.43644 -171.46821 9.96823 2.79817 -171.48608 958.39292
6835.0000 -180.57079 -172.10201 8.46878 2.81165 -171.24637 984.85381
6840.0000 -180.89354 -171.24521 9.64833 2.81584 -171.17181 948.94948
6845.0000 -180.00715 -171.09403 8.91313 2.79895 -171.47218 964.88011
6850.0000 -180.05662 -170.99249 9.06413 2.82050 -171.08892 965.00473
6855.0000 -180.26650 -170.98147 9.28503 2.85245 -170.52076 971.26899
6860.0000 -180.25908 -170.58431 9.67478 2.87375 -170.14192 1018.20505
6865.0000 -179.89977 -170.16431 9.73546 2.88364 -169.96608 1011.66675
6870.0000 -181.17985 -171.65387 9.52598 2.84006 -170.74099 1001.41622
6875.0000 -180.85304 -170.51643 10.33660 2.84794 -170.60089 979.82359
6880.0000 -179.92410 -171.06483 8.85927 2.84596 -170.63610 984.08182
6885.0000 -179.29851 -168.82716 10.47135 2.85909 -170.40262 988.89530
6890.0000 -180.06063 -170.75742 9.30321 2.90974 -169.50188 1030.88666
6895.0000 -179.71468 -170.00928 9.70541 2.85573 -170.46239 977.90309
6900.0000 -181.17789 -172.20931 8.96857 2.80817 -171.30822 946.09533
6905.0000 -179.56106 -170.57893 8.98213 2.82156 -171.07012 950.38510
6910.0000 -179.69479 -169.64041 10.05439 2.86599 -170.27990 1020.83400
6915.0000 -180.91882 -171.42541 9.49342 2.82993 -170.92115 974.57632
6920.0000 -182.35590 -173.11399 9.24191 2.78717 -171.68158 992.70730
6925.0000 -182.39415 -170.96557 11.42858 2.67245 -173.72185 902.35487
6930.0000 -180.89066 -171.73940 9.15125 2.81257 -171.22999 1005.33693
6935.0000 -180.84488 -170.51188 10.33300 2.81359 -171.21174 976.43508
6940.0000 -180.99873 -170.28635 10.71238 2.85948 -170.39574 1008.62731
6945.0000 -180.13873 -171.05362 9.08511 2.80228 -171.41291 977.65367
6950.0000 -181.51302 -173.07141 8.44161 2.80379 -171.38617 979.63299
6955.0000 -180.68478 -171.88374 8.80105 2.77636 -171.87388 956.34465
6960.0000 -180.40912 -169.58256 10.82657 2.86545 -170.28955 1047.06436
6965.0000 -179.73059 -171.65624 8.07435 2.84387 -170.67326 990.74131
6970.0000 -180.14399 -170.51753 9.62645 2.83059 -170.90954 960.85420
6975.0000 -180.51526 -170.37408 10.14119 2.89787 -169.71293 1000.52892
6980.0000 -180.71748 -171.63787 9.07961 2.85345 -170.50284 1000.98372
6985.0000 -180.49299 -171.16803 9.32496 2.80685 -171.33166 933.88780
6990.0000 -181.32064 -170.37091 10.94973 2.81756 -171.14117 973.19581
6995.0000 -181.44642 -172.40757 9.03885 2.75321 -172.28563 923.24817
7000.0000 -181.30941 -171.61083 9.69857 2.83410 -170.84697 1017.41641
MELTING PROCESS: loop number 29 T-loop= 1021.0000000000000
main_MD> interactions number 29 at Temperature= 1021.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.22596 3.94392 -8.98730
force_rgl> df(natom) 0.07844 -0.96638 -0.70383
7005.0000 -176.37498 -167.19281 9.18217 2.82330 -171.03903 974.54417
7010.0000 -177.73233 -166.53921 11.19312 3.03171 -167.33260 1107.14291
7015.0000 -178.45154 -167.33307 11.11847 3.05925 -166.84294 1138.26457
7020.0000 -176.75705 -167.81496 8.94208 2.98385 -168.18376 1090.88238
7025.0000 -179.90200 -168.61382 11.28818 2.95850 -168.63466 1075.96582
7030.0000 -179.54817 -169.43112 10.11705 2.94193 -168.92934 1040.79463
7035.0000 -177.25540 -167.55807 9.69733 2.94600 -168.85694 1058.15516
7040.0000 -179.38255 -169.34770 10.03485 2.99920 -167.91076 1116.99961
7045.0000 -181.26847 -170.53186 10.73661 2.85845 -170.41406 1010.29375
7050.0000 -179.31360 -169.13453 10.17907 2.82609 -170.98946 978.68190
7055.0000 -179.02514 -169.55000 9.47514 2.92120 -169.29810 979.81274
7060.0000 -178.95123 -169.80220 9.14902 2.88080 -170.01650 1002.81391
7065.0000 -180.30584 -171.25626 9.04957 2.81556 -171.17672 933.39832
7070.0000 -180.39970 -171.94479 8.45492 2.80795 -171.31218 917.97561
7075.0000 -180.80871 -171.10067 9.70804 2.78132 -171.78578 946.23144
7080.0000 -180.03285 -171.29486 8.73799 2.77930 -171.82162 941.00353
7085.0000 -180.78164 -171.19881 9.58283 2.81988 -171.10003 968.62439
7090.0000 -180.40659 -170.34395 10.06263 2.83500 -170.83109 1010.63504
7095.0000 -177.76056 -168.17698 9.58358 2.93068 -169.12948 1052.53536
7100.0000 -178.41033 -168.27631 10.13402 2.97037 -168.42355 1046.07678
