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nanoparticlesims/growth_Melting_Silver_ICO_2451/meltingSims/run_91/melt.log

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main_MD> Reading input file
read_input> Process type: melting
Read_input> Process caloric with a T-change of 25.000000000000000 [K] and a rate of 9.9999999999999992E+022 [K/ns]
read_input> Input for metadynamics has been read
read_input> Metadynamics has not been chosen.
read_input> Reading initial positions fromtoMelt_91.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 = 91 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: 91 9100
main_MD> Size of nv and nvoiz: 91 9100
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 = 91
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> 0.11182791380618670 -4.2123697051059776E-002 -0.11189401705050858 initial drift of cluster / NP1 for coalescence
init> 0.33080940354864613 0.35588381815646486 0.33930445178148694 scaling for velocity /for coalescence NP1
init.f90 > facguy = 1.8502944150906549E-003
preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
preparo> END t=0 TIME STEP
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.46991 0.02151 -0.72295
force_rgl> df(natom) 0.03126 -1.89362 1.38518
preparo> THERMALIZATION PROCESS AT 297.01150135955885
preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
5000 -231.64616246143663 3.7204141365083969 -235.36657659794503 3.8237050797122654E-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= 322.00000000000000
main_MD> interactions number 1 at Temperature= 322.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.75709 -1.17339 -1.11967
force_rgl> df(natom) -0.52304 -0.93028 -0.71124
5.0000 -235.53322 -232.21612 3.31710 1.80845 -231.86237 314.38470
10.0000 -235.36547 -231.50960 3.85587 1.81667 -231.69609 323.57774
15.0000 -235.76761 -231.29955 4.46805 1.82502 -231.52707 327.86061
20.0000 -234.60842 -230.79283 3.81559 1.85882 -230.84334 353.88113
25.0000 -235.47994 -231.73629 3.74365 1.82784 -231.47000 328.63407
30.0000 -235.30926 -231.09456 4.21470 1.84776 -231.06706 347.50010
35.0000 -235.12305 -230.68724 4.43581 1.83389 -231.34773 337.04630
40.0000 -235.29039 -231.30403 3.98636 1.84556 -231.11163 342.84761
45.0000 -235.45460 -231.99446 3.46014 1.81686 -231.69226 324.84943
50.0000 -236.12280 -232.49050 3.63230 1.77954 -232.44722 294.31096
55.0000 -235.55149 -231.74284 3.80865 1.78834 -232.26930 303.38129
60.0000 -235.08149 -230.81728 4.26422 1.82909 -231.44477 334.93449
65.0000 -235.74740 -232.31825 3.42914 1.82756 -231.47572 331.33267
70.0000 -235.67024 -231.80228 3.86796 1.79837 -232.06633 306.68940
75.0000 -235.46329 -231.31600 4.14729 1.82013 -231.62611 324.18611
80.0000 -235.26583 -231.45274 3.81309 1.84847 -231.05276 345.04482
85.0000 -235.39947 -231.12582 4.27366 1.82527 -231.52219 327.71608
90.0000 -235.93138 -231.95381 3.97757 1.82283 -231.57141 325.73640
95.0000 -235.50594 -231.67603 3.82992 1.80423 -231.94780 312.17702
100.0000 -235.25586 -231.65415 3.60171 1.82306 -231.56686 327.98778
105.0000 -235.49445 -231.64053 3.85393 1.83368 -231.35195 338.56141
110.0000 -235.03887 -230.88118 4.15769 1.85023 -231.01712 345.12768
115.0000 -235.39375 -231.35858 4.03517 1.82663 -231.49460 327.35597
120.0000 -235.68324 -231.86712 3.81612 1.82193 -231.58961 326.63043
125.0000 -235.71395 -232.19770 3.51625 1.80196 -231.99363 309.32661
130.0000 -235.09944 -231.57207 3.52737 1.82595 -231.50831 329.41958
135.0000 -235.33972 -231.11409 4.22563 1.82333 -231.56130 328.09674
140.0000 -235.24607 -231.54966 3.69641 1.83391 -231.34739 335.93161
145.0000 -234.32673 -230.40433 3.92240 1.84939 -231.03416 346.26872
150.0000 -234.73039 -231.02777 3.70262 1.84975 -231.02681 349.43357
155.0000 -235.55727 -231.40027 4.15700 1.84999 -231.02189 346.64132
160.0000 -235.48028 -231.90003 3.58026 1.82278 -231.57245 326.81595
165.0000 -235.77192 -232.24283 3.52909 1.80876 -231.85602 314.91188
170.0000 -235.64130 -231.30292 4.33838 1.81945 -231.63979 322.64349
175.0000 -235.26728 -230.85998 4.40730 1.84357 -231.15181 342.23905
180.0000 -235.87850 -231.57809 4.30041 1.84833 -231.05549 349.04886
185.0000 -235.36725 -231.05363 4.31362 1.84334 -231.15655 344.60063
190.0000 -235.75302 -231.77153 3.98150 1.85964 -230.82683 357.46203
195.0000 -235.65003 -231.07058 4.57945 1.83422 -231.34110 336.52329
200.0000 -235.15620 -231.25231 3.90390 1.86418 -230.73491 362.59230
205.0000 -235.60569 -232.36283 3.24286 1.80495 -231.93321 311.73674
210.0000 -235.21839 -231.51350 3.70489 1.81105 -231.80975 315.84186
215.0000 -234.84616 -231.13149 3.71467 1.83300 -231.36570 334.67472
220.0000 -235.12057 -230.71916 4.40141 1.84443 -231.13441 342.33346
225.0000 -235.02411 -230.62204 4.40208 1.86841 -230.64923 362.41712
230.0000 -235.82156 -231.37913 4.44244 1.83950 -231.23411 339.04053
235.0000 -234.87783 -230.85888 4.01895 1.83993 -231.22550 338.46380
240.0000 -235.25818 -231.79130 3.46688 1.82834 -231.45999 330.21616
245.0000 -235.14850 -231.17217 3.97633 1.82085 -231.61148 324.02745
250.0000 -235.38929 -231.70450 3.68479 1.82158 -231.59670 326.39935
MELTING PROCESS: loop number 2 T-loop= 347.00000000000000
main_MD> interactions number 2 at Temperature= 347.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.92168 2.05075 1.26775
force_rgl> df(natom) -2.87895 1.25410 -0.23375
255.0000 -235.70412 -231.41042 4.29370 1.82015 -231.62563 323.79029
260.0000 -235.32237 -231.69111 3.63126 1.83573 -231.31049 334.94157
265.0000 -234.86694 -230.42635 4.44059 1.87121 -230.59263 364.12990
270.0000 -235.39412 -231.45514 3.93899 1.86655 -230.68701 360.20902
275.0000 -235.37845 -230.97979 4.39866 1.84108 -231.20227 340.04809
280.0000 -235.11783 -231.63138 3.48645 1.83119 -231.40227 332.35344
285.0000 -235.08524 -231.42810 3.65714 1.82206 -231.58698 325.66260
290.0000 -235.05198 -230.77734 4.27464 1.85565 -230.90736 351.34870
295.0000 -234.46039 -230.09216 4.36823 1.86697 -230.67842 360.69196
300.0000 -234.26735 -229.74450 4.52286 1.91570 -229.69259 400.81844
305.0000 -235.38143 -231.34418 4.03726 1.85997 -230.82010 356.30557
310.0000 -235.55918 -231.39845 4.16073 1.83694 -231.28590 338.48504
315.0000 -234.75525 -229.88600 4.86925 1.88508 -230.31201 383.58850
320.0000 -234.84598 -230.86735 3.97863 1.89757 -230.05943 387.92376
325.0000 -235.43175 -231.17830 4.25345 1.83039 -231.41842 335.09218
330.0000 -234.89469 -230.93800 3.95668 1.84426 -231.13788 341.93095
335.0000 -234.99947 -231.75565 3.24382 1.84517 -231.11954 345.28366
340.0000 -234.07560 -230.46670 3.60890 1.85116 -230.99820 342.28468
345.0000 -234.75785 -230.89406 3.86380 1.86535 -230.71121 361.09980
350.0000 -234.94584 -231.98895 2.95689 1.82596 -231.50806 330.17230
355.0000 -235.14306 -231.76904 3.37402 1.80779 -231.87577 314.43921
360.0000 -234.63633 -231.00513 3.63120 1.82932 -231.44018 331.69374
365.0000 -235.05021 -231.20276 3.84745 1.83959 -231.23244 340.75488
370.0000 -235.58148 -231.22513 4.35635 1.85272 -230.96675 350.99850
375.0000 -235.64283 -231.94296 3.69988 1.84721 -231.07827 346.10392
380.0000 -235.45048 -231.23671 4.21378 1.82423 -231.54309 329.21925
385.0000 -236.19046 -232.07881 4.11165 1.82170 -231.59430 328.05404
390.0000 -235.90941 -232.20131 3.70810 1.80958 -231.83952 315.74069
395.0000 -235.24079 -231.65665 3.58414 1.79871 -232.05939 309.62352
400.0000 -235.45727 -231.58042 3.87686 1.83822 -231.26008 341.81503
405.0000 -235.49628 -231.41832 4.07796 1.81890 -231.65094 322.34423
410.0000 -234.54361 -231.08329 3.46032 1.85335 -230.95395 348.64361
415.0000 -235.29530 -231.29474 4.00057 1.82775 -231.47187 329.07832
420.0000 -235.37392 -231.19319 4.18073 1.82704 -231.48626 328.81083
425.0000 -235.15489 -231.25278 3.90210 1.85376 -230.94572 352.83815
430.0000 -234.94143 -231.35637 3.58506 1.84895 -231.04294 348.84933
435.0000 -235.20058 -230.57341 4.62717 1.84785 -231.06534 345.31549
440.0000 -234.57776 -229.92771 4.65005 1.88595 -230.29438 377.21113
445.0000 -234.38321 -230.56332 3.81989 1.87592 -230.49732 368.81277
450.0000 -234.98160 -230.49634 4.48526 1.86406 -230.73734 358.29098
455.0000 -234.98892 -231.10092 3.88799 1.86851 -230.64721 363.09775
460.0000 -235.56010 -231.98117 3.57893 1.83034 -231.41949 332.68140
465.0000 -235.24797 -231.27584 3.97213 1.82216 -231.58501 325.41834
470.0000 -235.75122 -232.00340 3.74782 1.80478 -231.93657 312.81543
475.0000 -235.92644 -231.81455 4.11189 1.80124 -232.00835 310.71952
480.0000 -235.35012 -231.22233 4.12779 1.83088 -231.40867 333.13075
485.0000 -235.01714 -231.55290 3.46424 1.84541 -231.11462 343.76289
490.0000 -234.62733 -230.62218 4.00514 1.85023 -231.01714 347.06085
495.0000 -234.97678 -230.46158 4.51520 1.88522 -230.30919 377.38887
500.0000 -234.55103 -230.74446 3.80658 1.86936 -230.63004 361.45289
MELTING PROCESS: loop number 3 T-loop= 372.00000000000000
main_MD> interactions number 3 at Temperature= 372.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.37363 -2.97665 -0.86580
force_rgl> df(natom) -0.65462 -0.03728 0.32787
505.0000 -234.32256 -230.26943 4.05313 1.86654 -230.68721 359.39995
510.0000 -233.65948 -229.61553 4.04395 1.89219 -230.16819 375.63462
515.0000 -234.99945 -230.24732 4.75213 1.88556 -230.30243 377.48189
520.0000 -234.78237 -230.28713 4.49523 1.85954 -230.82873 349.17490
525.0000 -235.49151 -231.04339 4.44812 1.84807 -231.06077 347.51486
530.0000 -234.30271 -229.15402 5.14870 1.90095 -229.99092 382.48291
535.0000 -234.79970 -229.88346 4.91624 1.91829 -229.64006 403.75845
540.0000 -234.96804 -231.01026 3.95778 1.87907 -230.43368 374.39193
545.0000 -234.57106 -230.24054 4.33053 1.89746 -230.06166 388.78226
550.0000 -235.41902 -231.07213 4.34689 1.87235 -230.56955 371.38745
555.0000 -234.96749 -230.33776 4.62973 1.88083 -230.39805 371.47007
560.0000 -235.12116 -230.56883 4.55233 1.87904 -230.43431 368.33350
565.0000 -234.69943 -230.88603 3.81340 1.86918 -230.63372 364.71391
570.0000 -235.02638 -230.83924 4.18714 1.87832 -230.44872 371.35127
575.0000 -234.75903 -230.61062 4.14841 1.86754 -230.66687 367.58495
580.0000 -234.78643 -230.82811 3.95832 1.86849 -230.64769 362.20392
585.0000 -235.11718 -230.69055 4.42662 1.87113 -230.59432 364.26710
590.0000 -234.63539 -230.45646 4.17893 1.86036 -230.81220 359.44121
595.0000 -235.05094 -230.55591 4.49503 1.86611 -230.69579 361.49090
600.0000 -234.55656 -229.88426 4.67230 1.88335 -230.34711 374.82976
605.0000 -234.79642 -230.55998 4.23643 1.88329 -230.34834 374.77829
610.0000 -234.93437 -230.85327 4.08110 1.88947 -230.22328 379.80421
615.0000 -234.94718 -230.49314 4.45404 1.87209 -230.57486 366.07253
620.0000 -234.87855 -231.11241 3.76614 1.85832 -230.85341 352.40491
625.0000 -235.21516 -230.94484 4.27032 1.85578 -230.90483 354.80450
630.0000 -235.15739 -230.72016 4.43723 1.86055 -230.80824 354.54755
635.0000 -235.10551 -231.13736 3.96815 1.85168 -230.98787 347.85196
640.0000 -235.08726 -230.91769 4.16957 1.84489 -231.12514 345.74039
645.0000 -235.00559 -230.75381 4.25179 1.87712 -230.47313 371.22506
650.0000 -235.16778 -230.60668 4.56110 1.85509 -230.91884 353.70669
655.0000 -235.23828 -230.61918 4.61909 1.86647 -230.68851 362.42371
660.0000 -234.58902 -230.32465 4.26437 1.87115 -230.59394 365.17185
665.0000 -234.92405 -230.11639 4.80767 1.91112 -229.78524 394.50591
670.0000 -234.50184 -229.67718 4.82467 1.90328 -229.94392 392.98934
675.0000 -234.82114 -230.59859 4.22255 1.88192 -230.37600 371.48736
680.0000 -234.38193 -229.95730 4.42463 1.87110 -230.59495 364.04698
685.0000 -234.90399 -229.88350 5.02049 1.90513 -229.90643 391.82729
690.0000 -234.85161 -230.40419 4.44742 1.88453 -230.32313 377.33184
695.0000 -235.00933 -229.90966 5.09966 1.88235 -230.36738 373.22261
700.0000 -235.03030 -230.15944 4.87085 1.88619 -230.28951 378.51869
705.0000 -234.57070 -230.03257 4.53813 1.90486 -229.91185 385.49524
710.0000 -234.88607 -230.71130 4.17477 1.86933 -230.63066 358.12987
715.0000 -234.48218 -230.65814 3.82404 1.85877 -230.84426 355.12073
720.0000 -234.55799 -230.66323 3.89477 1.86884 -230.64067 363.22338
725.0000 -234.58705 -230.32842 4.25863 1.87148 -230.58722 364.35563
730.0000 -235.11503 -230.50819 4.60684 1.87356 -230.54502 366.92000
735.0000 -234.44090 -230.32989 4.11101 1.86801 -230.65737 362.34596
740.0000 -235.17169 -230.56339 4.60830 1.88711 -230.27094 377.74922
745.0000 -234.54330 -230.24262 4.30068 1.88217 -230.37092 374.80455
750.0000 -235.09638 -231.13817 3.95821 1.87501 -230.51586 369.21268
MELTING PROCESS: loop number 4 T-loop= 397.00000000000000
main_MD> interactions number 4 at Temperature= 397.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.11254 0.07577 1.13621
force_rgl> df(natom) -1.67860 0.60277 2.10977
755.0000 -234.96342 -230.26246 4.70097 1.86726 -230.67252 358.25424
760.0000 -234.78464 -230.10652 4.67812 1.87816 -230.45201 369.63806
765.0000 -234.48187 -231.10638 3.37549 1.86341 -230.75037 359.86036
770.0000 -234.93119 -231.34470 3.58649 1.82395 -231.54873 327.47254
775.0000 -235.01839 -230.41734 4.60105 1.86293 -230.76023 357.90350
780.0000 -234.74905 -230.06524 4.68381 1.88998 -230.21295 382.24263
785.0000 -235.10428 -230.42807 4.67621 1.86228 -230.77341 358.39217
790.0000 -235.14756 -230.76724 4.38031 1.87261 -230.56433 363.10584
795.0000 -234.97088 -230.01042 4.96047 1.90286 -229.95243 389.99503
800.0000 -234.32442 -229.65036 4.67406 1.90133 -229.98338 387.55161
805.0000 -234.28649 -229.39534 4.89115 1.89768 -230.05716 385.17608
810.0000 -235.10580 -229.90642 5.19938 1.92057 -229.59407 402.69878