7105.0000 -178.52767 -171.23767 7.29001 2.87425 -170.13297 1029.32788
7110.0000 -182.26466 -172.71255 9.55210 2.78306 -171.75476 926.81644
7115.0000 -179.62782 -170.16102 9.46680 2.86164 -170.35722 995.92753
7120.0000 -181.62149 -170.32233 11.29917 2.87107 -170.18954 995.14474
7125.0000 -179.73628 -169.87741 9.85886 2.90109 -169.65563 1022.99297
7130.0000 -177.76127 -168.21696 9.54431 2.91614 -169.38809 1031.95004
7135.0000 -179.74610 -169.44656 10.29954 2.95888 -168.62784 1047.10830
7140.0000 -179.40055 -169.69175 9.70879 2.94099 -168.94608 1031.43718
7145.0000 -180.40399 -168.78601 11.61797 2.89144 -169.82724 1026.68667
7150.0000 -179.53886 -169.25076 10.28810 2.97431 -168.35342 1055.47865
7155.0000 -180.23663 -170.49393 9.74270 2.87011 -170.20668 1020.54235
7160.0000 -179.95795 -170.78434 9.17362 2.80412 -171.38020 972.95547
7165.0000 -178.78854 -170.69568 8.09286 2.93918 -168.97826 1028.45717
7170.0000 -180.70135 -172.17612 8.52523 2.79523 -171.53824 952.51815
7175.0000 -182.32102 -174.08485 8.23617 2.70011 -173.22994 896.86850
7180.0000 -182.79700 -173.16563 9.63137 2.72754 -172.74216 927.69043
7185.0000 -179.49854 -170.07435 9.42418 2.79017 -171.62827 959.29536
7190.0000 -180.21606 -169.58974 10.62632 2.87399 -170.13757 1022.50833
7195.0000 -180.74636 -170.53369 10.21267 2.93365 -169.07652 1046.19448
7200.0000 -180.31237 -171.15491 9.15746 2.90405 -169.60298 1014.37016
7205.0000 -180.12840 -169.01833 11.11007 2.84577 -170.63943 1008.79058
7210.0000 -179.81991 -169.78478 10.03512 2.91982 -169.32250 1059.57557
7215.0000 -180.41317 -171.53472 8.87845 2.88219 -169.99176 1012.37556
7220.0000 -181.57679 -172.49740 9.07940 2.77369 -171.92142 936.36406
7225.0000 -181.81573 -172.30637 9.50936 2.77285 -171.93642 941.75099
7230.0000 -180.55096 -171.15008 9.40088 2.79251 -171.58679 961.17287
7235.0000 -180.10298 -169.32761 10.77536 2.87018 -170.20535 1005.08174
7240.0000 -178.96187 -169.11781 9.84406 2.86922 -170.22241 993.47871
7245.0000 -179.68999 -170.22404 9.46596 2.89350 -169.79059 1007.04860
7250.0000 -180.26686 -171.99650 8.27036 2.75355 -172.27960 928.13201
MELTING PROCESS: loop number 30 T-loop= 1046.0000000000000
main_MD> interactions number 30 at Temperature= 1046.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.06670 -3.54076 -0.59572
force_rgl> df(natom) -0.52657 2.85040 1.27268
7255.0000 -180.22947 -170.46237 9.76710 2.82712 -170.97115 983.66481
7260.0000 -177.88876 -168.60012 9.28864 2.98987 -168.07683 1069.00249
7265.0000 -177.98073 -168.64047 9.34026 2.92781 -169.18046 1038.58120
7270.0000 -181.34433 -171.43678 9.90755 2.86552 -170.28824 987.87023
7275.0000 -182.33125 -173.30580 9.02545 2.76643 -172.05059 960.62729
7280.0000 -179.98757 -170.15036 9.83721 2.79594 -171.52578 973.08932
7285.0000 -177.27097 -168.96409 8.30688 2.88150 -170.00411 1008.59610
7290.0000 -179.43250 -168.50334 10.92916 2.97531 -168.33577 1065.12099
7295.0000 -177.61572 -168.48992 9.12580 3.01732 -167.58858 1116.29301
7300.0000 -178.66072 -169.36460 9.29612 2.97156 -168.40234 1047.85652
7305.0000 -179.86576 -169.77396 10.09180 2.86693 -170.26310 991.86581
7310.0000 -181.29178 -172.14961 9.14217 2.86313 -170.33069 1005.78016
7315.0000 -179.90445 -170.60443 9.30003 2.85360 -170.50026 996.96471
7320.0000 -178.39391 -169.62145 8.77247 2.94375 -168.89695 1052.27152
7325.0000 -176.88135 -168.51772 8.36362 2.90857 -169.52264 1023.39088
7330.0000 -179.05323 -169.12830 9.92492 2.91066 -169.48548 1007.27287
7335.0000 -178.66807 -168.69548 9.97260 2.91764 -169.36139 1028.48081
7340.0000 -179.49917 -168.62638 10.87279 2.95077 -168.77211 1041.64992
7345.0000 -178.47652 -167.53130 10.94522 3.01681 -167.59769 1073.74132
7350.0000 -177.49865 -167.64255 9.85610 3.04424 -167.10987 1111.26733
7355.0000 -179.95454 -168.36873 11.58581 2.92765 -169.18322 1029.14229
7360.0000 -178.71532 -167.58748 11.12784 2.98818 -168.10685 1111.75943
7365.0000 -178.58686 -167.30268 11.28417 3.04205 -167.14870 1094.39821
7370.0000 -177.08703 -167.33970 9.74732 2.99255 -168.02912 1083.66317
7375.0000 -178.15397 -166.30199 11.85198 3.05266 -166.96001 1151.80215
7380.0000 -179.63970 -169.55767 10.08203 2.94169 -168.93360 1039.02046
7385.0000 -178.89056 -168.88256 10.00799 2.93545 -169.04460 1058.83157
7390.0000 -180.78662 -171.36583 9.42079 2.82127 -171.07527 979.77285
7395.0000 -181.64680 -170.96005 10.68675 2.78992 -171.63280 956.95517
7400.0000 -180.22979 -170.52418 9.70561 2.93563 -169.04135 1062.03312
7405.0000 -181.22133 -170.69921 10.52212 2.81512 -171.18453 975.50912
7410.0000 -179.36261 -170.02168 9.34093 2.89285 -169.80229 1032.53968
7415.0000 -178.40841 -167.58194 10.82646 2.93621 -169.03112 1067.24825
7420.0000 -179.28937 -166.66691 12.62246 3.09817 -166.15064 1187.25999
7425.0000 -179.66056 -168.95162 10.70894 2.96807 -168.46455 1077.28111
7430.0000 -180.01704 -170.13502 9.88202 2.89060 -169.84226 1004.54818
7435.0000 -180.28880 -170.94707 9.34173 2.88860 -169.87771 1010.88260
7440.0000 -180.79518 -171.28142 9.51376 2.85185 -170.53135 1009.40374
7445.0000 -178.38491 -169.63272 8.75219 2.93822 -168.99541 1035.08428
7450.0000 -179.78921 -171.94943 7.83977 2.89398 -169.78203 1038.24204
7455.0000 -179.20094 -170.08153 9.11941 2.82213 -171.05995 985.75429
7460.0000 -180.08060 -170.47751 9.60310 2.88318 -169.97417 1014.11934
7465.0000 -180.30711 -169.41361 10.89350 2.86276 -170.33740 978.31218
7470.0000 -178.01996 -167.67395 10.34601 2.88753 -169.89681 1041.18369
7475.0000 -181.44867 -171.89100 9.55768 2.90419 -169.60056 1019.94024
7480.0000 -181.54774 -172.68209 8.86564 2.71895 -172.89495 907.41170
7485.0000 -179.36562 -168.25787 11.10775 2.89669 -169.73392 1023.33474
7490.0000 -180.66019 -171.02670 9.63348 2.89381 -169.78521 1017.06273
7495.0000 -181.43087 -169.95179 11.47908 2.87209 -170.17136 1007.85588
7500.0000 -178.84745 -169.32186 9.52559 2.92481 -169.23381 1021.53918
MELTING PROCESS: loop number 31 T-loop= 1071.0000000000000
main_MD> interactions number 31 at Temperature= 1071.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.14275 -0.30800 -1.41884
force_rgl> df(natom) -1.07378 -4.10317 2.51257
7505.0000 -178.59821 -168.54701 10.05120 2.94823 -168.81738 1050.44288
7510.0000 -179.45849 -170.50523 8.95326 2.85568 -170.46332 991.46478
7515.0000 -179.95135 -169.64177 10.30958 2.87924 -170.04422 1010.03919
7520.0000 -177.65171 -169.89787 7.75384 2.91021 -169.49349 1007.48043
7525.0000 -180.66782 -169.03840 11.62942 2.97146 -168.40423 1066.60219
7530.0000 -180.42402 -171.26569 9.15833 2.92359 -169.25555 1022.77573
7535.0000 -180.18173 -170.31207 9.86966 2.87178 -170.17692 993.73728
7540.0000 -180.07901 -169.18863 10.89039 2.88823 -169.88436 1018.18564
7545.0000 -179.02421 -167.54708 11.47713 2.98186 -168.21926 1091.21736
7550.0000 -178.55453 -167.36722 11.18731 3.01005 -167.71787 1066.99460
7555.0000 -178.85311 -169.13362 9.71949 2.93633 -169.02890 1025.38157
7560.0000 -179.79014 -168.78259 11.00755 2.93387 -169.07270 1053.32630
7565.0000 -180.83229 -168.89466 11.93763 2.92290 -169.26783 1050.48270
7570.0000 -180.80878 -169.69341 11.11537 2.92305 -169.26504 1071.58391
7575.0000 -181.06572 -169.96310 11.10262 2.91176 -169.46592 1043.58306
7580.0000 -178.68748 -167.41772 11.26976 2.93964 -168.96999 1055.55561
7585.0000 -178.32564 -167.38792 10.93772 3.06267 -166.78213 1156.83956
7590.0000 -176.84975 -167.96532 8.88443 3.07902 -166.49121 1175.51695
7595.0000 -176.45287 -166.24802 10.20485 2.98969 -168.07990 1096.69495
7600.0000 -177.88279 -168.66447 9.21832 2.92954 -169.14974 1051.83174
7605.0000 -180.63699 -169.65512 10.98188 2.92890 -169.16108 1044.25960
7610.0000 -178.51883 -168.19023 10.32860 2.89021 -169.84909 1014.10022
7615.0000 -180.39247 -170.45635 9.93612 2.89712 -169.72619 999.54198
7620.0000 -180.34209 -170.83697 9.50512 2.84375 -170.67545 979.71722
7625.0000 -179.22810 -167.98540 11.24270 2.97482 -168.34434 1108.61450
7630.0000 -177.92361 -168.79218 9.13143 2.95309 -168.73082 1036.58792
7635.0000 -179.26915 -167.30821 11.96094 2.96606 -168.50028 1063.49841
7640.0000 -180.01987 -170.55986 9.46001 2.93794 -169.00029 1051.61626
7645.0000 -179.18455 -168.74819 10.43636 2.90119 -169.65392 996.63330
7650.0000 -178.21161 -168.34839 9.86322 3.02334 -167.48159 1111.55173