815.0000 -234.15479 -229.49366 4.66113 1.92021 -229.60139 401.57605
820.0000 -234.50193 -230.36738 4.13455 1.88122 -230.39016 371.64524
825.0000 -234.23709 -229.02982 5.20727 1.91733 -229.65951 400.21556
830.0000 -234.49103 -229.33265 5.15837 1.93693 -229.26299 417.04202
835.0000 -234.06309 -228.94990 5.11319 1.96155 -228.76488 434.82365
840.0000 -233.29314 -228.44492 4.84821 1.97400 -228.51306 443.18033
845.0000 -234.77274 -230.63089 4.14185 1.93424 -229.31752 413.27818
850.0000 -234.61175 -230.27544 4.33632 1.87444 -230.52731 362.66493
855.0000 -234.35403 -228.82613 5.52790 1.94051 -229.19055 418.74724
860.0000 -234.16480 -229.35597 4.80883 1.95213 -228.95546 428.96487
865.0000 -234.99673 -230.38490 4.61183 1.89815 -230.04766 383.39206
870.0000 -234.50219 -229.88358 4.61861 1.91870 -229.63185 401.61127
875.0000 -233.87656 -229.68323 4.19333 1.90266 -229.95636 390.02983
880.0000 -234.87631 -230.78386 4.09245 1.88790 -230.25498 374.77279
885.0000 -234.88470 -230.27948 4.60522 1.86681 -230.68173 361.66592
890.0000 -235.15293 -230.18718 4.96575 1.88552 -230.30315 377.49434
895.0000 -234.36311 -229.03075 5.33237 1.92308 -229.54321 405.13347
900.0000 -234.27736 -229.53582 4.74154 1.94711 -229.05707 420.19484
905.0000 -234.31067 -229.45780 4.85288 1.93589 -229.28410 414.48533
910.0000 -234.07088 -229.47682 4.59406 1.91983 -229.60904 401.66287
915.0000 -234.61673 -230.00011 4.61662 1.90451 -229.91904 389.98968
920.0000 -234.02720 -230.23173 3.79547 1.89672 -230.07664 385.67388
925.0000 -234.02404 -230.41859 3.60545 1.87652 -230.48526 372.12311
930.0000 -233.86891 -228.94765 4.92125 1.90461 -229.91684 393.33364
935.0000 -234.06450 -229.06385 5.00066 1.94883 -229.02227 425.33209
940.0000 -234.03033 -229.23024 4.80009 1.94890 -229.02089 421.85914
945.0000 -233.94694 -229.56532 4.38162 1.92576 -229.48900 401.04996
950.0000 -234.34100 -229.99131 4.34969 1.93067 -229.38962 412.27676
955.0000 -234.84866 -229.95472 4.89394 1.91049 -229.79797 398.87050
960.0000 -234.28947 -229.35859 4.93089 1.91187 -229.77006 396.73049
965.0000 -233.76795 -228.99688 4.77107 1.92310 -229.54288 408.31758
970.0000 -234.03285 -228.86158 5.17127 1.96402 -228.71497 435.69351
975.0000 -234.36286 -229.95377 4.40909 1.91483 -229.71011 399.71338
980.0000 -233.45326 -229.52675 3.92651 1.91842 -229.63744 399.15072
985.0000 -234.19381 -229.67507 4.51874 1.90851 -229.83797 397.19251
990.0000 -235.26034 -230.47958 4.78075 1.90622 -229.88428 390.44291
995.0000 -234.38431 -229.80898 4.57533 1.89079 -230.19649 381.87227
1000.0000 -234.96111 -230.99756 3.96355 1.89108 -230.19076 383.05766
MELTING PROCESS: loop number 5 T-loop= 422.00000000000000
main_MD> interactions number 5 at Temperature= 422.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.57198 -0.54903 -2.68969
force_rgl> df(natom) 0.70411 1.26191 -2.33493
1005.0000 -234.72448 -230.00320 4.72127 1.87449 -230.52627 369.53524
1010.0000 -234.36225 -229.39193 4.97033 1.89653 -230.08043 383.16683
1015.0000 -233.88964 -229.48252 4.40712 1.91391 -229.72882 396.69209
1020.0000 -233.53081 -228.84037 4.69044 1.96696 -228.65543 435.36294
1025.0000 -233.97042 -228.82348 5.14694 1.95156 -228.96715 426.50656
1030.0000 -232.56695 -227.79766 4.76929 1.98532 -228.28403 455.12732
1035.0000 -233.55095 -228.78559 4.76536 1.99035 -228.18219 460.52269
1040.0000 -233.42362 -228.65447 4.76915 1.93385 -229.32540 416.25663
1045.0000 -234.11289 -228.85227 5.26062 1.96945 -228.60506 438.94516
1050.0000 -234.61142 -229.27905 5.33237 1.93419 -229.31851 414.14226
1055.0000 -233.26070 -228.34160 4.91910 1.96198 -228.75617 433.88236
1060.0000 -233.99649 -228.63241 5.36408 1.99765 -228.03467 466.06090
1065.0000 -234.43584 -229.16519 5.27065 1.94956 -229.00757 428.46951
1070.0000 -233.34517 -228.07883 5.26634 1.97236 -228.54626 438.21132
1075.0000 -233.77663 -228.78502 4.99161 1.95535 -228.89034 425.68130
1080.0000 -234.25335 -228.66435 5.58900 1.97470 -228.49897 441.72395
1085.0000 -234.22716 -229.62342 4.60374 1.94213 -229.15774 422.58736
1090.0000 -233.90980 -228.65983 5.24997 1.94574 -229.08474 425.92587
1095.0000 -233.83911 -228.45207 5.38705 1.95865 -228.82354 435.15506
1100.0000 -234.51791 -229.43769 5.08022 1.95986 -228.79923 433.04732
1105.0000 -234.49754 -229.52045 4.97709 1.93638 -229.27417 414.98879
1110.0000 -233.93748 -229.34548 4.59200 1.91611 -229.68421 399.97697
1115.0000 -234.36156 -229.03588 5.32568 1.92067 -229.59204 404.81505
1120.0000 -233.78201 -228.88452 4.89748 1.95929 -228.81070 430.78770
1125.0000 -234.14290 -228.94865 5.19425 1.95989 -228.79845 435.05104
1130.0000 -234.24114 -230.16663 4.07451 1.92552 -229.49396 406.70668
1135.0000 -233.42460 -228.65656 4.76803 1.95139 -228.97054 419.90099
1140.0000 -234.21088 -228.77731 5.43357 1.96061 -228.78397 432.64337
1145.0000 -234.65563 -230.10017 4.55545 1.93885 -229.22418 415.85461
1150.0000 -234.47956 -230.01164 4.46792 1.88849 -230.24303 379.44591
1155.0000 -234.08656 -229.49890 4.58766 1.91037 -229.80029 394.61425
1160.0000 -234.09821 -229.27032 4.82789 1.93001 -229.40298 406.38044
1165.0000 -234.20974 -229.72290 4.48684 1.93580 -229.28588 412.30468
1170.0000 -234.08883 -228.19462 5.89421 1.94715 -229.05626 422.58392
1175.0000 -233.94381 -228.34080 5.60301 1.99628 -228.06229 464.49916
1180.0000 -233.13446 -227.48688 5.64758 1.98342 -228.32239 450.81178
1185.0000 -233.89783 -228.68410 5.21374 2.02990 -227.38209 483.16728
1190.0000 -233.55176 -228.68020 4.87156 1.96695 -228.65569 441.47843
1195.0000 -234.10057 -228.75375 5.34682 1.95292 -228.93954 433.56090
1200.0000 -233.83666 -227.91837 5.91829 1.97754 -228.44154 448.84966
1205.0000 -233.71132 -228.59752 5.11379 1.99607 -228.06654 464.33307
1210.0000 -234.02687 -228.50743 5.51945 1.96586 -228.67772 436.72204
1215.0000 -234.03689 -228.55068 5.48621 1.97131 -228.56755 441.47074
1220.0000 -233.33332 -228.59707 4.73625 1.96745 -228.64556 439.50686
1225.0000 -233.81164 -228.21241 5.59923 1.98316 -228.32780 453.64995
1230.0000 -234.61637 -229.86272 4.75365 1.94605 -229.07850 420.63464
1235.0000 -234.39483 -229.04106 5.35377 1.91198 -229.76779 399.57436
1240.0000 -234.37140 -229.02935 5.34205 1.96105 -228.77505 436.30246
1245.0000 -234.20416 -229.66404 4.54012 1.93085 -229.38603 410.12761
1250.0000 -234.30070 -229.28342 5.01728 1.92723 -229.45938 408.49689
MELTING PROCESS: loop number 6 T-loop= 447.00000000000000
main_MD> interactions number 6 at Temperature= 447.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.65091 -0.24503 -1.04476
force_rgl> df(natom) -0.72503 -0.63765 -1.21056
1255.0000 -233.58858 -228.54826 5.04032 1.93972 -229.20652 419.77581
1260.0000 -233.39508 -227.69238 5.70269 2.00190 -227.94859 467.72806
1265.0000 -233.58320 -227.61006 5.97314 1.99854 -228.01659 463.07299
1270.0000 -233.00994 -227.38965 5.62028 2.02697 -227.44140 482.43285
1275.0000 -233.54845 -227.87553 5.67293 2.01911 -227.60051 481.01673
1280.0000 -234.17844 -228.92420 5.25424 1.98194 -228.35239 452.16222
1285.0000 -233.36940 -228.38406 4.98533 1.98866 -228.21648 466.34829
1290.0000 -234.10597 -229.04799 5.05798 1.97059 -228.58214 444.02365
1295.0000 -234.09700 -228.99290 5.10410 1.94330 -229.13422 421.54300
1300.0000 -233.38952 -228.78552 4.60401 1.95680 -228.86105 434.10751
1305.0000 -232.90585 -227.32542 5.58043 1.99469 -228.09444 463.12080
1310.0000 -233.26183 -227.60872 5.65312 2.02154 -227.55117 481.97964
1315.0000 -233.81886 -228.38158 5.43727 2.00386 -227.90889 466.70858
1320.0000 -234.37416 -228.68766 5.68650 1.97687 -228.45509 443.62182
1325.0000 -234.12259 -228.74673 5.37587 1.98224 -228.34628 451.57364
1330.0000 -233.94912 -228.58324 5.36588 1.97676 -228.45719 447.38319
1335.0000 -234.46761 -229.00261 5.46500 1.95709 -228.85509 432.27803
1340.0000 -233.08905 -228.53987 4.54918 1.96403 -228.71485 434.63765
1345.0000 -233.55817 -227.97142 5.58675 2.00213 -227.94401 459.92461
1350.0000 -234.01463 -229.30447 4.71016 1.96854 -228.62362 443.69192
1355.0000 -233.38153 -227.77360 5.60793 1.97860 -228.41993 448.75287
1360.0000 -232.61816 -227.49675 5.12142 2.01656 -227.65203 476.97910
1365.0000 -233.54772 -228.20396 5.34376 1.98191 -228.35309 453.98861
1370.0000 -233.27640 -228.07283 5.20357 1.99668 -228.05425 455.43958
1375.0000 -234.30309 -229.45437 4.84872 1.96199 -228.75597 430.90527
1380.0000 -233.62803 -228.39471 5.23332 1.96357 -228.72400 435.79118
1385.0000 -234.41459 -228.89680 5.51779 1.99815 -228.02450 464.75794
1390.0000 -234.22972 -229.06958 5.16014 1.93022 -229.39871 411.64034
1395.0000 -233.44486 -228.92685 4.51801 1.93814 -229.23858 416.75109
1400.0000 -233.48161 -227.77315 5.70845 1.96807 -228.63306 440.24405
1405.0000 -232.98620 -227.87244 5.11376 2.01083 -227.76787 469.60758
1410.0000 -232.77026 -227.50235 5.26791 2.01768 -227.62940 473.75342
1415.0000 -233.62181 -228.50437 5.11744 2.00715 -227.84241 463.79326
1420.0000 -233.56896 -227.15830 6.41065 2.00942 -227.79653 472.15880
1425.0000 -233.74709 -228.28063 5.46646 2.02966 -227.38692 487.50263
1430.0000 -233.16511 -227.78805 5.37707 2.00665 -227.85259 466.66219
1435.0000 -233.23698 -228.02613 5.21085 1.98409 -228.30896 451.20466
1440.0000 -233.51209 -228.60784 4.90425 1.99796 -228.02823 463.36525
1445.0000 -232.93313 -227.81444 5.11869 1.98665 -228.25720 455.99553
1450.0000 -234.50833 -228.60687 5.90146 1.98369 -228.31697 454.07065
1455.0000 -233.62244 -228.21998 5.40246 1.96970 -228.60006 439.43283
1460.0000 -233.56767 -227.87208 5.69559 1.97092 -228.57528 437.32876
1465.0000 -233.03566 -226.96249 6.07316 2.01971 -227.58824 480.30536
1470.0000 -233.90585 -228.80196 5.10389 2.01644 -227.65445 470.25037
1475.0000 -234.33071 -228.62145 5.70926 1.96149 -228.76611 434.24427
1480.0000 -232.99995 -227.40895 5.59100 1.98036 -228.38441 446.09068
1485.0000 -234.25925 -228.51257 5.74668 2.01133 -227.75785 475.95110
1490.0000 -233.62422 -228.28566 5.33856 1.96098 -228.77652 433.78148
1495.0000 -234.10777 -228.67229 5.43548 1.98741 -228.24169 462.31966
1500.0000 -234.08497 -229.35820 4.72676 1.94961 -229.00650 424.50667
MELTING PROCESS: loop number 7 T-loop= 472.00000000000000
main_MD> interactions number 7 at Temperature= 472.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.70657 1.41665 2.20485
force_rgl> df(natom) 0.84301 2.49691 0.12583
1505.0000 -233.80103 -229.22697 4.57406 1.95889 -228.81879 427.62384
1510.0000 -234.00681 -228.47238 5.53443 1.97764 -228.43944 450.63368
1515.0000 -233.92054 -228.46447 5.45606 1.94874 -229.02405 423.98873
1520.0000 -232.66644 -227.85787 4.80857 1.98895 -228.21067 457.00438
1525.0000 -233.06522 -227.32772 5.73750 2.01613 -227.66079 477.62017
1530.0000 -232.10718 -226.89028 5.21690 2.05580 -226.85814 487.14494
1535.0000 -233.72563 -227.43488 6.29075 2.03655 -227.24764 484.06685
1540.0000 -233.11703 -227.39040 5.72664 2.02694 -227.44198 473.52017
1545.0000 -232.60492 -227.35546 5.24946 2.03251 -227.32932 473.26154
1550.0000 -233.36369 -227.05481 6.30888 2.02177 -227.54663 469.29511
1555.0000 -233.34304 -227.12347 6.21957 2.05010 -226.97353 493.50029
1560.0000 -232.34919 -226.11771 6.23147 2.05589 -226.85626 501.42837
1565.0000 -233.15897 -228.01706 5.14191 2.01946 -227.59334 469.52021
1570.0000 -233.06955 -228.04010 5.02945 1.98753 -228.23937 440.25230
1575.0000 -231.82261 -226.37198 5.45063 2.03766 -227.22514 478.12878
1580.0000 -232.46966 -226.35568 6.11397 2.10696 -225.82312 534.06084
1585.0000 -231.89344 -225.91405 5.97939 2.12008 -225.55758 545.98346
1590.0000 -233.10823 -227.54293 5.56530 2.05906 -226.79222 509.02193
1595.0000 -233.32680 -227.24578 6.08103 2.02757 -227.42921 479.02276
1600.0000 -233.09461 -227.51551 5.57910 2.02691 -227.44259 473.60959
1605.0000 -232.69385 -227.49735 5.19650 2.02448 -227.49188 473.98366
1610.0000 -232.13935 -226.96640 5.17296 2.04503 -227.07595 485.81523
1615.0000 -232.82449 -227.10257 5.72192 2.04830 -227.00978 484.81365
1620.0000 -232.54401 -226.58772 5.95629 2.06427 -226.68683 507.68448
1625.0000 -233.10934 -227.68952 5.41982 2.02944 -227.39136 482.53575
1630.0000 -233.28674 -227.69803 5.58871 2.04356 -227.10577 493.77535
1635.0000 -232.72834 -227.19466 5.53368 2.01325 -227.71903 463.55960
1640.0000 -232.09762 -225.99784 6.09978 2.07488 -226.47220 513.13954
1645.0000 -232.33476 -227.28811 5.04665 2.03595 -227.25977 489.24242
1650.0000 -233.08585 -227.95549 5.13037 2.03293 -227.32087 483.16670
1655.0000 -233.73873 -228.85552 4.88321 1.98639 -228.26233 451.52346
1660.0000 -233.68662 -228.42577 5.26085 1.96779 -228.63867 439.59753
1665.0000 -233.04930 -226.95865 6.09065 2.03276 -227.32422 487.55821
1670.0000 -234.16783 -228.46446 5.70337 2.01248 -227.73458 468.11933
1675.0000 -233.23985 -227.61032 5.62953 1.97683 -228.45589 442.19340
1680.0000 -232.96910 -227.64283 5.32626 2.01485 -227.68657 475.13467
1685.0000 -233.39689 -228.68669 4.71020 1.96593 -228.67637 440.78483
1690.0000 -232.54045 -227.49835 5.04211 1.98771 -228.23562 449.92519
1695.0000 -233.30894 -228.15904 5.14990 1.99550 -228.07809 448.34811
1700.0000 -233.76977 -227.65888 6.11089 2.01143 -227.75582 462.30924
1705.0000 -233.04559 -227.74029 5.30530 1.99198 -228.14929 453.00244
1710.0000 -233.07632 -229.06529 4.01104 1.97625 -228.46750 439.26630
1715.0000 -232.68315 -227.29101 5.39214 1.98562 -228.27805 447.34652
1720.0000 -232.98693 -226.86140 6.12553 2.05946 -226.78404 506.22757
1725.0000 -233.59424 -227.79929 5.79496 2.03736 -227.23114 478.28892
1730.0000 -234.27592 -228.64227 5.63365 1.98390 -228.31285 441.42442
1735.0000 -233.25273 -228.62376 4.62897 1.96749 -228.64474 439.01705
1740.0000 -232.68895 -226.57903 6.10992 2.05483 -226.87771 504.49872
1745.0000 -233.05318 -228.10363 4.94955 2.02641 -227.45272 481.40605
1750.0000 -234.15137 -228.68275 5.46862 1.98024 -228.38690 444.27588
MELTING PROCESS: loop number 8 T-loop= 497.00000000000000
main_MD> interactions number 8 at Temperature= 497.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.61275 0.19851 -1.34092
force_rgl> df(natom) 1.73000 -3.25883 0.17773
1755.0000 -233.49006 -228.18016 5.30990 1.96001 -228.79613 431.69351
1760.0000 -233.77395 -227.74905 6.02490 2.03086 -227.36264 485.20053
1765.0000 -233.62630 -228.44665 5.17965 1.98740 -228.24194 453.72859
1770.0000 -233.24625 -227.61171 5.63454 1.99285 -228.13171 446.44628
1775.0000 -232.39336 -226.57581 5.81754 2.04692 -227.03777 495.95783
1780.0000 -233.68871 -226.80199 6.88672 2.05020 -226.97141 502.82103
1785.0000 -232.57471 -227.05832 5.51639 2.04393 -227.09822 489.49307
1790.0000 -233.60697 -227.69122 5.91574 2.02990 -227.38212 483.37812
1795.0000 -233.63824 -228.29598 5.34226 2.02186 -227.54487 477.77977
1800.0000 -233.68206 -227.76053 5.92153 1.99428 -228.10274 457.56066
1805.0000 -233.10401 -226.88508 6.21893 2.00820 -227.82110 468.10351
1810.0000 -231.97850 -225.07955 6.89896 2.08487 -226.27002 528.75989
1815.0000 -233.54663 -227.00556 6.54107 2.08289 -226.30999 523.67052
1820.0000 -233.24084 -226.93001 6.31083 2.05675 -226.83895 506.56166
1825.0000 -231.75062 -225.72014 6.03048 2.06942 -226.58262 512.74107
1830.0000 -232.84494 -226.81623 6.02871 2.09918 -225.98051 537.20388
1835.0000 -232.33887 -225.58470 6.75417 2.06459 -226.68038 513.45077
1840.0000 -232.49127 -227.36626 5.12501 2.09449 -226.07534 534.42602
1845.0000 -234.05492 -227.94227 6.11265 2.03444 -227.29025 489.07457
1850.0000 -233.92646 -228.37256 5.55390 1.99105 -228.16803 456.76271
1855.0000 -233.09095 -226.61796 6.47300 2.05834 -226.80676 511.08084
1860.0000 -232.60430 -227.00429 5.60001 2.04184 -227.14052 493.52599
1865.0000 -233.32436 -226.86896 6.45540 2.05168 -226.94151 491.94492
1870.0000 -232.88382 -227.74589 5.13793 2.04475 -227.08177 494.30666
1875.0000 -232.79502 -226.80750 5.98753 2.04703 -227.03547 500.04388
1880.0000 -233.25964 -226.70351 6.55613 2.06252 -226.72208 506.54988
1885.0000 -232.30919 -227.14163 5.16756 2.05775 -226.81865 496.70594
1890.0000 -233.28346 -227.42210 5.86135 2.02626 -227.45584 480.91040
1895.0000 -233.12711 -226.91037 6.21675 2.02317 -227.51829 476.03463
1900.0000 -232.61867 -226.56249 6.05618 2.06137 -226.74535 510.26917
1905.0000 -232.33770 -227.09881 5.23888 2.05889 -226.79568 501.01351
1910.0000 -233.64010 -227.84378 5.79633 2.02951 -227.38995 485.00009
1915.0000 -231.36102 -226.42019 4.94083 2.05446 -226.88518 502.32606
1920.0000 -232.00093 -226.23851 5.76243 2.08224 -226.32312 512.20949
1925.0000 -233.79565 -227.72769 6.06796 2.06438 -226.68452 509.95400
1930.0000 -232.60682 -226.76901 5.83781 2.05360 -226.90255 500.53776
1935.0000 -232.81756 -227.26926 5.54831 2.05805 -226.81256 504.92213
1940.0000 -233.20054 -227.39429 5.80625 2.04015 -227.17483 490.96149
1945.0000 -232.90546 -227.59903 5.30643 1.99913 -228.00464 459.88542
1950.0000 -233.41683 -228.21371 5.20313 2.02250 -227.53176 477.35759
1955.0000 -233.21585 -227.72301 5.49284 2.00445 -227.89691 464.78108
1960.0000 -233.26652 -227.07414 6.19238 2.02343 -227.51297 469.91043
1965.0000 -232.55149 -227.64079 4.91070 2.03496 -227.27978 488.36753
1970.0000 -232.94888 -226.99348 5.95540 2.05055 -226.96426 498.26832
1975.0000 -233.53271 -227.73810 5.79461 2.02868 -227.40682 478.16314
1980.0000 -232.95129 -227.37282 5.57847 2.02415 -227.49844 476.23783
1985.0000 -232.70926 -226.74892 5.96034 2.03480 -227.28304 486.78007
1990.0000 -233.69148 -229.32177 4.36972 1.99000 -228.18926 447.90561
1995.0000 -233.62115 -228.84497 4.77618 1.95400 -228.91760 424.12284
2000.0000 -232.87580 -226.11287 6.76293 2.02500 -227.48121 484.59565
MELTING PROCESS: loop number 9 T-loop= 522.00000000000000
main_MD> interactions number 9 at Temperature= 522.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.85945 -2.04731 0.67372
force_rgl> df(natom) -1.83063 0.05734 -0.79169
2005.0000 -231.05901 -225.18057 5.87844 2.09792 -226.00602 523.20243
2010.0000 -232.23403 -225.82155 6.41248 2.13994 -225.15595 557.51553
2015.0000 -232.38918 -226.68393 5.70525 2.07758 -226.41752 488.80360
2020.0000 -231.60975 -226.33462 5.27512 2.09746 -226.01527 493.08364
2025.0000 -231.95640 -226.00771 5.94869 2.07783 -226.41238 481.19914
2030.0000 -231.42956 -225.06682 6.36274 2.10942 -225.77325 505.43170
2035.0000 -231.49406 -225.33446 6.15960 2.13390 -225.27806 519.81379
2040.0000 -231.10898 -225.72545 5.38353 2.10468 -225.86921 484.32963
2045.0000 -230.76553 -225.18592 5.57960 2.12164 -225.52607 485.46621
2050.0000 -231.21963 -225.30569 5.91394 2.10980 -225.76568 505.07309
2055.0000 -231.01191 -225.66788 5.34402 2.10979 -225.76586 505.22310
2060.0000 -232.04900 -225.89985 6.14915 2.09706 -226.02344 497.41976
2065.0000 -232.01556 -225.69735 6.31821 2.11141 -225.73300 524.15595
2070.0000 -231.02309 -224.77342 6.24967 2.13689 -225.21755 537.22288
2075.0000 -231.74368 -225.97309 5.77059 2.11951 -225.56927 521.51198
2080.0000 -232.19632 -225.72200 6.47432 2.11280 -225.70486 513.21972
2085.0000 -231.33121 -224.71827 6.61294 2.14856 -224.98153 527.93384
2090.0000 -231.30934 -225.23451 6.07483 2.15284 -224.89486 545.22416
2095.0000 -231.12875 -225.31036 5.81838 2.13992 -225.15620 511.17305
2100.0000 -231.24897 -224.73172 6.51726 2.15242 -224.90338 509.67264
2105.0000 -229.50608 -223.16319 6.34289 2.21422 -223.65304 534.90820
2110.0000 -230.72040 -224.41138 6.30902 2.21292 -223.67936 538.09085
2115.0000 -230.79652 -224.70217 6.09435 2.17287 -224.48954 538.02109
2120.0000 -230.41595 -223.95765 6.45830 2.15857 -224.77899 535.09850
2125.0000 -231.21902 -225.01001 6.20901 2.18386 -224.26732 541.99272
2130.0000 -231.70335 -225.58570 6.11766 2.10724 -225.81737 488.81394
2135.0000 -230.75689 -224.25750 6.49938 2.15827 -224.78502 551.41802
2140.0000 -230.17546 -223.89448 6.28098 2.19721 -223.99729 551.26344
2145.0000 -229.89150 -223.65430 6.23720 2.17371 -224.47258 523.22045
2150.0000 -229.23705 -223.19063 6.04642 2.21698 -223.59714 552.77777
2155.0000 -230.87531 -224.58717 6.28814 2.22612 -223.41225 555.57850
2160.0000 -230.76886 -224.42025 6.34861 2.17322 -224.48254 525.07562
2165.0000 -230.30543 -223.48533 6.82011 2.16692 -224.60998 519.29072
2170.0000 -230.73451 -224.64008 6.09443 2.19013 -224.14047 556.37090
2175.0000 -231.06371 -224.90187 6.16184 2.15159 -224.92009 533.45243
2180.0000 -231.82223 -226.02847 5.79376 2.14353 -225.08313 508.88749
2185.0000 -231.09444 -225.55214 5.54230 2.10846 -225.79267 493.83662
2190.0000 -231.67650 -225.43462 6.24188 2.09844 -225.99540 485.39702
2195.0000 -230.92734 -224.51807 6.40927 2.16772 -224.59382 556.45658
2200.0000 -230.74872 -224.73742 6.01130 2.14969 -224.95857 546.68803
2205.0000 -231.57528 -225.91286 5.66243 2.10274 -225.90849 507.77288
2210.0000 -230.77906 -225.53387 5.24519 2.11319 -225.69704 511.27351
2215.0000 -231.75112 -225.82203 5.92909 2.12387 -225.48092 521.46926
2220.0000 -231.82083 -226.16777 5.65306 2.10387 -225.88569 500.48201
2225.0000 -231.83941 -226.00893 5.83048 2.09706 -226.02337 521.45946
2230.0000 -231.95352 -224.96505 6.98848 2.10543 -225.85412 528.19512
2235.0000 -232.08933 -225.45476 6.63457 2.14248 -225.10455 560.39202
2240.0000 -232.49364 -227.16266 5.33099 2.09808 -226.00283 514.92087
2245.0000 -232.89780 -227.88337 5.01443 2.02709 -227.43890 467.72589
2250.0000 -231.61636 -225.48774 6.12861 2.06633 -226.64502 489.39486
MELTING PROCESS: loop number 10 T-loop= 547.00000000000000
main_MD> interactions number 10 at Temperature= 547.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.39188 -3.50992 0.47803
force_rgl> df(natom) 1.30885 1.48395 -0.29754
2255.0000 -230.87896 -224.81371 6.06525 2.15095 -224.93301 546.59767
2260.0000 -230.78691 -224.80312 5.98379 2.12834 -225.39048 529.45089
2265.0000 -230.92438 -224.48355 6.44083 2.16613 -224.62596 542.48967
2270.0000 -230.02159 -224.95034 5.07125 2.16983 -224.55115 529.14731
2275.0000 -231.15990 -225.19605 5.96385 2.17490 -224.44857 533.12163
2280.0000 -232.05799 -226.07755 5.98044 2.11753 -225.60927 517.29032
2285.0000 -231.59262 -225.37420 6.21843 2.12238 -225.51103 520.29500
2290.0000 -230.91365 -224.72932 6.18433 2.14960 -224.96044 552.89002
2295.0000 -231.49693 -224.77071 6.72621 2.18158 -224.31344 565.98199
2300.0000 -231.76652 -224.61555 7.15097 2.15426 -224.86607 549.86715
2305.0000 -232.37451 -224.53489 7.83962 2.13910 -225.17287 553.47682
2310.0000 -232.32151 -225.54501 6.77650 2.16443 -224.66034 582.82723
2315.0000 -231.56000 -225.36120 6.19881 2.15038 -224.94465 557.55704
2320.0000 -230.83902 -223.72802 7.11100 2.17194 -224.50850 581.13452
2325.0000 -230.14528 -224.36911 5.77617 2.19743 -223.99284 553.53921
2330.0000 -230.24828 -222.73900 7.50928 2.18200 -224.30501 516.24831
2335.0000 -229.26246 -222.88165 6.38081 2.26869 -222.55096 549.65017
2340.0000 -228.56198 -221.50189 7.06009 2.30548 -221.80663 584.49741
2345.0000 -227.95370 -220.49451 7.45919 2.34354 -221.03682 619.89787
2350.0000 -228.10699 -221.26969 6.83730 2.35162 -220.87326 611.86957
2355.0000 -229.89833 -224.06926 5.82907 2.25387 -222.85096 550.79105
2360.0000 -229.09240 -222.85892 6.23347 2.21864 -223.56367 522.62602
2365.0000 -229.33389 -222.80326 6.53064 2.26335 -222.65899 565.62291
2370.0000 -228.94212 -223.85342 5.08870 2.24307 -223.06948 541.97911
2375.0000 -230.12535 -223.68189 6.44346 2.20962 -223.74619 509.38869
2380.0000 -229.80906 -222.83296 6.97610 2.21755 -223.58561 529.59562
2385.0000 -230.16266 -223.71414 6.44852 2.22371 -223.46103 533.00361
2390.0000 -228.89731 -222.71311 6.18420 2.22481 -223.43883 547.31649
2395.0000 -227.79260 -221.88053 5.91207 2.27013 -222.52192 559.15775
2400.0000 -229.76547 -222.68448 7.08099 2.27332 -222.45734 566.44830
2405.0000 -229.30023 -223.77583 5.52439 2.22973 -223.33931 560.48734
2410.0000 -231.00600 -223.97247 7.03353 2.19529 -224.03609 568.93657
2415.0000 -231.12190 -224.95852 6.16338 2.18123 -224.32043 565.19330
2420.0000 -230.70554 -223.93834 6.76720 2.18440 -224.25631 562.51276
2425.0000 -231.12983 -224.02986 7.09997 2.18486 -224.24712 541.17589
2430.0000 -231.90111 -224.90148 6.99964 2.16877 -224.57266 546.73713
2435.0000 -230.56322 -224.58625 5.97696 2.16487 -224.65150 556.38122
2440.0000 -231.65508 -224.99082 6.66426 2.17819 -224.38191 560.70583
2445.0000 -231.49342 -225.05995 6.43347 2.13361 -225.28401 531.09988
2450.0000 -230.62956 -224.08411 6.54545 2.18333 -224.27802 571.72204
2455.0000 -231.35928 -224.48996 6.86931 2.20252 -223.88986 556.86291
2460.0000 -230.72191 -223.88305 6.83886 2.19890 -223.96302 573.81506
2465.0000 -230.61512 -223.60500 7.01012 2.24143 -223.10257 588.46312
2470.0000 -230.55855 -223.77171 6.78684 2.18982 -224.14666 563.04809
2475.0000 -230.36134 -223.44075 6.92058 2.19298 -224.08282 565.39346
2480.0000 -230.70829 -223.47234 7.23595 2.25894 -222.74839 606.62419
2485.0000 -231.84938 -224.83125 7.01813 2.20900 -223.75857 574.41315
2490.0000 -230.84535 -224.78104 6.06431 2.14781 -224.99659 542.35220
2495.0000 -231.98326 -225.65902 6.32424 2.13907 -225.17349 546.02491
2500.0000 -231.30500 -225.30185 6.00316 2.15733 -224.80402 554.77346
MELTING PROCESS: loop number 11 T-loop= 572.00000000000000
main_MD> interactions number 11 at Temperature= 572.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.06930 -1.01179 -0.18159
force_rgl> df(natom) -1.85864 -0.86862 2.15938
2505.0000 -231.96857 -225.16190 6.80667 2.12657 -225.42637 516.22967
2510.0000 -228.24331 -222.02989 6.21342 2.22643 -223.40597 574.36029
2515.0000 -228.68522 -221.79789 6.88733 2.28893 -222.14147 593.72197
2520.0000 -229.16761 -222.52227 6.64535 2.28226 -222.27652 568.85538
2525.0000 -229.92842 -222.88367 7.04475 2.25477 -222.83262 573.83872
2530.0000 -228.11970 -221.05026 7.06943 2.28448 -222.23151 576.39886
2535.0000 -229.13104 -221.43127 7.69977 2.30895 -221.73654 596.16678
2540.0000 -229.31838 -222.12867 7.18971 2.30637 -221.78871 605.44041
2545.0000 -228.56523 -221.12870 7.43653 2.29805 -221.95700 602.42285
2550.0000 -230.01333 -223.29134 6.72199 2.29266 -222.06609 588.85887
2555.0000 -229.38902 -222.67591 6.71311 2.19701 -224.00117 519.06070
2560.0000 -229.29486 -222.60085 6.69401 2.27974 -222.32745 586.67813
2565.0000 -229.29337 -222.09690 7.19647 2.29384 -222.04227 596.81631
2570.0000 -230.87199 -224.72842 6.14357 2.22777 -223.37898 554.98981
2575.0000 -229.90453 -223.59046 6.31407 2.19132 -224.11633 536.23372
2580.0000 -230.49462 -224.18752 6.30710 2.22363 -223.46266 551.76095
2585.0000 -230.79353 -224.69569 6.09784 2.19144 -224.11389 532.87751
2590.0000 -231.74022 -224.54937 7.19085 2.18967 -224.14968 556.53400
2595.0000 -229.02923 -223.48879 5.54043 2.17229 -224.50144 517.73529
2600.0000 -230.04355 -223.17202 6.87154 2.23663 -223.19957 556.60246
2605.0000 -229.33181 -222.11720 7.21461 2.25252 -222.87822 567.00177
2610.0000 -229.12044 -222.51974 6.60071 2.27804 -222.36182 575.34837
2615.0000 -230.52294 -223.96955 6.55339 2.25160 -222.89677 568.94377
2620.0000 -229.04744 -222.31706 6.73038 2.21123 -223.71361 535.28727
2625.0000 -229.10255 -221.95123 7.15133 2.27336 -222.45657 590.45262
2630.0000 -228.90437 -222.39189 6.51248 2.33183 -221.27362 599.74410
2635.0000 -228.59217 -219.95073 8.64143 2.35322 -220.84093 610.38531