7655.0000 -179.19490 -167.01300 12.18190 2.99101 -168.05645 1092.76905
7660.0000 -179.92894 -169.42802 10.50092 3.00602 -167.78950 1080.83489
7665.0000 -180.25176 -170.46854 9.78321 2.89535 -169.75777 1015.49970
7670.0000 -179.04587 -168.44111 10.60476 2.92203 -169.28329 1048.82665
7675.0000 -179.10473 -167.89642 11.20831 2.97042 -168.42262 1059.09809
7680.0000 -178.99016 -169.35797 9.63218 3.00791 -167.75593 1122.28861
7685.0000 -178.84738 -169.08077 9.76661 2.92049 -169.31061 1050.20396
7690.0000 -179.63949 -168.31132 11.32817 2.95973 -168.61284 1079.75576
7695.0000 -179.20633 -168.97196 10.23437 3.00028 -167.89170 1085.49156
7700.0000 -177.49277 -166.94927 10.54350 3.03319 -167.30632 1109.26524
7705.0000 -178.03345 -166.27916 11.75429 3.05525 -166.91395 1137.16557
7710.0000 -179.56798 -169.14279 10.42520 3.00265 -167.84946 1080.94534
7715.0000 -178.51874 -165.79080 12.72794 3.08188 -166.44035 1153.67218
7720.0000 -179.07500 -166.96398 12.11103 3.09304 -166.24188 1154.30155
7725.0000 -177.00553 -165.10550 11.90003 3.04010 -167.18340 1108.26487
7730.0000 -176.51716 -166.09658 10.42059 3.11598 -165.83391 1131.09846
7735.0000 -178.82472 -170.80936 8.01536 3.00244 -167.85317 1084.59815
7740.0000 -179.11632 -170.32051 8.79581 2.88293 -169.97860 988.10147
7745.0000 -178.77981 -169.55729 9.22252 2.92443 -169.24053 1021.93112
7750.0000 -178.67717 -168.00749 10.66968 2.98385 -168.18375 1095.27055
MELTING PROCESS: loop number 32 T-loop= 1096.0000000000000
main_MD> interactions number 32 at Temperature= 1096.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.11039 1.48455 -1.11075
force_rgl> df(natom) -1.72626 -4.67708 3.29832
7755.0000 -179.57152 -170.74894 8.82258 2.96622 -168.49730 1047.53470
7760.0000 -179.92283 -167.31446 12.60837 2.93797 -168.99973 1034.08034
7765.0000 -178.46840 -167.80612 10.66227 3.04538 -167.08954 1120.21613
7770.0000 -178.97178 -168.65779 10.31399 2.95225 -168.74587 1065.83366
7775.0000 -177.83292 -168.43972 9.39320 2.92131 -169.29598 1061.49718
7780.0000 -177.97086 -166.90612 11.06474 3.00628 -167.78493 1088.46640
7785.0000 -177.85814 -167.44737 10.41077 3.10056 -166.10813 1144.62412
7790.0000 -178.02293 -167.31149 10.71144 3.08195 -166.43914 1125.98006
7795.0000 -177.57891 -164.26153 13.31738 3.09765 -166.15991 1222.10284
7800.0000 -177.57031 -167.13912 10.43118 3.11635 -165.82744 1153.06251
7805.0000 -178.70826 -170.82075 7.88751 2.90920 -169.51139 1023.58663
7810.0000 -178.77766 -167.91601 10.86165 2.87440 -170.13025 1007.09994
7815.0000 -178.53489 -167.78019 10.75469 2.98085 -168.23725 1081.97290
7820.0000 -179.08426 -166.06957 13.01469 3.06455 -166.74864 1135.19718
7825.0000 -178.15228 -167.37865 10.77363 3.04269 -167.13733 1124.49869
7830.0000 -178.00682 -166.01816 11.98866 3.02062 -167.52982 1117.28697
7835.0000 -178.09506 -167.15604 10.93902 3.07289 -166.60032 1139.40740
7840.0000 -177.22216 -168.55396 8.66820 2.99566 -167.97374 1071.94579
7845.0000 -177.56483 -166.14865 11.41618 3.00543 -167.80001 1092.81814
7850.0000 -180.02745 -171.12292 8.90453 3.03724 -167.23429 1150.29990
7855.0000 -180.54757 -170.42498 10.12259 2.85820 -170.41852 996.41963
7860.0000 -179.36946 -170.28206 9.08740 2.88692 -169.90770 992.34633
7865.0000 -180.98064 -169.94526 11.03538 2.89708 -169.72702 1047.38387
7870.0000 -180.53623 -171.08770 9.44853 2.81390 -171.20633 956.46285
7875.0000 -181.10432 -170.50047 10.60385 2.84247 -170.69815 1002.25167
7880.0000 -177.08727 -166.63403 10.45324 3.01237 -167.67662 1088.19605
7885.0000 -178.39337 -167.92856 10.46481 3.06265 -166.78244 1119.92787
7890.0000 -179.95019 -169.68604 10.26415 2.95210 -168.74850 1053.04776
7895.0000 -179.16326 -168.38049 10.78277 2.95159 -168.75756 1071.38823
7900.0000 -177.36990 -168.56631 8.80359 3.01158 -167.69070 1083.72011
7905.0000 -178.04299 -167.47408 10.56892 2.91749 -169.36406 1050.13312
7910.0000 -180.17304 -169.09486 11.07818 2.98363 -168.18770 1106.43259
7915.0000 -177.48364 -165.26549 12.21815 3.08098 -166.45642 1150.09675
7920.0000 -177.66533 -168.32187 9.34346 3.09789 -166.15571 1153.39147
7925.0000 -177.80158 -166.75161 11.04997 3.00098 -167.87925 1082.65641