2640.0000 -228.85814 -221.21996 7.63818 2.37546 -220.39093 622.94031
2645.0000 -228.94216 -221.74119 7.20097 2.32980 -221.31476 609.78223
2650.0000 -229.10392 -222.70240 6.40152 2.26638 -222.59775 582.13241
2655.0000 -229.14695 -222.25549 6.89146 2.25723 -222.78299 580.38599
2660.0000 -229.30741 -222.91748 6.38993 2.28625 -222.19570 591.08652
2665.0000 -229.38608 -222.43391 6.95217 2.26157 -222.69514 567.69242
2670.0000 -229.37043 -222.61117 6.75927 2.24736 -222.98262 593.52453
2675.0000 -228.81024 -221.18219 7.62806 2.29418 -222.03538 640.75287
2680.0000 -229.35772 -222.74658 6.61114 2.30683 -221.77952 615.66515
2685.0000 -229.27778 -222.00156 7.27622 2.28990 -222.12186 593.07800
2690.0000 -230.46482 -223.62017 6.84466 2.25807 -222.76582 574.78313
2695.0000 -229.35699 -222.47681 6.88018 2.25227 -222.88316 561.69518
2700.0000 -229.71723 -223.60199 6.11523 2.26391 -222.64780 581.23383
2705.0000 -228.80585 -221.89319 6.91267 2.27447 -222.43418 565.00843
2710.0000 -229.33782 -222.35518 6.98264 2.27802 -222.36230 551.87138
2715.0000 -228.22451 -221.61949 6.60501 2.28196 -222.28250 564.84375
2720.0000 -228.10614 -220.01597 8.09017 2.34039 -221.10044 612.90973
2725.0000 -228.85769 -222.98324 5.87445 2.29342 -222.05074 587.69570
2730.0000 -229.84179 -223.48902 6.35277 2.22635 -223.40760 530.10037
2735.0000 -230.60555 -224.75648 5.84906 2.19222 -224.09824 513.38627
2740.0000 -230.75194 -224.18900 6.56294 2.16781 -224.59201 539.14003
2745.0000 -229.12969 -222.34525 6.78444 2.24334 -223.06399 582.31294
2750.0000 -229.99270 -223.15538 6.83733 2.24429 -223.04463 556.37132
MELTING PROCESS: loop number 12 T-loop= 597.00000000000000
main_MD> interactions number 12 at Temperature= 597.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.22250 -2.69175 -0.89209
force_rgl> df(natom) -0.29797 -3.30370 0.40357
2755.0000 -229.56974 -222.31867 7.25107 2.25277 -222.87316 561.14105
2760.0000 -230.75105 -224.20180 6.54924 2.24634 -223.00320 568.95063
2765.0000 -231.11041 -223.84955 7.26086 2.20882 -223.76233 559.16982
2770.0000 -229.35374 -222.65985 6.69389 2.22140 -223.50777 590.72422
2775.0000 -229.46704 -222.60949 6.85755 2.26598 -222.60584 619.83196
2780.0000 -229.37408 -223.15807 6.21601 2.24586 -223.01301 575.46291
2785.0000 -229.25837 -221.94754 7.31083 2.28614 -222.19797 590.75065
2790.0000 -228.00786 -221.02860 6.97926 2.30271 -221.86269 607.56837
2795.0000 -228.93797 -221.60992 7.32805 2.33767 -221.15547 624.54107
2800.0000 -228.72816 -220.92931 7.79885 2.33419 -221.22584 634.42400
2805.0000 -227.88712 -220.69445 7.19267 2.33968 -221.11491 657.95793
2810.0000 -227.88343 -221.04809 6.83534 2.33864 -221.13576 605.81726
2815.0000 -229.52228 -223.05323 6.46905 2.28065 -222.30900 581.11769
2820.0000 -230.15063 -222.67538 7.47525 2.25451 -222.83784 572.44590
2825.0000 -228.65881 -221.96461 6.69420 2.27809 -222.36097 575.41837
2830.0000 -228.42209 -222.49246 5.92963 2.26355 -222.65497 568.56898
2835.0000 -230.59318 -223.08839 7.50479 2.27260 -222.47189 572.90323
2840.0000 -230.15447 -223.00783 7.14665 2.24417 -223.04719 558.86796
2845.0000 -230.10897 -222.53616 7.57282 2.24874 -222.95459 565.70829
2850.0000 -228.90595 -222.71703 6.18892 2.25761 -222.77518 585.49461
2855.0000 -228.72149 -222.58776 6.13373 2.29059 -222.10798 604.32690
2860.0000 -227.52276 -221.27661 6.24615 2.30960 -221.72334 590.13685
2865.0000 -228.44728 -220.81490 7.63237 2.38711 -220.15520 648.52271
2870.0000 -228.57953 -221.44653 7.13300 2.32246 -221.46322 586.02093
2875.0000 -228.22545 -221.93697 6.28848 2.31478 -221.61848 583.75403
2880.0000 -229.02240 -221.39563 7.62677 2.32417 -221.42867 606.65335
2885.0000 -227.48436 -220.79154 6.69282 2.34286 -221.05044 614.10239
2890.0000 -229.01855 -221.66333 7.35522 2.35580 -220.78862 600.29138
2895.0000 -230.16112 -223.03097 7.13015 2.28839 -222.15240 577.21267
2900.0000 -229.37887 -222.01264 7.36623 2.29843 -221.94929 600.58651
2905.0000 -229.18740 -221.11665 8.07075 2.32460 -221.41984 624.93769
2910.0000 -227.51689 -220.16194 7.35495 2.36648 -220.57257 659.06175
2915.0000 -228.71362 -222.02968 6.68394 2.35026 -220.90083 623.88203
2920.0000 -228.87036 -221.69789 7.17247 2.32214 -221.46964 629.92502
2925.0000 -228.33088 -221.06028 7.27060 2.32557 -221.40019 620.51521
2930.0000 -227.30251 -220.59390 6.70862 2.34047 -221.09884 619.31452
2935.0000 -227.78066 -220.04466 7.73600 2.39664 -219.96247 658.42579
2940.0000 -227.98131 -220.58862 7.39268 2.38293 -220.23986 633.94725
2945.0000 -228.22360 -221.85755 6.36605 2.31557 -221.60254 598.62602
2950.0000 -228.74257 -221.66414 7.07843 2.30630 -221.79009 563.29091
2955.0000 -229.28406 -221.98184 7.30221 2.30852 -221.74519 594.27986
2960.0000 -229.89726 -222.90078 6.99648 2.25177 -222.89340 567.84402
2965.0000 -230.20992 -223.31079 6.89913 2.25354 -222.85752 559.67157
2970.0000 -230.32806 -223.79452 6.53354 2.24053 -223.12077 575.98594
2975.0000 -227.79427 -221.39353 6.40073 2.23197 -223.29394 547.32468
2980.0000 -228.51905 -220.12095 8.39810 2.33266 -221.25690 621.66310
2985.0000 -228.80310 -222.23583 6.56727 2.34552 -220.99674 626.74318
2990.0000 -228.17414 -220.66462 7.50951 2.33126 -221.28513 610.07269
2995.0000 -227.74668 -221.05721 6.68948 2.35980 -220.70777 643.33017
3000.0000 -228.38541 -221.98485 6.40055 2.32209 -221.47076 596.89077
MELTING PROCESS: loop number 13 T-loop= 622.00000000000000
main_MD> interactions number 13 at Temperature= 622.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.62443 1.77930 0.36503
force_rgl> df(natom) -0.57809 -2.63477 1.51392
3005.0000 -229.42491 -222.05381 7.37111 2.31018 -221.71168 603.98255
3010.0000 -228.31596 -220.61662 7.69934 2.30590 -221.79829 610.22181
3015.0000 -228.95647 -221.91188 7.04459 2.34655 -220.97583 653.02173
3020.0000 -229.14342 -221.95222 7.19120 2.31023 -221.71058 592.28501
3025.0000 -229.40408 -222.41671 6.98737 2.30061 -221.90527 583.35100
3030.0000 -229.53638 -223.19151 6.34487 2.29464 -222.02599 591.94701
3035.0000 -229.73849 -222.94698 6.79151 2.27151 -222.49397 577.24629
3040.0000 -229.51640 -222.90927 6.60713 2.24002 -223.13109 605.20740
3045.0000 -228.38157 -220.87797 7.50360 2.30202 -221.87682 616.37321
3050.0000 -229.51699 -222.09456 7.42243 2.31809 -221.55170 659.06402
3055.0000 -231.15205 -224.16223 6.98982 2.26655 -222.59427 627.34549
3060.0000 -230.72270 -223.92453 6.79818 2.21367 -223.66422 599.03018
3065.0000 -228.76850 -221.95219 6.81631 2.26608 -222.60382 606.34570
3070.0000 -228.60685 -221.96750 6.63934 2.31714 -221.57088 632.75086
3075.0000 -229.85119 -221.62523 8.22596 2.33047 -221.30112 646.06324
3080.0000 -229.20188 -221.20650 7.99538 2.30438 -221.82895 621.57820
3085.0000 -229.22352 -222.41559 6.80793 2.31436 -221.62716 637.55536
3090.0000 -227.91273 -220.59849 7.31424 2.35003 -220.90550 617.37852
3095.0000 -228.50411 -221.60992 6.89419 2.34648 -220.97734 629.62687
3100.0000 -229.38593 -221.84379 7.54214 2.31402 -221.63400 615.47967
3105.0000 -229.01709 -222.18317 6.83393 2.28110 -222.30000 600.66842
3110.0000 -228.35719 -220.58061 7.77658 2.33564 -221.19647 634.72000
3115.0000 -228.15675 -221.44208 6.71466 2.34869 -220.93246 609.58040
3120.0000 -228.10898 -220.22368 7.88530 2.38119 -220.27500 643.88558
3125.0000 -226.66302 -219.74799 6.91503 2.39282 -220.03981 648.97924
3130.0000 -227.09641 -219.68489 7.41151 2.44354 -219.01355 674.06149
3135.0000 -227.38581 -220.53676 6.84906 2.40049 -219.88459 660.11734
3140.0000 -227.69621 -220.00216 7.69406 2.36038 -220.69597 625.70686
3145.0000 -227.93907 -220.29190 7.64717 2.39410 -220.01384 658.17837
3150.0000 -227.51741 -220.98414 6.53328 2.35175 -220.87059 651.39097
3155.0000 -227.73145 -220.80767 6.92378 2.34645 -220.97778 619.73043
3160.0000 -227.46802 -220.12450 7.34352 2.38256 -220.24721 644.63319
3165.0000 -228.80490 -221.64764 7.15725 2.33891 -221.13031 617.88010
3170.0000 -227.47524 -220.02420 7.45104 2.38540 -220.18992 632.60882
3175.0000 -226.94054 -219.96987 6.97067 2.40844 -219.72364 652.83376
3180.0000 -225.92273 -217.97803 7.94470 2.45408 -218.80041 667.67965
3185.0000 -228.11982 -220.41062 7.70920 2.40192 -219.85569 662.80008
3190.0000 -226.59308 -219.83554 6.75754 2.36519 -220.59872 628.85887
3195.0000 -227.15562 -219.74751 7.40811 2.39595 -219.97649 636.01533
3200.0000 -229.08794 -222.23154 6.85640 2.33995 -221.10926 598.01011
3205.0000 -230.54967 -222.43464 8.11504 2.29441 -222.03061 581.38263
3210.0000 -229.34718 -222.73584 6.61134 2.28658 -222.18909 576.59637
3215.0000 -228.81088 -221.49703 7.31385 2.30484 -221.81977 604.86643
3220.0000 -229.14471 -222.45079 6.69393 2.29932 -221.93130 614.14561
3225.0000 -228.62647 -221.14827 7.47820 2.29300 -222.05929 607.05963
3230.0000 -228.07285 -221.08534 6.98751 2.34832 -220.93997 637.32668
3235.0000 -228.71437 -221.99796 6.71640 2.33845 -221.13974 611.83584
3240.0000 -228.40492 -222.06835 6.33657 2.30700 -221.77591 593.26558
3245.0000 -228.00839 -221.23764 6.77075 2.31240 -221.66681 604.84028
3250.0000 -228.49422 -220.72204 7.77218 2.35938 -220.71627 624.61966
MELTING PROCESS: loop number 14 T-loop= 647.00000000000000
main_MD> interactions number 14 at Temperature= 647.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -1.14555 -0.44676 2.23356
force_rgl> df(natom) -2.75203 0.08436 1.12449
3255.0000 -227.90341 -220.01179 7.89161 2.37349 -220.43085 629.62451
3260.0000 -226.56229 -217.84904 8.71325 2.42854 -219.31713 671.57711
3265.0000 -226.73010 -218.43301 8.29709 2.46083 -218.66373 680.28072
3270.0000 -226.72355 -218.94043 7.78312 2.43907 -219.10408 685.28184
3275.0000 -225.82707 -217.90606 7.92101 2.46937 -218.49103 694.72232
3280.0000 -227.05415 -218.37732 8.67683 2.48084 -218.25888 711.97796
3285.0000 -225.89998 -216.71454 9.18544 2.52194 -217.42746 746.67601
3290.0000 -227.00883 -219.49893 7.50990 2.50595 -217.75090 698.22715
3295.0000 -225.76647 -218.34199 7.42448 2.48066 -218.26254 697.97661
3300.0000 -228.01485 -220.01233 8.00252 2.44099 -219.06507 677.24699
3305.0000 -227.24882 -219.67666 7.57215 2.36087 -220.68620 637.95026
3310.0000 -228.17580 -220.63516 7.54064 2.40847 -219.72314 660.45549
3315.0000 -227.69982 -219.09699 8.60283 2.41291 -219.63326 656.71382
3320.0000 -228.15390 -221.26430 6.88960 2.37818 -220.33596 643.39627
3325.0000 -226.96294 -219.73834 7.22460 2.37392 -220.42201 637.12613
3330.0000 -225.87896 -218.54160 7.33736 2.40398 -219.81396 640.86179
3335.0000 -228.49032 -220.98497 7.50535 2.41679 -219.55470 665.10576
3340.0000 -228.75363 -219.50875 9.24488 2.37960 -220.30722 646.94556
3345.0000 -227.81646 -220.36061 7.45585 2.38084 -220.28201 643.61423
3350.0000 -228.26783 -220.35554 7.91230 2.33090 -221.29245 609.88468
3355.0000 -226.30389 -219.51380 6.79009 2.42764 -219.33525 674.44301
3360.0000 -229.15354 -221.75217 7.40136 2.34800 -220.94646 609.08711
3365.0000 -228.66393 -222.17868 6.48525 2.31231 -221.66858 621.24280
3370.0000 -229.12837 -221.96866 7.15972 2.31101 -221.69486 625.07293
3375.0000 -228.61136 -220.74611 7.86526 2.30597 -221.79680 623.89377
3380.0000 -227.90467 -220.99919 6.90548 2.35174 -220.87082 627.05228
3385.0000 -228.22916 -219.71651 8.51265 2.40701 -219.75272 654.96380
3390.0000 -227.80509 -219.94374 7.86134 2.36502 -220.60205 652.69787
3395.0000 -226.74807 -219.24193 7.50614 2.39727 -219.94960 657.32141
3400.0000 -227.58318 -219.93058 7.65260 2.41879 -219.51421 668.99292
3405.0000 -228.36763 -221.33821 7.02941 2.40734 -219.74601 645.25518
3410.0000 -228.78634 -221.12561 7.66073 2.30000 -221.91757 593.83335
3415.0000 -228.41825 -220.94651 7.47174 2.29376 -222.04391 580.08879
3420.0000 -229.05847 -221.28416 7.77430 2.34429 -221.02150 616.32878
3425.0000 -227.34766 -220.95918 6.38848 2.34385 -221.03039 620.23555
3430.0000 -228.90633 -221.97497 6.93137 2.33317 -221.24652 630.15653
3435.0000 -228.67783 -221.01849 7.65934 2.32032 -221.50644 611.32642
3440.0000 -228.03884 -220.41527 7.62358 2.37384 -220.42363 630.85450
3445.0000 -227.17340 -218.25369 8.91970 2.42669 -219.35452 680.80092
3450.0000 -228.09109 -220.33700 7.75408 2.45451 -218.79162 675.45340
3455.0000 -228.00728 -221.12050 6.88678 2.33878 -221.13313 608.61951
3460.0000 -227.54143 -219.89754 7.64389 2.41189 -219.65387 672.17488
3465.0000 -227.78571 -221.09356 6.69215 2.37366 -220.42740 640.13712
3470.0000 -227.76554 -219.61632 8.14922 2.37256 -220.44962 622.98871
3475.0000 -226.95884 -218.72892 8.22993 2.40872 -219.71804 646.40321
3480.0000 -226.34635 -218.18776 8.15859 2.48566 -218.16135 709.35537
3485.0000 -226.07686 -218.37822 7.69864 2.43616 -219.16290 670.70854
3490.0000 -226.72934 -218.79528 7.93405 2.44708 -218.94203 680.89486
3495.0000 -227.70893 -220.11109 7.59784 2.43379 -219.21080 670.07630
3500.0000 -228.41945 -220.79586 7.62359 2.37078 -220.48568 637.37569
MELTING PROCESS: loop number 15 T-loop= 672.00000000000000
main_MD> interactions number 15 at Temperature= 672.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.58585 -1.61558 -1.64839
force_rgl> df(natom) 2.58709 1.75235 0.24194
3505.0000 -228.36876 -220.61705 7.75171 2.36081 -220.68732 630.97023
3510.0000 -228.61424 -220.42784 8.18640 2.39669 -219.96138 649.65698
3515.0000 -226.84397 -219.40625 7.43773 2.42977 -219.29213 674.43901
3520.0000 -225.97509 -219.00064 6.97445 2.41715 -219.54740 657.44264
3525.0000 -228.56254 -220.44058 8.12195 2.36745 -220.55304 631.19734
3530.0000 -227.90303 -221.34350 6.55953 2.34338 -221.04006 613.14849
3535.0000 -226.25617 -218.18724 8.06893 2.38386 -220.22091 643.17447
3540.0000 -227.76402 -218.37042 9.39361 2.43958 -219.09361 673.50823