7930.0000 -177.52843 -166.97764 10.55079 3.03123 -167.34127 1127.52006
7935.0000 -177.44400 -168.33082 9.11318 3.03058 -167.35277 1100.24059
7940.0000 -178.99026 -167.82184 11.16843 2.98944 -168.08444 1073.61100
7945.0000 -178.01513 -168.16702 9.84812 2.92649 -169.20395 1038.64205
7950.0000 -176.93855 -166.08388 10.85466 3.00619 -167.78646 1068.61751
7955.0000 -177.01057 -166.19455 10.81601 3.05269 -166.95947 1105.94504
7960.0000 -178.23345 -167.83100 10.40244 3.04618 -167.07538 1138.85456
7965.0000 -179.90985 -168.65357 11.25629 2.98740 -168.12063 1078.65540
7970.0000 -179.00226 -169.62568 9.37658 2.96688 -168.48555 1083.85776
7975.0000 -178.66968 -169.31330 9.35638 2.92966 -169.14752 1035.34944
7980.0000 -179.03663 -166.87674 12.15989 3.01148 -167.69243 1116.53048
7985.0000 -179.68403 -170.00250 9.68153 2.94430 -168.88718 1036.73067
7990.0000 -180.72335 -170.29906 10.42429 2.86225 -170.34632 1010.43363
7995.0000 -179.14541 -170.54766 8.59775 2.82334 -171.03833 971.98449
8000.0000 -177.03278 -166.93308 10.09970 2.97748 -168.29711 1072.66356
MELTING PROCESS: loop number 33 T-loop= 1121.0000000000000
main_MD> interactions number 33 at Temperature= 1121.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.24749 -1.57612 1.81097
force_rgl> df(natom) -2.12498 -1.27460 -0.83467
8005.0000 -177.88911 -168.12682 9.76229 2.98106 -168.23350 1078.07368
8010.0000 -179.08144 -169.07094 10.01050 2.96326 -168.54994 1055.72979
8015.0000 -178.38203 -168.00094 10.38108 2.96920 -168.44437 1066.44539
8020.0000 -180.04754 -169.76372 10.28382 2.91361 -169.43293 1026.84339
8025.0000 -179.51177 -168.40142 11.11035 2.93254 -169.09631 1044.96292
8030.0000 -177.40058 -165.98767 11.41292 2.94531 -168.86915 1061.39132
8035.0000 -179.43299 -168.75162 10.68137 3.01415 -167.64492 1107.93466
8040.0000 -178.75276 -165.77408 12.97867 3.02613 -167.43180 1136.53820
8045.0000 -177.88706 -166.61804 11.26902 3.08024 -166.46960 1155.95162
8050.0000 -178.16330 -166.92044 11.24286 3.08510 -166.38322 1158.25894
8055.0000 -178.85257 -166.43761 12.41496 3.10387 -166.04937 1151.07767
8060.0000 -178.65149 -167.23397 11.41752 3.03851 -167.21180 1136.12944
8065.0000 -178.34232 -164.61598 13.72635 3.12232 -165.72128 1167.19068
8070.0000 -178.30640 -166.39671 11.90969 3.22251 -163.93934 1270.29799
8075.0000 -177.79616 -167.64586 10.15030 3.02797 -167.39923 1094.42116
8080.0000 -177.14062 -166.85154 10.28909 3.10774 -165.98057 1170.89903
8085.0000 -177.40289 -166.71079 10.69210 3.08680 -166.35294 1159.93687
8090.0000 -175.88028 -165.18951 10.69077 3.14382 -165.33881 1210.66796
8095.0000 -175.31906 -161.85215 13.46692 3.25957 -163.28032 1271.22297
8100.0000 -176.80378 -164.07607 12.72772 3.25381 -163.38278 1248.46323
8105.0000 -177.29794 -165.45557 11.84237 3.20034 -164.33368 1228.14113
8110.0000 -177.80157 -165.98343 11.81815 3.14767 -165.27036 1178.19804
8115.0000 -176.85910 -166.00208 10.85702 3.07398 -166.58098 1143.99442
8120.0000 -176.37921 -164.00665 12.37256 3.14516 -165.31494 1220.40227
8125.0000 -178.05003 -165.68423 12.36580 3.11757 -165.80561 1189.11367
8130.0000 -177.27556 -167.84737 9.42819 2.99939 -167.90742 1109.20667
8135.0000 -178.91504 -167.33600 11.57904 3.05982 -166.83269 1138.52793
8140.0000 -177.78562 -166.57138 11.21424 3.05190 -166.97358 1120.42016
8145.0000 -178.60422 -166.59877 12.00545 3.02052 -167.53163 1102.95738
8150.0000 -177.89819 -166.96825 10.92994 3.07846 -166.50116 1138.73346
8155.0000 -176.90238 -164.88550 12.01688 3.08716 -166.34644 1172.24226
8160.0000 -179.12186 -168.13761 10.98425 3.11532 -165.84565 1172.96229
8165.0000 -177.29721 -166.98413 10.31308 3.02331 -167.48210 1098.22007
8170.0000 -177.21536 -166.35571 10.85965 3.06905 -166.66863 1128.71742
8175.0000 -179.28223 -169.86977 9.41246 2.98138 -168.22777 1058.71264
8180.0000 -177.87267 -167.18245 10.69022 2.97586 -168.32590 1079.21627
8185.0000 -179.01699 -168.35233 10.66465 3.08859 -166.32110 1148.01738
8190.0000 -177.20795 -165.96062 11.24733 3.04368 -167.11982 1093.97516
8195.0000 -177.79031 -167.23403 10.55628 3.06812 -166.68515 1129.57746
8200.0000 -178.60784 -168.10106 10.50678 3.02387 -167.47209 1117.19974
8205.0000 -177.25364 -166.07902 11.17462 3.05335 -166.94781 1109.32680
8210.0000 -178.25003 -166.29292 11.95711 3.09414 -166.22235 1152.55152
8215.0000 -177.83329 -167.72665 10.10663 3.06353 -166.76683 1139.02252
8220.0000 -176.39020 -166.39390 9.99631 3.02125 -167.51864 1094.13517
8225.0000 -177.65865 -167.34780 10.31085 3.04921 -167.02150 1111.38897
8230.0000 -177.17744 -166.51309 10.66436 3.08479 -166.38868 1101.90089
8235.0000 -177.79282 -168.18848 9.60434 3.02807 -167.39732 1120.55894
8240.0000 -176.44645 -168.19924 8.24721 3.05438 -166.92945 1113.87413
8245.0000 -177.75357 -166.07285 11.68071 3.09227 -166.25555 1149.30320
8250.0000 -177.42199 -165.55594 11.86605 3.08338 -166.41381 1119.37587
MELTING PROCESS: loop number 34 T-loop= 1146.0000000000000
main_MD> interactions number 34 at Temperature= 1146.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.04726 -2.92365 -4.38746
force_rgl> df(natom) 2.93096 -5.30607 1.69013
8255.0000 -177.71247 -165.54199 12.17048 3.12073 -165.74956 1179.00686
8260.0000 -177.27114 -165.50386 11.76728 3.07830 -166.50415 1176.85199
8265.0000 -177.76266 -166.16545 11.59721 3.08801 -166.33137 1159.27037
8270.0000 -175.46899 -165.46954 9.99945 3.09309 -166.24103 1138.55767
8275.0000 -175.88368 -165.88620 9.99748 3.18839 -164.54618 1206.10930
8280.0000 -175.75234 -163.59782 12.15452 3.17280 -164.82352 1188.72633
8285.0000 -177.63142 -165.59393 12.03750 3.20854 -164.18775 1248.29179
8290.0000 -177.69223 -165.11848 12.57375 3.11212 -165.90262 1153.69567
8295.0000 -175.38358 -164.44895 10.93463 3.17027 -164.86847 1208.91988
8300.0000 -178.10688 -168.16588 9.94100 3.13508 -165.49420 1228.50609
8305.0000 -178.26202 -168.02644 10.23557 2.98497 -168.16392 1079.16061
8310.0000 -176.26751 -164.44132 11.82619 3.07679 -166.53095 1133.06238
8315.0000 -176.30517 -165.93438 10.37080 3.16787 -164.91113 1201.53831
8320.0000 -177.45281 -165.29319 12.15962 3.17373 -164.80692 1222.34969
8325.0000 -174.96427 -165.38015 9.58412 3.19037 -164.51095 1214.91779
8330.0000 -177.58674 -165.96257 11.62417 3.06993 -166.65288 1115.85909
8335.0000 -178.77142 -166.88904 11.88238 3.16514 -164.95959 1187.80874
8340.0000 -176.81458 -164.67901 12.13557 3.09625 -166.18492 1126.08768
8345.0000 -176.58549 -165.23971 11.34577 3.13501 -165.49554 1152.95673
8350.0000 -179.03441 -168.83315 10.20126 3.00498 -167.80805 1103.81767
8355.0000 -176.46086 -166.64109 9.81977 3.01565 -167.61834 1098.53917
8360.0000 -179.73481 -168.96203 10.77278 2.99790 -167.93390 1065.17831
8365.0000 -177.36010 -167.22729 10.13280 3.01991 -167.54246 1096.60229
8370.0000 -178.11579 -167.29321 10.82257 3.05672 -166.88795 1135.49249
8375.0000 -177.72002 -166.97477 10.74526 2.99412 -168.00110 1086.82577
8380.0000 -175.64768 -165.82651 9.82117 3.09566 -166.19541 1155.15896
8385.0000 -177.63502 -165.78921 11.84582 3.10426 -166.04234 1177.13267
8390.0000 -177.54632 -164.28908 13.25724 3.15153 -165.20167 1189.16195
8395.0000 -176.27101 -165.90483 10.36618 3.16967 -164.87912 1175.23736
8400.0000 -176.55818 -163.94630 12.61189 3.17903 -164.71261 1200.99187
8405.0000 -179.14793 -168.78345 10.36449 3.09032 -166.29037 1181.14218
8410.0000 -176.88252 -165.80864 11.07388 3.06383 -166.76134 1156.28652
8415.0000 -178.59897 -167.04610 11.55287 3.06018 -166.82631 1164.67608
8420.0000 -178.06403 -164.85819 13.20584 3.14213 -165.36884 1166.16887
8425.0000 -174.06618 -163.15621 10.90997 3.17572 -164.77143 1171.21163
8430.0000 -176.10468 -164.38461 11.72007 3.29513 -162.64783 1305.69240
8435.0000 -175.74485 -164.12554 11.61932 3.24843 -163.47846 1263.74502
8440.0000 -175.28136 -164.45736 10.82400 3.16864 -164.89750 1244.52375
8445.0000 -174.25629 -162.77346 11.48282 3.23473 -163.72214 1231.55535
8450.0000 -179.15466 -168.32830 10.82636 3.14485 -165.32060 1164.95004
8455.0000 -179.87189 -168.29490 11.57699 3.02432 -167.46402 1084.14083
8460.0000 -179.12409 -167.93734 11.18674 2.99938 -167.90756 1061.95887
8465.0000 -177.70346 -166.61851 11.08494 3.01385 -167.65031 1091.87264
8470.0000 -177.55739 -164.70241 12.85499 3.13193 -165.55024 1132.85374