3545.0000 -226.88130 -219.15971 7.72160 2.46008 -218.67888 707.17172
3550.0000 -227.35190 -219.30290 8.04899 2.42189 -219.45168 679.51872
3555.0000 -227.21395 -220.08102 7.13293 2.41701 -219.55026 658.20235
3560.0000 -227.84894 -221.11843 6.73052 2.37577 -220.38463 648.93123
3565.0000 -227.89817 -220.30636 7.59181 2.40405 -219.81256 655.44429
3570.0000 -226.53676 -219.26150 7.27526 2.38887 -220.11962 616.31707
3575.0000 -227.52121 -219.06947 8.45174 2.42593 -219.36981 648.13329
3580.0000 -228.24576 -220.43830 7.80746 2.42510 -219.38662 645.71157
3585.0000 -226.95724 -219.23319 7.72405 2.38292 -220.24000 646.18150
3590.0000 -227.58377 -219.74097 7.84280 2.42457 -219.39743 657.38205
3595.0000 -227.89553 -219.89490 8.00064 2.39700 -219.95513 657.51181
3600.0000 -226.74792 -219.38701 7.36092 2.39656 -219.96407 647.60126
3605.0000 -227.74794 -219.57608 8.17186 2.41384 -219.61444 662.99946
3610.0000 -225.61483 -217.58796 8.02687 2.45327 -218.81666 700.15287
3615.0000 -227.04823 -219.71927 7.32896 2.44237 -219.03724 664.25296
3620.0000 -227.25866 -219.43183 7.82683 2.41142 -219.66344 648.55949
3625.0000 -228.40841 -220.61936 7.78906 2.40333 -219.82712 641.04290
3630.0000 -228.39647 -221.83620 6.56026 2.32908 -221.32934 610.66946
3635.0000 -229.09287 -221.75167 7.34120 2.31214 -221.67200 607.95791
3640.0000 -227.89423 -219.23185 8.66239 2.33876 -221.13347 619.85320
3645.0000 -226.24324 -218.41912 7.82412 2.45902 -218.70037 685.69110
3650.0000 -226.79895 -219.85500 6.94395 2.46077 -218.66504 685.25660
3655.0000 -228.13847 -220.22708 7.91139 2.38402 -220.21778 640.40015
3660.0000 -228.17350 -220.65704 7.51646 2.36779 -220.54621 635.52143
3665.0000 -228.43121 -220.02928 8.40193 2.36900 -220.52162 638.51813
3670.0000 -228.04997 -219.74611 8.30386 2.40632 -219.76651 683.80929
3675.0000 -227.46677 -220.31780 7.14897 2.37497 -220.40087 645.95341
3680.0000 -228.38039 -220.42646 7.95393 2.39743 -219.94643 638.97752
3685.0000 -227.80603 -218.91478 8.89125 2.38207 -220.25728 639.08952
3690.0000 -228.69185 -221.37821 7.31364 2.37611 -220.37780 656.76349
3695.0000 -227.04933 -218.74034 8.30899 2.36971 -220.50729 642.96428
3700.0000 -227.71224 -220.00639 7.70585 2.41795 -219.53140 660.11272
3705.0000 -229.31540 -221.46329 7.85211 2.37867 -220.32608 633.05004
3710.0000 -226.91623 -218.50475 8.41148 2.39139 -220.06866 676.95030
3715.0000 -227.69459 -220.45022 7.24438 2.40447 -219.80407 685.57805
3720.0000 -227.85426 -221.13193 6.72234 2.33936 -221.12129 620.99615
3725.0000 -227.74428 -219.67222 8.07206 2.39220 -220.05221 650.30995
3730.0000 -227.04261 -218.71508 8.32754 2.42580 -219.37239 692.94764
3735.0000 -226.34515 -218.64656 7.69859 2.47240 -218.42974 686.16080
3740.0000 -226.51933 -218.71971 7.79962 2.43595 -219.16717 661.76343
3745.0000 -226.48916 -218.12835 8.36081 2.50492 -217.77176 717.79853
3750.0000 -227.37667 -218.92824 8.44842 2.47638 -218.34918 697.60734
MELTING PROCESS: loop number 16 T-loop= 697.00000000000000
main_MD> interactions number 16 at Temperature= 697.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.21009 -6.02765 -1.95835
force_rgl> df(natom) -0.00335 -1.78852 0.97635
3755.0000 -226.56188 -218.45778 8.10411 2.42074 -219.47479 674.20329
3760.0000 -226.49067 -218.74823 7.74243 2.49184 -218.03645 696.14913
3765.0000 -226.21268 -216.83481 9.37787 2.49886 -217.89433 697.83881
3770.0000 -223.35712 -214.46752 8.88959 2.61810 -215.48196 782.31423
3775.0000 -225.70355 -216.71626 8.98729 2.63677 -215.10434 791.57865
3780.0000 -226.23505 -217.09526 9.13979 2.50355 -217.79943 696.78544
3785.0000 -224.69944 -215.85790 8.84154 2.57090 -216.43685 728.06761
3790.0000 -226.65289 -218.47989 8.17300 2.52159 -217.43447 717.75801
3795.0000 -225.14023 -216.83032 8.30990 2.50802 -217.70913 703.48260
3800.0000 -226.01747 -217.74794 8.26953 2.50798 -217.70994 707.34679
3805.0000 -226.80840 -217.52079 9.28761 2.49604 -217.95134 723.33317
3810.0000 -227.03141 -218.17666 8.85475 2.49960 -217.87934 709.73673
3815.0000 -225.98039 -218.57421 7.40618 2.48353 -218.20454 685.05003
3820.0000 -226.14400 -216.68325 9.46075 2.50709 -217.72796 696.01788
3825.0000 -225.51207 -216.87336 8.63871 2.53784 -217.10582 735.18448
3830.0000 -225.79917 -216.56462 9.23455 2.57763 -216.30074 748.59459
3835.0000 -226.18380 -216.91704 9.26677 2.56224 -216.61219 724.89037
3840.0000 -227.49964 -218.88785 8.61179 2.46893 -218.49980 687.31418
3845.0000 -227.02363 -218.47029 8.55334 2.48367 -218.20170 697.00621
3850.0000 -226.57761 -218.12106 8.45655 2.44078 -219.06945 673.37559
3855.0000 -226.88882 -218.82374 8.06508 2.49668 -217.93857 700.00389
3860.0000 -227.96384 -219.87522 8.08862 2.45933 -218.69405 692.59070
3865.0000 -227.04137 -218.79226 8.24911 2.42889 -219.30994 677.88937
3870.0000 -225.57123 -217.27891 8.29232 2.48992 -218.07517 716.89336
3875.0000 -226.51495 -217.60084 8.91411 2.52584 -217.34849 718.19892
3880.0000 -226.55009 -217.69751 8.85258 2.46069 -218.66665 687.62059
3885.0000 -227.56738 -217.76268 9.80469 2.44564 -218.97110 686.67308
3890.0000 -226.86029 -218.51366 8.34663 2.49097 -218.05406 698.86769
3895.0000 -226.40206 -218.38420 8.01785 2.50759 -217.71775 709.78435
3900.0000 -226.35100 -218.14962 8.20138 2.45213 -218.83972 688.29770
3905.0000 -226.54477 -218.14784 8.39693 2.49623 -217.94764 712.92838
3910.0000 -226.27436 -217.35285 8.92151 2.48545 -218.16573 701.41293
3915.0000 -226.25756 -218.98983 7.26773 2.46542 -218.57091 681.40507
3920.0000 -226.22197 -218.58225 7.63971 2.51410 -217.58601 707.36532
3925.0000 -227.10463 -217.87961 9.22502 2.47825 -218.31131 694.64245
3930.0000 -225.00069 -217.14082 7.85988 2.55221 -216.81505 741.37906
3935.0000 -226.53461 -218.46919 8.06541 2.50059 -217.85938 709.40105
3940.0000 -226.48874 -218.10367 8.38507 2.46818 -218.51504 675.90495
3945.0000 -227.12851 -219.83880 7.28970 2.44265 -219.03162 656.43123
3950.0000 -226.01854 -218.42789 7.59065 2.48068 -218.26221 697.84012
3955.0000 -225.91770 -217.54333 8.37438 2.52033 -217.46003 728.99092
3960.0000 -226.99015 -219.07861 7.91153 2.45016 -218.87955 691.04547
3965.0000 -226.49035 -217.63731 8.85304 2.46417 -218.59615 700.67054
3970.0000 -226.85342 -219.48669 7.36673 2.47555 -218.36599 697.94908
3975.0000 -225.89608 -218.00001 7.89608 2.46148 -218.65057 655.74880
3980.0000 -226.59091 -217.90501 8.68590 2.47854 -218.30556 679.09775
3985.0000 -226.97183 -219.82586 7.14597 2.47433 -218.39057 695.24576
3990.0000 -224.48003 -216.03613 8.44390 2.47737 -218.32905 686.38245
3995.0000 -227.01882 -217.71082 9.30800 2.54844 -216.89130 741.78140
4000.0000 -227.26247 -217.97338 9.28908 2.50084 -217.85423 710.86774
MELTING PROCESS: loop number 17 T-loop= 722.00000000000000
main_MD> interactions number 17 at Temperature= 722.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.28018 -5.00861 -0.46040
force_rgl> df(natom) -0.31325 1.42692 1.80579
4005.0000 -226.16397 -217.76657 8.39739 2.48481 -218.17854 688.14711
4010.0000 -226.43235 -217.73087 8.70148 2.53816 -217.09928 746.97436
4015.0000 -226.46323 -218.46772 7.99551 2.47631 -218.35064 683.95043
4020.0000 -227.00850 -218.44935 8.55915 2.47466 -218.38393 701.06150
4025.0000 -226.00205 -219.15486 6.84720 2.45414 -218.79910 680.10992
4030.0000 -226.18426 -217.48752 8.69674 2.47172 -218.44348 686.05430
4035.0000 -226.12208 -217.57346 8.54862 2.55541 -216.75031 744.64494
4040.0000 -226.50451 -217.65672 8.84779 2.50008 -217.86967 728.21072
4045.0000 -226.32739 -217.49351 8.83388 2.54628 -216.93505 749.48734
4050.0000 -225.01258 -216.89016 8.12241 2.55276 -216.80397 762.13318
4055.0000 -225.39802 -216.67625 8.72177 2.56594 -216.53717 747.11986
4060.0000 -224.07855 -215.44664 8.63191 2.62562 -215.32984 772.06145
4065.0000 -225.57271 -216.91698 8.65572 2.54632 -216.93411 737.28602
4070.0000 -225.56066 -216.27518 9.28548 2.57345 -216.38533 755.03978
4075.0000 -225.25507 -215.76451 9.49056 2.58119 -216.22875 748.94685
4080.0000 -226.43338 -218.34477 8.08862 2.54805 -216.89926 751.11668
4085.0000 -227.76665 -218.01942 9.74723 2.50158 -217.83943 733.81280
4090.0000 -225.16047 -216.43626 8.72421 2.55369 -216.78511 784.27311
4095.0000 -225.96127 -218.36434 7.59694 2.48695 -218.13529 690.62935
4100.0000 -226.02825 -216.21694 9.81131 2.54532 -216.95437 729.32599
4105.0000 -224.84004 -215.63589 9.20415 2.58260 -216.20027 767.22287
4110.0000 -225.47294 -216.43015 9.04279 2.58318 -216.18845 755.76893
4115.0000 -225.19300 -215.75260 9.44040 2.55371 -216.78460 749.63505
4120.0000 -224.61781 -215.20277 9.41505 2.61780 -215.48801 759.30953
4125.0000 -224.19142 -215.18353 9.00789 2.61593 -215.52578 779.04137
4130.0000 -225.83876 -216.11654 9.72222 2.57512 -216.35152 763.09638
4135.0000 -223.28000 -215.43931 7.84069 2.58736 -216.10379 771.53842
4140.0000 -225.62382 -217.30114 8.32268 2.59490 -215.95144 772.75181
4145.0000 -227.82053 -218.03914 9.78139 2.51875 -217.49190 758.64373
4150.0000 -226.74549 -218.06779 8.67770 2.52484 -217.36874 734.48974
4155.0000 -226.10050 -218.42368 7.67682 2.48557 -218.16321 704.49069
4160.0000 -224.31596 -215.21064 9.10533 2.52178 -217.43075 722.16304
4165.0000 -225.26335 -217.53487 7.72848 2.57655 -216.32249 749.99228
4170.0000 -226.84448 -217.69439 9.15009 2.51017 -217.66552 720.72686
4175.0000 -227.47518 -218.96742 8.50776 2.46973 -218.48366 685.82076
4180.0000 -227.53962 -218.80500 8.73462 2.45359 -218.81032 696.86477
4185.0000 -226.28773 -218.12749 8.16024 2.44854 -218.91240 680.35806
4190.0000 -225.80299 -216.21031 9.59268 2.57047 -216.44550 754.35316
4195.0000 -225.64243 -216.77550 8.86694 2.52910 -217.28247 734.69502
4200.0000 -225.58426 -216.87329 8.71097 2.57038 -216.44737 748.74669
4205.0000 -225.73197 -217.21164 8.52033 2.57753 -216.30279 745.06606
4210.0000 -225.36198 -216.73912 8.62286 2.52947 -217.27510 717.79269
4215.0000 -226.67715 -217.24043 9.43672 2.53024 -217.25957 737.97557
4220.0000 -225.87874 -217.91180 7.96693 2.50864 -217.69655 714.51135
4225.0000 -227.71280 -219.75676 7.95604 2.46650 -218.54902 678.46829
4230.0000 -225.45175 -217.33285 8.11890 2.48331 -218.20892 710.93584
4235.0000 -224.40234 -215.59275 8.80959 2.57600 -216.33367 751.88289
4240.0000 -225.79226 -217.53171 8.26055 2.57411 -216.37198 753.96808
4245.0000 -226.27541 -218.13278 8.14263 2.47384 -218.40064 680.72480
4250.0000 -226.49987 -219.82292 6.67694 2.44957 -218.89159 652.35143
MELTING PROCESS: loop number 18 T-loop= 747.00000000000000
main_MD> interactions number 18 at Temperature= 747.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 2.32584 -1.11700 3.96167
force_rgl> df(natom) 0.81026 -0.94384 -1.30736
4255.0000 -225.92081 -216.81711 9.10370 2.48423 -218.19028 686.73249
4260.0000 -225.03567 -215.22341 9.81226 2.56079 -216.64144 741.74193
4265.0000 -225.21294 -216.68088 8.53206 2.62667 -215.30856 784.46195
4270.0000 -225.36613 -217.04135 8.32478 2.55040 -216.85160 718.06606
4275.0000 -225.52966 -215.79483 9.73483 2.55619 -216.73447 731.67928
4280.0000 -225.90080 -217.66518 8.23563 2.56920 -216.47133 741.79252
4285.0000 -224.69969 -216.73766 7.96203 2.56853 -216.48483 720.61609
4290.0000 -225.14722 -215.71275 9.43446 2.60887 -215.66878 773.70939
4295.0000 -226.26416 -216.61137 9.65280 2.53521 -217.15888 750.61348
4300.0000 -225.86362 -219.05812 6.80550 2.51151 -217.63840 696.60671
4305.0000 -225.77190 -217.81155 7.96036 2.46672 -218.54467 684.60328
4310.0000 -225.76017 -217.63574 8.12443 2.47508 -218.37552 697.11804
4315.0000 -225.92606 -216.91184 9.01422 2.54184 -217.02485 713.55908
4320.0000 -226.34113 -216.94003 9.40111 2.51201 -217.62832 727.42458
4325.0000 -227.08054 -219.39325 7.68729 2.48678 -218.13881 710.34960
4330.0000 -227.22677 -218.57591 8.65086 2.49335 -218.00577 711.41693
4335.0000 -225.24407 -216.82997 8.41410 2.45398 -218.80229 682.36111
4340.0000 -223.90004 -215.60753 8.29252 2.55534 -216.75179 751.28154
4345.0000 -226.31562 -217.86966 8.44596 2.56062 -216.64488 743.28017
4350.0000 -226.30863 -217.77467 8.53396 2.50898 -217.68962 706.89164
4355.0000 -224.63971 -216.09093 8.54878 2.52781 -217.30876 715.19474
4360.0000 -225.96044 -218.85613 7.10431 2.49932 -217.88511 720.85726
4365.0000 -226.10624 -218.89171 7.21453 2.46739 -218.53101 693.07422
4370.0000 -226.90700 -217.57912 9.32788 2.43831 -219.11942 675.52022
4375.0000 -225.06764 -215.72096 9.34668 2.58635 -216.12435 751.83134
4380.0000 -224.83885 -215.97436 8.86449 2.61062 -215.63334 784.94044
4385.0000 -223.10399 -214.54366 8.56034 2.64454 -214.94711 795.68417
4390.0000 -224.99693 -216.64100 8.35593 2.60253 -215.79700 765.92494
4395.0000 -224.17969 -216.51964 7.66005 2.58462 -216.15927 739.95302
4400.0000 -227.67035 -218.38271 9.28764 2.49989 -217.87345 687.35634
4405.0000 -226.59317 -218.86866 7.72452 2.44156 -219.05356 679.98244
4410.0000 -224.20669 -216.14592 8.06077 2.55558 -216.74692 732.03082
4415.0000 -224.43005 -215.84902 8.58103 2.58754 -216.10034 765.11225
4420.0000 -226.37535 -217.24730 9.12806 2.59428 -215.96392 747.83836
4425.0000 -226.44097 -216.29093 10.15004 2.56923 -216.47067 787.20480
4430.0000 -226.24056 -217.74596 8.49459 2.55329 -216.79325 755.44023
4435.0000 -224.23381 -215.07587 9.15794 2.54815 -216.89721 740.27251
4440.0000 -224.48401 -215.22813 9.25588 2.66023 -214.62969 817.87486
4445.0000 -223.90435 -215.42376 8.48059 2.62477 -215.34696 795.57736
4450.0000 -224.76831 -217.23671 7.53160 2.52905 -217.28349 724.72643
4455.0000 -224.99154 -215.96577 9.02577 2.57413 -216.37157 750.57963
4460.0000 -225.01970 -214.67231 10.34739 2.65164 -214.80331 788.86973