8475.0000 -176.91932 -163.44528 13.47404 3.19319 -164.46074 1192.35961
8480.0000 -178.72002 -166.63232 12.08770 3.12854 -165.61067 1164.40781
8485.0000 -177.78595 -166.25184 11.53411 2.98885 -168.09490 1102.70609
8490.0000 -176.61418 -166.05844 10.55574 3.05540 -166.91136 1111.83275
8495.0000 -175.91071 -165.68460 10.22611 3.12994 -165.58569 1167.00783
8500.0000 -176.93550 -165.24671 11.68879 3.08301 -166.42035 1115.20290
MELTING PROCESS: loop number 35 T-loop= 1171.0000000000000
main_MD> interactions number 35 at Temperature= 1171.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.22700 -0.14617 -0.52970
force_rgl> df(natom) -0.72258 -3.79900 -3.94058
8505.0000 -178.03071 -168.15700 9.87371 3.08482 -166.38805 1119.14732
8510.0000 -178.60654 -168.15885 10.44769 2.92680 -169.19849 1046.61047
8515.0000 -178.09832 -165.50002 12.59831 3.11032 -165.93459 1134.95106
8520.0000 -177.12221 -167.38835 9.73386 3.04174 -167.15431 1124.24822
8525.0000 -176.70651 -165.80304 10.90347 2.99809 -167.93049 1075.43841
8530.0000 -176.41244 -164.32364 12.08880 3.15771 -165.09180 1207.37280
8535.0000 -177.14445 -166.58101 10.56344 3.14528 -165.31285 1180.78925
8540.0000 -178.61931 -167.19573 11.42358 3.07735 -166.52104 1136.87367
8545.0000 -178.12103 -166.17705 11.94398 3.05484 -166.92134 1122.91728
8550.0000 -178.65554 -166.60089 12.05466 3.10622 -166.00754 1146.71039
8555.0000 -179.31103 -167.91128 11.39975 3.02427 -167.46502 1126.92031
8560.0000 -177.45753 -166.23123 11.22630 2.97589 -168.32537 1063.94459
8565.0000 -176.61508 -165.05351 11.56156 3.15964 -165.05745 1199.50086
8570.0000 -177.40507 -167.22839 10.17668 3.14174 -165.37589 1163.95526
8575.0000 -177.44949 -168.00540 9.44409 3.02226 -167.50076 1089.55897
8580.0000 -177.89735 -167.36212 10.53523 3.05897 -166.84778 1102.18061
8585.0000 -177.80165 -166.90756 10.89409 3.00822 -167.75044 1088.74486
8590.0000 -177.75591 -163.60683 14.14908 3.15090 -165.21284 1204.19579
8595.0000 -176.12769 -162.72621 13.40149 3.27291 -163.04297 1255.10894
8600.0000 -176.54407 -164.83892 11.70516 3.20439 -164.26157 1206.50065
8605.0000 -176.62867 -164.49983 12.12884 3.12712 -165.63580 1202.12730
8610.0000 -176.25317 -165.34786 10.90531 3.17737 -164.74221 1216.02203
8615.0000 -176.26290 -164.20085 12.06205 3.17344 -164.81203 1195.42978
8620.0000 -176.38334 -166.37872 10.00462 3.16655 -164.93454 1193.87907
8625.0000 -178.81883 -167.66796 11.15087 3.03540 -167.26701 1132.33772
8630.0000 -177.77215 -167.94827 9.82389 2.96676 -168.48784 1026.56279
8635.0000 -177.48200 -166.79543 10.68657 3.02304 -167.48681 1100.80805
8640.0000 -177.83274 -166.19818 11.63456 3.15442 -165.15028 1185.45726
8645.0000 -178.92691 -167.50159 11.42532 3.05368 -166.94202 1112.60142
8650.0000 -176.48015 -164.34455 12.13560 3.03367 -167.29776 1096.14755
8655.0000 -175.47965 -162.59026 12.88939 3.24148 -163.60199 1240.89876
8660.0000 -176.00546 -164.37494 11.63053 3.31897 -162.22395 1297.23830
8665.0000 -174.72474 -163.11485 11.60988 3.23740 -163.67455 1231.36244
8670.0000 -178.42689 -166.38684 12.04004 3.19445 -164.43836 1200.22677
8675.0000 -174.75506 -165.27161 9.48345 3.12456 -165.68128 1146.44745
8680.0000 -174.48958 -163.60248 10.88710 3.22896 -163.82461 1255.90597
8685.0000 -176.68730 -164.84745 11.83986 3.19287 -164.46658 1220.60318
8690.0000 -178.16577 -166.99975 11.16602 3.10304 -166.06401 1158.00648
8695.0000 -176.34893 -165.80346 10.54547 3.07697 -166.52781 1135.98889
8700.0000 -176.25301 -163.05112 13.20189 3.17720 -164.74511 1201.83688
8705.0000 -173.68413 -162.10822 11.57591 3.31549 -162.28582 1270.36009
8710.0000 -176.71115 -164.27564 12.43551 3.29586 -162.63492 1278.42129
8715.0000 -176.84369 -165.37666 11.46703 3.15488 -165.14212 1214.18968
8720.0000 -176.80497 -164.36289 12.44207 3.15075 -165.21561 1208.94215
8725.0000 -175.52082 -162.87581 12.64501 3.20524 -164.24645 1223.92149
8730.0000 -175.07147 -163.63695 11.43451 3.26387 -163.20375 1287.38661
8735.0000 -173.21916 -161.73405 11.48511 3.28134 -162.89315 1257.53404
8740.0000 -176.16208 -164.29767 11.86441 3.26584 -163.16882 1273.38276