4465.0000 -224.54862 -215.41089 9.13773 2.64171 -215.00421 809.22084
4470.0000 -223.82402 -214.49159 9.33242 2.61725 -215.49918 787.86930
4475.0000 -225.00484 -215.18389 9.82095 2.64357 -214.96660 799.12750
4480.0000 -225.78962 -217.67806 8.11156 2.55261 -216.80701 743.52611
4485.0000 -223.98298 -215.01437 8.96861 2.53586 -217.14580 724.59177
4490.0000 -224.51117 -216.87240 7.63876 2.57957 -216.26157 745.27954
4495.0000 -225.72778 -216.00528 9.72251 2.58229 -216.20637 744.32707
4500.0000 -225.08087 -216.83131 8.24956 2.53697 -217.12329 737.15125
MELTING PROCESS: loop number 19 T-loop= 772.00000000000000
main_MD> interactions number 19 at Temperature= 772.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.47712 2.72739 -0.45929
force_rgl> df(natom) -2.23508 0.07336 1.92005
4505.0000 -225.22997 -216.57838 8.65158 2.60997 -215.64646 773.38189
4510.0000 -224.48149 -215.54905 8.93244 2.55265 -216.80618 740.03092
4515.0000 -225.21762 -216.16321 9.05441 2.58215 -216.20933 768.40555
4520.0000 -226.12485 -216.17193 9.95292 2.60856 -215.67501 771.32024
4525.0000 -224.15482 -215.25412 8.90070 2.60660 -215.71453 767.39590
4530.0000 -223.76881 -215.12779 8.64101 2.64503 -214.93709 822.90594
4535.0000 -223.69958 -214.38346 9.31612 2.67621 -214.30625 831.68799
4540.0000 -225.93485 -216.14465 9.79020 2.63722 -215.09519 812.54401
4545.0000 -224.16783 -215.85259 8.31524 2.59441 -215.96132 778.94434
4550.0000 -224.32990 -215.52725 8.80265 2.64270 -214.98424 810.80731
4555.0000 -224.14306 -214.79808 9.34498 2.62948 -215.25168 777.09179
4560.0000 -224.03417 -216.53108 7.50309 2.59080 -216.03421 752.46283
4565.0000 -226.79876 -216.43222 10.36655 2.55562 -216.74600 741.97932
4570.0000 -225.74237 -215.78625 9.95612 2.58987 -216.05315 784.38050
4575.0000 -225.39963 -216.74322 8.65641 2.58577 -216.13614 772.45271
4580.0000 -225.15234 -215.71499 9.43734 2.61200 -215.60548 799.05071
4585.0000 -226.46505 -216.03707 10.42798 2.59532 -215.94289 785.54149
4590.0000 -226.44717 -217.74359 8.70358 2.54555 -216.94973 732.17955
4595.0000 -227.23286 -220.18714 7.04572 2.49764 -217.91899 704.96075
4600.0000 -226.98304 -219.14421 7.83884 2.42881 -219.31162 686.80303
4605.0000 -225.91941 -217.79985 8.11956 2.49913 -217.88887 708.17348
4610.0000 -227.18982 -218.80035 8.38946 2.49909 -217.88977 706.74948
4615.0000 -226.23598 -217.93477 8.30121 2.46030 -218.67454 700.69772
4620.0000 -225.68090 -217.35367 8.32723 2.50529 -217.76420 716.65991
4625.0000 -227.29261 -218.12713 9.16548 2.52328 -217.40023 739.42943
4630.0000 -226.34778 -217.26914 9.07864 2.50118 -217.84736 711.42159
4635.0000 -224.29806 -215.70257 8.59549 2.59041 -216.04211 781.87575
4640.0000 -224.82571 -215.62003 9.20568 2.62132 -215.41684 781.49201
4645.0000 -225.30007 -216.90137 8.39870 2.54484 -216.96415 737.49948
4650.0000 -224.53402 -215.18531 9.34872 2.56457 -216.56493 759.03448
4655.0000 -225.25280 -217.45516 7.79764 2.54852 -216.88972 741.44562
4660.0000 -225.03151 -216.71294 8.31857 2.56431 -216.57028 746.56156
4665.0000 -224.03779 -214.71122 9.32657 2.55910 -216.67559 752.26836
4670.0000 -222.47522 -213.58653 8.88869 2.65612 -214.71276 822.54966
4675.0000 -224.95586 -215.63854 9.31732 2.65396 -214.75654 816.97692
4680.0000 -223.23477 -213.31188 9.92289 2.65626 -214.70990 806.79304
4685.0000 -223.50313 -213.96117 9.54197 2.69785 -213.86856 818.46490
4690.0000 -224.99479 -214.24276 10.75203 2.69350 -213.95646 845.23128
4695.0000 -224.77595 -215.33210 9.44385 2.64697 -214.89781 803.92131
4700.0000 -225.35898 -215.60416 9.75482 2.61955 -215.45255 777.53306
4705.0000 -225.94763 -217.09184 8.85580 2.59080 -216.03428 777.77029
4710.0000 -225.22680 -215.76837 9.45843 2.55383 -216.78224 756.26876
4715.0000 -224.12864 -215.06455 9.06409 2.62308 -215.38112 790.86007
4720.0000 -225.02668 -215.15997 9.86672 2.61353 -215.57439 780.38090
4725.0000 -225.21784 -215.42947 9.78838 2.62495 -215.34340 800.11229
4730.0000 -224.94886 -215.48043 9.46843 2.59492 -215.95090 785.45340
4735.0000 -224.52989 -215.59862 8.93127 2.63577 -215.12443 789.85660
4740.0000 -224.86316 -215.36277 9.50039 2.63209 -215.19888 786.85233
4745.0000 -224.84616 -213.61386 11.23230 2.64627 -214.91209 800.27636
4750.0000 -222.03231 -213.98514 8.04717 2.68173 -214.19472 842.35475
MELTING PROCESS: loop number 20 T-loop= 797.00000000000000
main_MD> interactions number 20 at Temperature= 797.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 4.31055 1.75387 3.62502
force_rgl> df(natom) -1.75166 1.83835 -2.69060
4755.0000 -224.47655 -214.45539 10.02116 2.67857 -214.25849 809.49773
4760.0000 -225.81452 -216.02374 9.79077 2.65000 -214.83656 808.53378
4765.0000 -224.90547 -215.30989 9.59559 2.60793 -215.68771 783.77876
4770.0000 -224.72381 -216.17563 8.54819 2.58846 -216.08155 788.99576
4775.0000 -224.78606 -214.10121 10.68485 2.64931 -214.85054 811.39960
4780.0000 -225.64900 -216.04718 9.60182 2.62273 -215.38836 794.02529
4785.0000 -225.11794 -216.79297 8.32497 2.53038 -217.25672 724.87214
4790.0000 -226.55594 -217.35558 9.20036 2.55835 -216.69074 754.91391
4795.0000 -225.91332 -218.00752 7.90580 2.50773 -217.71486 711.83246
4800.0000 -224.77005 -216.04784 8.72221 2.54718 -216.91672 748.36766
4805.0000 -224.89851 -216.28015 8.61836 2.58924 -216.06594 792.01146
4810.0000 -225.15952 -217.08558 8.07394 2.55800 -216.69787 767.15788
4815.0000 -225.53289 -216.72732 8.80557 2.55976 -216.66231 751.79842
4820.0000 -222.72359 -215.06757 7.65602 2.61547 -215.53512 788.17098
4825.0000 -223.71386 -213.66967 10.04419 2.64313 -214.97558 824.21607
4830.0000 -222.69601 -212.67359 10.02243 2.76042 -212.60270 894.28194
4835.0000 -224.77184 -214.88270 9.88914 2.68085 -214.21249 826.53750
4840.0000 -224.06071 -214.77624 9.28447 2.64910 -214.85473 817.51454
4845.0000 -224.29409 -215.96751 8.32658 2.57483 -216.35739 744.84302
4850.0000 -225.52150 -217.79293 7.72857 2.52624 -217.34047 721.09583
4855.0000 -225.97084 -219.02654 6.94430 2.51892 -217.48849 731.35787
4860.0000 -226.18604 -217.68496 8.50108 2.47339 -218.40959 690.09016
4865.0000 -224.83112 -216.42015 8.41097 2.52650 -217.33521 736.78039
4870.0000 -222.90734 -214.15562 8.75172 2.64640 -214.90934 813.53162
4875.0000 -224.13954 -215.23282 8.90672 2.68394 -214.15002 831.76623
4880.0000 -223.42830 -214.25019 9.17811 2.67081 -214.41554 797.01139
4885.0000 -223.99148 -214.85937 9.13210 2.69707 -213.88435 845.71634
4890.0000 -225.54556 -215.54809 9.99747 2.65047 -214.82698 804.44584
4895.0000 -224.57470 -214.70262 9.87208 2.58442 -216.16330 784.15914
4900.0000 -225.31738 -216.45749 8.85988 2.62438 -215.35484 789.68860
4905.0000 -225.16679 -215.94460 9.22218 2.60562 -215.73454 770.73885
4910.0000 -225.07537 -215.62606 9.44932 2.66498 -214.53360 816.98059
4915.0000 -226.15038 -216.59103 9.55935 2.58919 -216.06687 782.78394
4920.0000 -224.80028 -214.35218 10.44809 2.60308 -215.78578 798.00211
4925.0000 -224.22603 -214.68181 9.54421 2.63304 -215.17973 791.04443
4930.0000 -223.24962 -213.16297 10.08664 2.67467 -214.33756 793.96359
4935.0000 -221.09694 -213.50042 7.59651 2.72105 -213.39907 843.27027
4940.0000 -223.04446 -214.29992 8.74454 2.62507 -215.34100 788.11555
4945.0000 -222.30773 -213.07488 9.23285 2.73471 -213.12287 854.22846
4950.0000 -223.48607 -214.88307 8.60300 2.70477 -213.72842 832.36358
4955.0000 -224.02852 -214.84332 9.18520 2.66190 -214.59574 816.03982
4960.0000 -225.79582 -215.91887 9.87695 2.63851 -215.06898 801.80453
4965.0000 -223.55082 -215.23352 8.31730 2.61913 -215.46104 788.80344
4970.0000 -225.53981 -215.09006 10.44975 2.62699 -215.30213 804.13654
4975.0000 -223.13209 -212.45468 10.67740 2.72086 -213.40300 856.99412
4980.0000 -223.03224 -214.42852 8.60372 2.68483 -214.13189 817.19858
4985.0000 -223.52026 -213.85911 9.66115 2.62870 -215.26746 786.50012
4990.0000 -225.10253 -215.51784 9.58470 2.67227 -214.38598 816.69151
4995.0000 -223.86908 -214.63826 9.23083 2.61508 -215.54306 769.47250
5000.0000 -224.82906 -215.67340 9.15566 2.58883 -216.07421 757.35246
MELTING PROCESS: loop number 21 T-loop= 822.00000000000000
main_MD> interactions number 21 at Temperature= 822.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.50000 -2.67800 -0.61972
force_rgl> df(natom) -0.17621 1.60179 0.01196
5005.0000 -224.46484 -214.85477 9.61008 2.65900 -214.65446 794.83098
5010.0000 -223.84968 -214.61875 9.23093 2.65955 -214.64347 814.93429
5015.0000 -223.69793 -214.90899 8.78894 2.66013 -214.63156 795.92095
5020.0000 -222.90739 -213.61859 9.28881 2.63728 -215.09393 778.36762
5025.0000 -222.16903 -212.05712 10.11191 2.80511 -211.69855 925.72016
5030.0000 -221.42333 -210.39046 11.03288 2.84873 -210.81598 934.94275
5035.0000 -221.96384 -212.27793 9.68591 2.81196 -211.55983 899.58292
5040.0000 -222.49227 -210.81068 11.68159 2.81499 -211.49854 890.12388
5045.0000 -220.97602 -210.79188 10.18414 2.82726 -211.25028 896.07528
5050.0000 -224.48460 -213.89414 10.59046 2.79817 -211.83887 883.05181
5055.0000 -224.46632 -215.68944 8.77688 2.66164 -214.60117 802.05470
5060.0000 -224.11670 -215.40596 8.71074 2.62586 -215.32491 798.37646
5065.0000 -225.08248 -214.43146 10.65102 2.68717 -214.08467 837.25455
5070.0000 -224.62595 -214.64037 9.98558 2.67910 -214.24785 823.20494
5075.0000 -224.25248 -214.09295 10.15953 2.65220 -214.79201 789.91831
5080.0000 -224.51672 -215.60965 8.90707 2.66134 -214.60724 830.82929
5085.0000 -226.00987 -216.55574 9.45413 2.57138 -216.42717 769.17611
5090.0000 -223.67005 -215.07343 8.59662 2.59419 -215.96569 781.24375
5095.0000 -223.07767 -214.15460 8.92308 2.70085 -213.80776 830.45952
5100.0000 -222.58933 -213.41116 9.17817 2.69203 -213.98620 834.16017
5105.0000 -221.94915 -212.25162 9.69753 2.72679 -213.28307 868.86232
5110.0000 -223.46328 -212.70677 10.75651 2.77560 -212.29544 868.46473
5115.0000 -222.77367 -212.36347 10.41020 2.75791 -212.65346 856.56400
5120.0000 -222.81834 -213.45345 9.36489 2.68331 -214.16263 822.84163
5125.0000 -221.91545 -211.44898 10.46647 2.78939 -212.01653 868.26548
5130.0000 -222.58674 -213.01371 9.57303 2.79684 -211.86579 850.17766
5135.0000 -221.58938 -211.53824 10.05114 2.82762 -211.24309 926.26453
5140.0000 -221.82807 -211.96341 9.86467 2.82598 -211.27633 919.15951
5145.0000 -223.04655 -214.18519 8.86135 2.73846 -213.04692 852.03181
5150.0000 -225.42839 -214.78140 10.64700 2.64343 -214.96949 825.28712
5155.0000 -225.73329 -215.23531 10.49798 2.66360 -214.56149 819.53299
5160.0000 -224.86458 -214.78085 10.08372 2.61409 -215.56312 787.90045
5165.0000 -222.73243 -212.02334 10.70909 2.71887 -213.44330 836.32018
5170.0000 -224.20267 -213.59120 10.61147 2.71528 -213.51588 833.31569
5175.0000 -224.42815 -215.74899 8.67916 2.66729 -214.48685 810.63856
5180.0000 -225.77619 -217.02000 8.75619 2.57448 -216.36450 766.65761
5185.0000 -226.50964 -217.85306 8.65659 2.51042 -217.66047 715.14050
5190.0000 -224.03442 -215.43624 8.59818 2.57034 -216.44813 753.31475
5195.0000 -225.50700 -216.28792 9.21909 2.64734 -214.89046 797.42641
5200.0000 -224.95436 -215.77926 9.17510 2.60203 -215.80705 785.78969
5205.0000 -225.83587 -215.61384 10.22203 2.66363 -214.56085 833.93181
5210.0000 -223.63455 -213.65482 9.97973 2.65345 -214.76685 824.49151
5215.0000 -222.20522 -212.54307 9.66215 2.74184 -212.97858 830.85340
5220.0000 -221.15031 -212.26966 8.88065 2.74409 -212.93292 845.24552
5225.0000 -222.44345 -212.87952 9.56393 2.74479 -212.91886 841.71065
5230.0000 -224.41776 -214.89642 9.52134 2.69550 -213.91609 833.08277
5235.0000 -223.95629 -213.42443 10.53186 2.66823 -214.46781 818.49398
5240.0000 -224.67011 -214.92117 9.74893 2.64675 -214.90240 779.42619
5245.0000 -223.77471 -213.73187 10.04284 2.69939 -213.83737 843.92979
5250.0000 -222.27824 -211.55396 10.72428 2.77695 -212.26829 870.74544
MELTING PROCESS: loop number 22 T-loop= 847.00000000000000
main_MD> interactions number 22 at Temperature= 847.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.28112 -0.71239 1.41112
force_rgl> df(natom) 1.82022 0.94153 -2.48813
5255.0000 -222.61806 -213.58892 9.02913 2.72912 -213.23584 846.79832
5260.0000 -223.21363 -211.38586 11.82778 2.76265 -212.55751 848.48859
5265.0000 -222.09974 -211.51261 10.58713 2.81889 -211.41977 911.42532
5270.0000 -222.75901 -212.62131 10.13770 2.77858 -212.23525 893.05235
5275.0000 -222.40411 -212.62342 9.78069 2.76221 -212.56638 864.66759
5280.0000 -222.09152 -211.94263 10.14889 2.74669 -212.88040 854.19073
5285.0000 -223.26440 -211.03685 12.22755 2.83268 -211.14063 918.83132
5290.0000 -224.27289 -213.47827 10.79462 2.78714 -212.06203 897.52482
5295.0000 -222.76758 -212.44490 10.32268 2.72889 -213.24049 852.28992
5300.0000 -223.55699 -213.52229 10.03470 2.74904 -212.83292 859.49333
5305.0000 -224.15489 -215.06107 9.09381 2.71232 -213.57584 848.16229
5310.0000 -221.50554 -212.31081 9.19473 2.72920 -213.23417 844.27471
5315.0000 -223.59460 -212.60874 10.98586 2.79460 -211.91111 889.97765
5320.0000 -221.70075 -211.95100 9.74976 2.73332 -213.15083 858.05034
5325.0000 -220.97710 -210.56989 10.40722 2.83285 -211.13731 914.91072
5330.0000 -222.16842 -211.93961 10.22882 2.81192 -211.56072 909.71898
5335.0000 -222.47789 -211.98804 10.48985 2.82286 -211.33944 923.53458
5340.0000 -223.95206 -214.08403 9.86803 2.73615 -213.09362 851.25565
5345.0000 -223.69410 -214.91414 8.77997 2.70267 -213.77109 858.05100
5350.0000 -223.26719 -213.91848 9.34871 2.71290 -213.56407 869.09429
5355.0000 -222.84063 -211.95276 10.88787 2.76046 -212.60175 887.44218
5360.0000 -223.18041 -212.46465 10.71576 2.77785 -212.24993 885.35153
5365.0000 -223.82084 -213.34604 10.47480 2.77580 -212.29149 904.35948
5370.0000 -222.93387 -211.90544 11.02843 2.78354 -212.13496 879.09180
5375.0000 -225.12193 -214.02841 11.09353 2.72526 -213.31406 874.60763
5380.0000 -224.44652 -216.45783 7.98870 2.59593 -215.93058 771.13410
5385.0000 -224.51913 -215.34320 9.17593 2.62075 -215.42833 786.40643
5390.0000 -223.50452 -216.04174 7.46278 2.63858 -215.06770 820.38246
5395.0000 -224.33609 -215.19715 9.13894 2.54249 -217.01159 747.06686
5400.0000 -224.27869 -214.13400 10.14469 2.65081 -214.82016 803.28660
5405.0000 -224.26726 -213.82587 10.44139 2.69992 -213.82669 849.19044
5410.0000 -224.96993 -213.07594 11.89399 2.72927 -213.23282 852.46772
5415.0000 -222.36378 -212.63168 9.73210 2.69720 -213.88165 827.44268
5420.0000 -224.94415 -215.19882 9.74532 2.72426 -213.33415 851.10130
5425.0000 -224.37161 -212.95863 11.41298 2.66999 -214.43212 801.00493
5430.0000 -223.27515 -214.79508 8.48007 2.72344 -213.35074 848.73116
5435.0000 -224.06895 -214.58136 9.48759 2.65486 -214.73824 801.02045
5440.0000 -223.44440 -214.91011 8.53429 2.66466 -214.53996 813.24858
5445.0000 -223.02934 -213.61794 9.41140 2.71404 -213.54100 834.91760
5450.0000 -223.91179 -214.86662 9.04517 2.70180 -213.78852 854.10894
5455.0000 -224.65951 -215.45317 9.20634 2.64987 -214.83925 829.24366
5460.0000 -224.94283 -214.36459 10.57824 2.67846 -214.26085 816.21329
5465.0000 -222.24045 -212.14182 10.09863 2.69299 -213.96693 822.50927
5470.0000 -222.68842 -212.94573 9.74269 2.74927 -212.82828 863.10987
5475.0000 -223.10864 -213.34552 9.76311 2.74235 -212.96823 847.47746
5480.0000 -223.28520 -213.70008 9.58511 2.71656 -213.48988 839.57512
5485.0000 -222.36552 -212.02881 10.33671 2.70596 -213.70438 832.37549
5490.0000 -224.68653 -213.76944 10.91708 2.75509 -212.71054 875.91902
5495.0000 -225.08704 -215.55059 9.53645 2.66669 -214.49887 831.14802
5500.0000 -223.96616 -216.32892 7.63724 2.54688 -216.92276 742.47427
MELTING PROCESS: loop number 23 T-loop= 872.00000000000000
main_MD> interactions number 23 at Temperature= 872.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.76049 0.36496 -1.92865
force_rgl> df(natom) 2.41239 2.70361 -3.60711
5505.0000 -223.73007 -212.78421 10.94585 2.66185 -214.59683 815.37638
5510.0000 -223.37397 -213.19415 10.17982 2.72142 -213.39158 834.06596
5515.0000 -221.44927 -210.07478 11.37450 2.85099 -210.77017 935.04439
5520.0000 -220.37264 -210.11045 10.26219 2.86642 -210.45816 917.53569
5525.0000 -222.31233 -210.67352 11.63881 2.85389 -210.71165 918.90858
5530.0000 -221.60482 -210.28310 11.32172 2.88605 -210.06103 926.81683
5535.0000 -219.23052 -207.91262 11.31790 2.88563 -210.06941 958.00799
5540.0000 -220.19922 -209.41877 10.78045 2.89469 -209.88605 942.97716
5545.0000 -222.44343 -211.45489 10.98854 2.82985 -211.19789 885.94343
5550.0000 -223.99075 -212.43782 11.55293 2.79061 -211.99177 883.29951
5555.0000 -223.62873 -214.15808 9.47064 2.72961 -213.22591 867.46785
5560.0000 -225.34063 -216.91604 8.42459 2.61531 -215.53834 808.37046
5565.0000 -224.92492 -214.84191 10.08302 2.62364 -215.36987 781.01590
5570.0000 -223.29592 -212.66169 10.63423 2.70652 -213.69305 844.02023
5575.0000 -224.48210 -212.81934 11.66276 2.78426 -212.12034 881.85481
5580.0000 -222.28252 -210.38746 11.89507 2.79730 -211.85653 894.23137
5585.0000 -222.46078 -209.57585 12.88493 2.87236 -210.33795 928.79579
5590.0000 -221.57152 -211.93806 9.63346 2.84183 -210.95549 925.46490
5595.0000 -222.57039 -213.73230 8.83809 2.72857 -213.24695 858.82966
5600.0000 -222.86854 -212.97326 9.89528 2.75716 -212.66865 871.89491
5605.0000 -220.93369 -210.56746 10.36623 2.82185 -211.35974 921.72697
5610.0000 -222.07231 -212.33300 9.73931 2.83068 -211.18117 893.95100
5615.0000 -223.58330 -214.02809 9.55522 2.74555 -212.90351 859.13784
5620.0000 -221.65160 -212.70339 8.94821 2.71376 -213.54653 852.43698
5625.0000 -221.32487 -211.25432 10.07055 2.85761 -210.63628 949.94228
5630.0000 -222.63823 -212.02372 10.61451 2.82331 -211.33026 891.02449
5635.0000 -221.86236 -211.13978 10.72259 2.74898 -212.83407 881.98223
5640.0000 -222.80348 -211.97210 10.83138 2.78947 -212.01488 900.21192
5645.0000 -220.92066 -210.68118 10.23948 2.83111 -211.17239 904.80027
5650.0000 -222.65081 -211.95655 10.69426 2.79611 -211.88052 909.50959
5655.0000 -222.91734 -213.32164 9.59570 2.75370 -212.73866 883.41684
5660.0000 -224.86503 -215.10255 9.76248 2.69290 -213.96857 809.01460
5665.0000 -224.27774 -213.96296 10.31477 2.71140 -213.59435 853.20774
5670.0000 -224.52756 -215.88969 8.63787 2.62683 -215.30542 803.21687
5675.0000 -225.05401 -215.23564 9.81838 2.61494 -215.54586 780.49455
5680.0000 -222.45751 -213.79554 8.66196 2.70112 -213.80235 840.12719
5685.0000 -225.44945 -216.94850 8.50095 2.61304 -215.58425 768.72678
5690.0000 -224.10486 -215.24760 8.85726 2.62174 -215.40837 778.64836
5695.0000 -223.47587 -213.70441 9.77147 2.61864 -215.47095 755.40778
5700.0000 -224.09303 -213.67031 10.42273 2.69877 -213.84989 841.14432
5705.0000 -224.52935 -214.82470 9.70465 2.65550 -214.72528 816.34338
5710.0000 -222.22726 -211.55407 10.67320 2.71728 -213.47548 834.63247
5715.0000 -223.60449 -212.85634 10.74815 2.79089 -211.98618 888.15395
5720.0000 -222.71992 -213.09471 9.62521 2.75257 -212.76138 893.91451
5725.0000 -223.64583 -213.45265 10.19319 2.72988 -213.22050 852.17747
5730.0000 -223.32451 -212.70841 10.61610 2.68271 -214.17486 846.45727
5735.0000 -222.54604 -213.62146 8.92458 2.71104 -213.60167 841.01934
5740.0000 -222.06734 -211.13875 10.92858 2.75619 -212.68812 825.44740
5745.0000 -222.75116 -212.15816 10.59300 2.86050 -210.57789 929.06199
5750.0000 -222.86200 -212.21753 10.64447 2.75194 -212.77429 880.55017
MELTING PROCESS: loop number 24 T-loop= 897.00000000000000
main_MD> interactions number 24 at Temperature= 897.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.07756 2.11685 0.57791
force_rgl> df(natom) 0.10337 -7.90654 -3.23376
5755.0000 -222.16282 -213.09595 9.06687 2.74964 -212.82062 866.09784
5760.0000 -223.45575 -214.15716 9.29858 2.71787 -213.46348 852.69575
5765.0000 -224.52755 -213.24175 11.28580 2.69005 -214.02631 836.55177
5770.0000 -222.12331 -210.57313 11.55017 2.80670 -211.66630 901.92769
5775.0000 -221.59552 -210.67070 10.92483 2.84821 -210.82652 921.25090
5780.0000 -219.56930 -210.17060 9.39870 2.82607 -211.27441 895.77405
5785.0000 -222.60720 -210.53656 12.07064 2.89087 -209.96338 938.96073
5790.0000 -221.42194 -209.30683 12.11511 2.88228 -210.13730 950.08264
5795.0000 -220.29518 -210.03578 10.25940 2.90999 -209.57653 955.47461
5800.0000 -223.00808 -212.44867 10.55942 2.83939 -211.00500 906.73410
5805.0000 -222.94136 -213.98519 8.95617 2.68780 -214.07184 798.90196
5810.0000 -223.48680 -211.59710 11.88970 2.73423 -213.13241 867.11030
5815.0000 -221.72332 -211.52029 10.20303 2.79848 -211.83268 849.34823
5820.0000 -222.73653 -211.51216 11.22437 2.81428 -211.51298 899.35466
5825.0000 -222.57321 -212.85327 9.71994 2.76839 -212.44145 876.56704
5830.0000 -221.68137 -211.74039 9.94098 2.79983 -211.80532 915.06262
5835.0000 -221.30548 -211.35108 9.95440 2.81208 -211.55747 891.19831
5840.0000 -222.73383 -212.34185 10.39199 2.75138 -212.78548 863.43531
5845.0000 -220.83075 -211.24248 9.58827 2.79032 -211.99766 905.31652
5850.0000 -222.10226 -211.63503 10.46724 2.84730 -210.84500 911.70865
5855.0000 -220.36552 -208.94340 11.42212 2.83888 -211.01520 913.13808
5860.0000 -218.63999 -208.07416 10.56583 2.85730 -210.64262 906.80651
5865.0000 -221.44287 -209.53715 11.90572 2.96710 -208.42123 1006.77260
5870.0000 -221.15636 -211.30446 9.85190 2.86235 -210.54045 950.40469
5875.0000 -220.49181 -210.56758 9.92423 2.83733 -211.04669 903.09843
5880.0000 -221.01750 -208.67786 12.33963 2.91497 -209.47578 939.62798
5885.0000 -222.25630 -210.66602 11.59028 2.89778 -209.82369 974.82500
5890.0000 -224.29157 -213.91417 10.37741 2.77970 -212.21263 900.64567
5895.0000 -223.08774 -213.97569 9.11205 2.68573 -214.11373 836.00664
5900.0000 -221.45802 -213.18010 8.27792 2.71718 -213.47748 821.02562
5905.0000 -222.59941 -211.19131 11.40811 2.78717 -212.06137 868.00183
5910.0000 -223.24341 -213.07833 10.16508 2.76213 -212.56809 875.66195
5915.0000 -223.76661 -212.89522 10.87139 2.73101 -213.19757 846.56227
5920.0000 -222.75678 -211.03183 11.72495 2.77819 -212.24316 876.76073
5925.0000 -222.48907 -211.33452 11.15455 2.83231 -211.14809 924.95117
5930.0000 -221.99776 -211.31353 10.68423 2.77307 -212.34675 858.88652
5935.0000 -222.44043 -212.47629 9.96414 2.81045 -211.59052 904.84198
5940.0000 -221.93558 -210.40045 11.53513 2.85069 -210.77627 948.30542
5945.0000 -221.83805 -211.65571 10.18234 2.82509 -211.29420 897.12625
5950.0000 -221.60856 -209.66990 11.93866 2.83539 -211.08594 899.41007
5955.0000 -221.22686 -210.58194 10.64492 2.92342 -209.30496 954.33533
5960.0000 -221.93442 -210.59753 11.33689 2.85456 -210.69806 920.32459
5965.0000 -222.60041 -211.64662 10.95379 2.86802 -210.42563 930.84966
5970.0000 -221.04477 -211.47881 9.56596 2.77813 -212.24441 864.57346
5975.0000 -223.20866 -212.68203 10.52662 2.75339 -212.74493 854.14611
5980.0000 -222.01364 -210.84630 11.16735 2.76481 -212.51386 896.99839
5985.0000 -220.88566 -210.40318 10.48248 2.86624 -210.46174 942.09279
5990.0000 -222.41757 -213.99476 8.42282 2.77421 -212.32371 859.75701
5995.0000 -222.29004 -212.96343 9.32661 2.68821 -214.06350 831.17335
6000.0000 -224.92990 -214.22915 10.70075 2.71328 -213.55631 850.59369
MELTING PROCESS: loop number 25 T-loop= 922.00000000000000
main_MD> interactions number 25 at Temperature= 922.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -2.42676 0.34519 -7.01962
force_rgl> df(natom) 1.37123 0.93081 -1.96090
6005.0000 -223.16415 -211.37211 11.79204 2.80782 -211.64366 909.22527
6010.0000 -222.41610 -210.83904 11.57706 2.84238 -210.94444 940.57514
6015.0000 -223.86045 -214.22434 9.63612 2.78452 -212.11495 875.33983
6020.0000 -224.08633 -214.05850 10.02784 2.66067 -214.62067 841.52474
6025.0000 -222.75508 -211.70220 11.05288 2.76988 -212.41120 889.39509
6030.0000 -222.67395 -211.19704 11.47691 2.81754 -211.44694 900.49344
6035.0000 -221.99015 -208.94579 13.04436 2.90003 -209.77807 963.25307
6040.0000 -220.83079 -209.08360 11.74719 2.91985 -209.37712 980.93763
6045.0000 -220.69001 -211.08529 9.60472 2.86300 -210.52725 927.61489
6050.0000 -223.33267 -213.42841 9.90426 2.79328 -211.93777 876.80827
6055.0000 -222.17006 -213.04646 9.12360 2.68127 -214.20388 817.72013
6060.0000 -222.20444 -212.49939 9.70505 2.78511 -212.10302 864.65896
6065.0000 -223.57149 -212.92658 10.64492 2.76593 -212.49108 870.17459
6070.0000 -222.96351 -212.08002 10.88349 2.77367 -212.33461 878.01568
6075.0000 -223.00214 -212.27167 10.73047 2.78312 -212.14347 895.49978
6080.0000 -223.47884 -212.25470 11.22414 2.79618 -211.87918 891.24248
6085.0000 -220.49532 -211.20643 9.28888 2.77506 -212.30649 874.47893
6090.0000 -221.81475 -209.05312 12.76163 2.83659 -211.06166 919.92369
6095.0000 -220.64700 -210.32779 10.31922 2.88862 -210.00892 962.83226
6100.0000 -221.80524 -209.17824 12.62700 2.84643 -210.86244 928.45165
6105.0000 -221.60042 -210.01660 11.58382 2.96806 -208.40178 1009.38794
6110.0000 -223.32802 -211.48503 11.84299 2.88517 -210.07881 954.48388
6115.0000 -220.62921 -210.18654 10.44267 2.87090 -210.36739 942.07013
6120.0000 -219.47812 -208.80595 10.67216 2.85259 -210.73781 936.56981
6125.0000 -222.27785 -212.11552 10.16233 2.89479 -209.88407 925.84197
6130.0000 -222.88739 -212.04839 10.83900 2.77001 -212.40860 876.12641
6135.0000 -221.64601 -210.89586 10.75015 2.81472 -211.50414 896.27890
6140.0000 -223.52903 -212.13165 11.39738 2.80232 -211.75497 888.25241
6145.0000 -222.63115 -212.04101 10.59014 2.84640 -210.86322 913.37664
6150.0000 -221.43707 -212.23256 9.20452 2.77432 -212.32150 857.79193
6155.0000 -222.82588 -212.14332 10.68256 2.81648 -211.46853 911.72944
6160.0000 -221.21943 -209.69904 11.52040 2.85192 -210.75143 921.76375
6165.0000 -218.85593 -206.85967 11.99626 3.04043 -206.93753 1018.34893
6170.0000 -222.99921 -212.75133 10.24788 2.84377 -210.91639 926.34885
6175.0000 -222.40471 -211.37045 11.03425 2.77119 -212.38464 888.09213
6180.0000 -220.06014 -208.67303 11.38710 2.90502 -209.67711 957.87421
6185.0000 -221.71710 -210.15385 11.56325 2.92224 -209.32873 962.08648
6190.0000 -221.73906 -211.01213 10.72693 2.86243 -210.53889 959.66366
6195.0000 -219.31957 -208.58800 10.73157 2.88677 -210.04644 968.57922
6200.0000 -219.93961 -209.19809 10.74152 2.92759 -209.22044 963.60605
6205.0000 -221.25708 -209.27306 11.98401 2.93927 -208.98416 965.03736
6210.0000 -221.06406 -209.96418 11.09988 2.89519 -209.87603 936.24808
6215.0000 -221.32859 -210.94822 10.38036 2.86608 -210.46506 946.16900
6220.0000 -221.81067 -211.08412 10.72655 2.85387 -210.71194 932.52156
6225.0000 -221.73219 -210.61113 11.12106 2.78494 -212.10652 908.67709
6230.0000 -220.19537 -210.26698 9.92839 2.86952 -210.39541 923.58411
6235.0000 -221.10140 -208.80206 12.29934 2.94531 -208.86207 985.81568
6240.0000 -222.74134 -212.25462 10.48672 2.83774 -211.03831 911.10534
6245.0000 -222.52398 -212.90112 9.62285 2.83173 -211.15990 902.30910
6250.0000 -222.03483 -212.04265 9.99218 2.82362 -211.32400 899.32905
MELTING PROCESS: loop number 26 T-loop= 947.00000000000000
main_MD> interactions number 26 at Temperature= 947.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.15188 0.77422 2.63921
force_rgl> df(natom) 1.01866 -0.68719 1.59216
6255.0000 -222.44213 -213.51104 8.93108 2.75026 -212.80826 890.95153