8745.0000 -175.04173 -162.73158 12.31015 3.26079 -163.25860 1271.17225
8750.0000 -177.09881 -166.23088 10.86792 3.18829 -164.54800 1192.15186
MELTING PROCESS: loop number 36 T-loop= 1196.0000000000000
main_MD> interactions number 36 at Temperature= 1196.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.35862 4.93137 -0.61591
force_rgl> df(natom) 1.88403 0.01948 -3.19244
8755.0000 -176.33638 -165.87611 10.46027 3.07809 -166.50780 1142.62714
8760.0000 -177.45346 -167.00872 10.44475 3.04937 -167.01864 1133.95379
8765.0000 -177.32508 -166.92377 10.40131 3.01460 -167.63695 1120.36356
8770.0000 -176.92659 -167.33090 9.59569 3.03472 -167.27908 1107.47400
8775.0000 -178.25283 -168.20528 10.04755 3.06794 -166.68826 1169.32273
8780.0000 -175.92925 -164.28652 11.64273 3.03020 -167.35955 1123.70560
8785.0000 -178.49573 -165.19254 13.30319 3.21253 -164.11695 1236.97378
8790.0000 -179.17806 -165.99923 13.17883 3.08261 -166.42736 1185.80892
8795.0000 -176.25011 -162.91784 13.33228 3.19476 -164.43290 1224.51525
8800.0000 -175.63094 -163.41339 12.21754 3.16007 -165.04977 1188.35917
8805.0000 -176.49929 -165.43935 11.05994 3.15148 -165.20264 1202.49973
8810.0000 -176.90568 -165.92051 10.98517 3.08187 -166.44064 1132.60524
8815.0000 -177.16422 -164.48098 12.68324 3.11887 -165.78261 1164.47669
8820.0000 -175.14066 -163.72052 11.42014 3.16806 -164.90766 1187.14753
8825.0000 -176.55148 -164.47913 12.07235 3.14903 -165.24617 1169.97454
8830.0000 -179.34410 -168.23371 11.11039 3.00821 -167.75053 1084.73737
8835.0000 -178.75835 -167.97153 10.78682 2.94995 -168.78665 1093.57115
8840.0000 -178.84968 -167.48359 11.36610 3.00222 -167.85719 1093.69762
8845.0000 -177.13767 -165.38507 11.75260 3.10561 -166.01830 1171.13364
8850.0000 -174.23293 -163.38043 10.85251 3.21027 -164.15714 1217.31209
8855.0000 -177.47590 -164.83209 12.64381 3.26340 -163.21221 1257.62915
8860.0000 -179.75803 -169.53528 10.22275 3.04008 -167.18387 1110.32099
8865.0000 -180.53674 -168.53047 12.00628 2.93950 -168.97260 1071.86008
8870.0000 -177.78809 -166.27340 11.51470 2.99600 -167.96778 1086.29581
8875.0000 -175.60028 -164.22653 11.37375 3.10779 -165.97963 1149.12850
8880.0000 -176.96839 -164.28297 12.68542 3.14513 -165.31563 1201.75183
8885.0000 -174.42557 -162.94436 11.48121 3.16070 -165.03859 1195.96120
8890.0000 -173.41578 -163.02631 10.38947 3.27261 -163.04833 1233.90087
8895.0000 -175.57761 -165.38832 10.18929 3.21651 -164.04613 1223.35727
8900.0000 -177.37144 -165.59450 11.77694 3.15249 -165.18466 1184.08729
8905.0000 -175.55099 -164.30376 11.24723 3.12385 -165.69407 1190.28891
8910.0000 -176.69029 -165.60693 11.08336 3.12507 -165.67223 1179.63706
8915.0000 -176.73585 -166.05612 10.67973 3.08586 -166.36963 1150.54654
8920.0000 -174.99756 -162.57619 12.42136 3.14054 -165.39718 1179.09939
8925.0000 -177.11023 -164.66991 12.44032 3.25374 -163.38389 1279.16052
8930.0000 -174.39500 -162.41946 11.97553 3.28345 -162.85559 1276.54715
8935.0000 -175.27417 -162.77971 12.49446 3.26217 -163.23409 1273.18666
8940.0000 -176.16496 -164.34204 11.82292 3.21398 -164.09109 1247.43936
8945.0000 -177.82361 -166.67680 11.14681 3.09014 -166.29358 1149.55901
8950.0000 -177.67996 -166.86904 10.81091 3.07384 -166.58333 1108.79499
8955.0000 -177.18107 -165.00364 12.17743 3.15782 -165.08979 1208.27161
8960.0000 -178.33495 -167.05879 11.27616 3.14371 -165.34071 1176.66436
8965.0000 -178.77552 -166.08941 12.68612 3.12431 -165.68586 1200.06007
8970.0000 -177.41679 -167.53361 9.88318 3.11625 -165.82915 1166.29040
8975.0000 -177.97245 -167.07032 10.90213 3.05799 -166.86528 1133.91462
8980.0000 -177.59977 -167.58551 10.01426 3.13400 -165.51348 1198.14781
8985.0000 -180.01063 -168.46820 11.54243 2.98042 -168.24490 1072.82157
8990.0000 -178.83060 -165.89497 12.93563 3.05774 -166.86971 1151.31317
8995.0000 -177.89810 -166.71455 11.18355 3.13920 -165.42106 1177.91063
9000.0000 -178.25981 -165.76050 12.49931 3.13460 -165.50274 1175.48066
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 13 [min], 48.9537348 [s].
main_MD> Deallocating global variables
Reference in New Issue View Git Blame Copy Permalink