6260.0000 -224.05277 -214.63133 9.42144 2.67181 -214.39528 825.15713
6265.0000 -222.02417 -213.12863 8.89554 2.70887 -213.64549 863.75954
6270.0000 -223.39212 -212.19306 11.19906 2.78633 -212.07849 910.24571
6275.0000 -221.15885 -211.67820 9.48064 2.78790 -212.04671 878.63943
6280.0000 -222.09330 -212.62971 9.46359 2.79680 -211.86657 879.05063
6285.0000 -221.19852 -210.09946 11.09906 2.86733 -210.43961 957.46436
6290.0000 -222.78631 -212.51621 10.27010 2.77678 -212.27159 880.89326
6295.0000 -221.37332 -210.66231 10.71101 2.83691 -211.05508 919.00455
6300.0000 -221.30097 -209.95492 11.34605 2.86521 -210.48255 922.39993
6305.0000 -220.34834 -208.35483 11.99352 2.90552 -209.66704 945.50199
6310.0000 -220.74453 -211.45791 9.28661 2.93096 -209.15238 974.58112
6315.0000 -222.58163 -211.06916 11.51247 2.80323 -211.73657 921.83693
6320.0000 -218.88610 -207.17299 11.71311 2.91357 -209.50423 975.84402
6325.0000 -221.68920 -210.55984 11.12936 2.85776 -210.63326 898.58037
6330.0000 -221.44596 -210.30012 11.14583 2.86280 -210.53132 923.18292
6335.0000 -220.53358 -210.08479 10.44879 2.88338 -210.11496 960.46632
6340.0000 -222.80612 -211.80435 11.00177 2.84944 -210.80159 912.95639
6345.0000 -220.90231 -208.05072 12.85159 2.89080 -209.96491 959.51262
6350.0000 -221.11984 -209.92249 11.19734 2.90478 -209.68196 979.77394
6355.0000 -221.77389 -209.61072 12.16317 2.90355 -209.70697 979.50112
6360.0000 -221.65090 -211.64897 10.00194 2.84487 -210.89407 906.33317
6365.0000 -223.39395 -213.30049 10.09346 2.75603 -212.69142 877.72849
6370.0000 -221.08113 -209.42469 11.65644 2.82771 -211.24133 892.51926
6375.0000 -219.72376 -209.81354 9.91022 2.88378 -210.10693 950.74035
6380.0000 -219.36564 -207.49881 11.86683 2.97653 -208.23033 979.89568
6385.0000 -218.30618 -207.73723 10.56896 2.96971 -208.36836 987.82994
6390.0000 -219.12979 -206.79579 12.33400 3.02461 -207.25772 1011.43388
6395.0000 -221.58149 -209.69007 11.89142 2.93963 -208.97688 975.09220
6400.0000 -220.81058 -210.48142 10.32916 2.87773 -210.22935 927.66832
6405.0000 -223.25985 -212.56120 10.69864 2.80642 -211.67199 905.36139
6410.0000 -223.63430 -212.58549 11.04881 2.81647 -211.46871 917.04793
6415.0000 -223.74315 -213.50551 10.23764 2.77008 -212.40718 855.31764
6420.0000 -224.20232 -212.81789 11.38443 2.75565 -212.69915 871.53250
6425.0000 -220.95077 -209.70914 11.24163 2.79059 -211.99217 900.19976
6430.0000 -219.24408 -209.42098 9.82311 2.92418 -209.28948 986.57888
6435.0000 -222.22896 -210.55829 11.67067 2.87627 -210.25883 935.05169
6440.0000 -220.90055 -211.08211 9.81844 2.90056 -209.76731 959.45814
6445.0000 -221.77359 -211.45195 10.32165 2.80797 -211.64070 915.29688
6450.0000 -220.85965 -211.86227 8.99738 2.81273 -211.54434 893.36647
6455.0000 -220.94088 -210.58599 10.35489 2.83276 -211.13917 918.37683
6460.0000 -222.29289 -210.44218 11.85071 2.88603 -210.06133 970.45641
6465.0000 -221.79894 -209.55486 12.24408 2.91114 -209.55334 963.82956
6470.0000 -221.62967 -208.83315 12.79652 2.87777 -210.22848 964.04057
6475.0000 -221.88938 -211.00046 10.88892 2.90196 -209.73904 957.87699
6480.0000 -221.54586 -210.49531 11.05055 2.92422 -209.28861 973.14570
6485.0000 -219.05884 -208.27593 10.78291 2.93936 -208.98232 1011.90107
6490.0000 -222.80122 -210.59297 12.20825 2.88852 -210.01104 952.44178
6495.0000 -218.88758 -207.94633 10.94125 2.89999 -209.77898 959.25509
6500.0000 -222.73419 -210.13445 12.59973 2.92005 -209.37305 990.39217
MELTING PROCESS: loop number 27 T-loop= 972.00000000000000
main_MD> interactions number 27 at Temperature= 972.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.55753 2.77955 2.30121
force_rgl> df(natom) 0.66779 -0.73681 1.82694
6505.0000 -221.78403 -210.32680 11.45724 2.89168 -209.94714 970.83898
6510.0000 -217.94653 -206.47980 11.46673 2.93488 -209.07314 970.97164
6515.0000 -220.02198 -205.16528 14.85669 3.06501 -206.44036 1044.44938
6520.0000 -221.08248 -207.72773 13.35474 3.07062 -206.32682 1053.01344
6525.0000 -223.18193 -209.53168 13.65025 2.93691 -209.03197 956.71466
6530.0000 -219.86376 -207.45502 12.40875 2.95393 -208.68756 982.30459
6535.0000 -219.59864 -207.51854 12.08010 3.04180 -206.90994 1069.72864
6540.0000 -220.68656 -209.72100 10.96556 2.93280 -209.11512 986.53669
6545.0000 -221.99529 -209.87542 12.11986 2.97970 -208.16620 1041.15528
6550.0000 -220.67863 -208.80079 11.87784 2.88365 -210.10953 947.73021
6555.0000 -221.27077 -208.98063 12.29014 2.92557 -209.26140 961.85974
6560.0000 -220.55431 -209.33691 11.21741 2.95613 -208.64303 1016.57230
6565.0000 -221.02895 -208.32026 12.70869 3.00302 -207.69455 1022.12533
6570.0000 -220.97377 -209.02235 11.95142 2.98793 -207.99984 1006.12649
6575.0000 -220.90174 -209.30914 11.59261 2.93969 -208.97578 985.42758
6580.0000 -219.92115 -209.76485 10.15630 2.91165 -209.54294 983.96786
6585.0000 -222.69545 -210.63605 12.05940 2.88979 -209.98529 934.38277
6590.0000 -220.40221 -207.73145 12.67077 2.85163 -210.75740 936.80009
6595.0000 -219.59257 -208.83205 10.76053 2.96683 -208.42661 984.26969
6600.0000 -220.88421 -209.37375 11.51047 2.96669 -208.42943 1007.12678
6605.0000 -220.56882 -208.66403 11.90478 2.92307 -209.31195 964.32298
6610.0000 -220.84703 -210.29050 10.55653 2.89595 -209.86062 952.74666
6615.0000 -223.01432 -211.54622 11.46811 2.85945 -210.59917 930.31483
6620.0000 -221.22385 -209.30852 11.91534 2.84980 -210.79434 947.94601
6625.0000 -218.64515 -207.90931 10.73585 2.94421 -208.88435 994.40833
6630.0000 -219.33575 -209.01734 10.31840 2.96854 -208.39209 998.92360
6635.0000 -219.76278 -208.30265 11.46013 2.89487 -209.88259 980.45852
6640.0000 -220.96350 -210.58609 10.37741 2.90719 -209.63329 948.12839
6645.0000 -221.02872 -209.76548 11.26324 2.93006 -209.17048 992.08490
6650.0000 -218.66553 -207.04526 11.62027 2.98181 -208.12352 1010.35297
6655.0000 -221.57642 -209.13380 12.44261 2.95447 -208.67667 1012.75354
6660.0000 -218.67992 -207.02679 11.65313 3.00968 -207.55967 1007.67014
6665.0000 -220.77092 -209.14433 11.62659 3.02261 -207.29822 1030.80488
6670.0000 -220.32335 -208.89767 11.42569 2.91673 -209.44027 986.11716
6675.0000 -219.84678 -207.58473 12.26205 2.97446 -208.27219 977.72672
6680.0000 -220.56245 -208.90999 11.65246 2.94877 -208.79200 1002.06547
6685.0000 -220.59665 -210.74011 9.85654 2.93020 -209.16762 960.58431
6690.0000 -219.56559 -208.12130 11.44429 2.91313 -209.51310 937.65739
6695.0000 -219.40002 -207.21819 12.18183 3.01798 -207.39174 1027.90625
6700.0000 -220.94688 -208.23944 12.70744 3.00389 -207.67686 1005.92202
6705.0000 -221.76504 -212.00957 9.75547 2.89685 -209.84248 961.97028
6710.0000 -220.64523 -209.27545 11.36978 2.85070 -210.77621 903.12704
6715.0000 -221.78682 -210.70991 11.07692 2.92227 -209.32824 958.33742
6720.0000 -221.06266 -211.04363 10.01903 2.85283 -210.73303 945.82768
6725.0000 -221.34095 -211.30733 10.03362 2.85060 -210.77811 938.50731
6730.0000 -221.06970 -209.21109 11.85860 2.93411 -209.08868 1003.25281
6735.0000 -221.98734 -210.31490 11.67244 2.89536 -209.87254 957.90021
6740.0000 -219.99117 -208.46160 11.52957 2.94015 -208.96634 983.98621
6745.0000 -220.90676 -209.25106 11.65570 2.93141 -209.14322 971.56575
6750.0000 -222.38738 -212.33168 10.05570 2.82534 -211.28915 907.61612
MELTING PROCESS: loop number 28 T-loop= 997.00000000000000
main_MD> interactions number 28 at Temperature= 997.00000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 1.29780 4.17034 2.06302
force_rgl> df(natom) -1.98033 -3.73833 -2.62271
6755.0000 -220.85617 -209.15924 11.69693 2.83962 -211.00028 934.51840
6760.0000 -219.45596 -208.44162 11.01434 2.92367 -209.29991 972.66214
6765.0000 -218.38615 -204.89872 13.48743 3.03985 -206.94936 1051.67645
6770.0000 -219.18784 -206.16672 13.02111 3.05908 -206.56031 1056.95788
6775.0000 -218.42510 -205.91415 12.51095 3.13081 -205.10905 1104.25379
6780.0000 -217.68248 -205.61093 12.07154 3.12016 -205.32463 1099.20860
6785.0000 -219.77228 -208.29564 11.47664 3.00373 -207.68012 1002.07041
6790.0000 -219.06689 -207.29211 11.77478 2.97895 -208.18138 972.42401
6795.0000 -218.50392 -206.10313 12.40079 3.10688 -205.59321 1053.01028
6800.0000 -219.86563 -206.96024 12.90539 3.06752 -206.38963 1071.18914
6805.0000 -221.01173 -209.29491 11.71682 2.99011 -207.95556 1037.49822
6810.0000 -218.88958 -207.49113 11.39845 2.96997 -208.36317 1015.84664
6815.0000 -219.59845 -207.41554 12.18291 3.04384 -206.86868 1035.51268
6820.0000 -219.08550 -206.41433 12.67117 2.97928 -208.17477 999.51073
6825.0000 -221.40715 -209.75833 11.64882 2.99552 -207.84625 1011.62881
6830.0000 -220.96671 -208.56936 12.39734 2.93534 -209.06374 984.25709
6835.0000 -221.01285 -208.77987 12.23298 2.92584 -209.25599 958.99936
6840.0000 -220.00063 -208.45633 11.54430 2.92574 -209.25798 965.66325
6845.0000 -219.69899 -207.92221 11.77678 2.96447 -208.47430 999.36923
6850.0000 -221.77118 -210.29230 11.47888 2.88520 -210.07820 944.90097
6855.0000 -221.31683 -209.51725 11.79958 2.87602 -210.26386 933.46752
6860.0000 -219.21473 -208.85904 10.35568 2.97718 -208.21716 1007.20895
6865.0000 -220.55481 -208.02834 12.52647 2.94672 -208.83348 983.46750
6870.0000 -217.75997 -205.08726 12.67272 3.05211 -206.70128 1063.60151
6875.0000 -220.89079 -208.92941 11.96138 2.99904 -207.77506 1020.76320
6880.0000 -218.23986 -205.81836 12.42150 3.01802 -207.39099 1024.54051
6885.0000 -220.08618 -207.97131 12.11487 3.04021 -206.94203 1056.93011
6890.0000 -218.56418 -206.96079 11.60339 3.03524 -207.04259 1039.30467
6895.0000 -222.66648 -210.25094 12.41554 2.94307 -208.90732 982.02857
6900.0000 -221.05607 -209.87741 11.17866 2.92459 -209.28120 968.00229
6905.0000 -223.03398 -210.73543 12.29856 2.87022 -210.38111 957.62823
6910.0000 -222.30129 -210.65706 11.64423 2.85851 -210.61807 894.96833
6915.0000 -221.23995 -210.92631 10.31364 2.86331 -210.52107 921.88283
6920.0000 -220.35314 -208.44748 11.90566 2.90923 -209.59198 973.06676
6925.0000 -221.13687 -208.35013 12.78674 2.93447 -209.08124 996.16865
6930.0000 -219.52906 -207.18617 12.34288 2.95703 -208.62491 998.93992
6935.0000 -221.39940 -209.24158 12.15782 2.96365 -208.49104 1012.22867
6940.0000 -221.64016 -209.30329 12.33687 2.90355 -209.70687 969.04853
6945.0000 -221.65628 -209.28059 12.37569 2.93089 -209.15377 988.53314
6950.0000 -220.20481 -208.96900 11.23581 2.91339 -209.50772 969.38082
6955.0000 -219.86588 -207.67480 12.19108 2.95489 -208.66819 996.14459
6960.0000 -218.64507 -207.75620 10.88888 3.00843 -207.58492 993.56893
6965.0000 -220.88372 -208.47097 12.41275 2.97211 -208.31982 1017.07971
6970.0000 -222.39603 -209.95801 12.43803 2.90553 -209.66690 973.43389
6975.0000 -221.67385 -209.63256 12.04129 2.85715 -210.64562 926.37333
6980.0000 -223.01355 -212.38180 10.63175 2.87397 -210.30533 929.24732
6985.0000 -222.56475 -212.08003 10.48473 2.75141 -212.78484 858.67570
6990.0000 -220.93304 -211.25479 9.67825 2.80209 -211.75955 897.26822
6995.0000 -220.16081 -209.48975 10.67106 2.85547 -210.67967 917.11623
7000.0000 -220.06392 -206.78330 13.28062 2.97722 -208.21654 1004.97962
MELTING PROCESS: loop number 29 T-loop= 1022.0000000000000
main_MD> interactions number 29 at Temperature= 1022.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 5.66586 -3.75732 2.19338
force_rgl> df(natom) -2.80038 0.84335 -4.88077
7005.0000 -219.65787 -208.01318 11.64469 3.00975 -207.55840 1031.14899
7010.0000 -219.05860 -207.67396 11.38464 3.00843 -207.58507 1053.72874
7015.0000 -219.60167 -208.01291 11.58876 3.03820 -206.98276 1064.98063
7020.0000 -217.16235 -205.23894 11.92341 3.04795 -206.78555 1031.30510
7025.0000 -219.84132 -206.32935 13.51197 3.03456 -207.05641 1033.34820
7030.0000 -220.12491 -207.81697 12.30793 3.04867 -206.77086 1041.98055
7035.0000 -220.20127 -208.36185 11.83942 2.99135 -207.93060 1008.64477
7040.0000 -221.30988 -207.56686 13.74303 3.01391 -207.47408 1038.26869
7045.0000 -219.77287 -208.23984 11.53303 2.96602 -208.44296 996.80819
7050.0000 -220.08771 -208.84900 11.23871 2.95217 -208.72317 986.51694
7055.0000 -222.71967 -211.07645 11.64322 2.87780 -210.22785 951.88791
7060.0000 -223.23261 -212.23210 11.00051 2.81959 -211.40558 914.45727
7065.0000 -221.85515 -210.77770 11.07745 2.82706 -211.25434 920.46247
7070.0000 -220.17996 -209.01873 11.16122 2.91345 -209.50663 967.55714
7075.0000 -220.07821 -210.01201 10.06619 2.94352 -208.89817 972.06683
7080.0000 -219.95508 -208.14228 11.81281 2.97175 -208.32716 979.87688
7085.0000 -219.79437 -207.19887 12.59550 3.03781 -206.99067 1024.95945
7090.0000 -219.67779 -207.75343 11.92436 3.02039 -207.34298 1052.23353
7095.0000 -219.47319 -208.98391 10.48928 2.99261 -207.90505 1012.02926
7100.0000 -219.33938 -205.43590 13.90347 3.03251 -207.09791 1039.46591
7105.0000 -217.48644 -206.73535 10.75109 3.05813 -206.57950 1060.25868
7110.0000 -217.50430 -206.57393 10.93037 3.04106 -206.92494 1024.32641
7115.0000 -219.67857 -207.22325 12.45532 3.03935 -206.95951 1055.20599
7120.0000 -218.63250 -206.03641 12.59609 3.06336 -206.47366 1066.82126
7125.0000 -217.22802 -203.81629 13.41173 3.13228 -205.07941 1103.22589
7130.0000 -218.93019 -206.35457 12.57562 3.19186 -203.87394 1155.01142
7135.0000 -221.12657 -208.27822 12.84835 3.03414 -207.06476 1028.60342
7140.0000 -219.71431 -207.79884 11.91546 2.98523 -208.05435 965.58335
7145.0000 -221.60789 -209.87629 11.73160 2.92695 -209.23347 992.24795
7150.0000 -217.41205 -205.44268 11.96937 2.97827 -208.19524 1017.69143
7155.0000 -217.20017 -205.12031 12.07986 3.14063 -204.91038 1102.12496
7160.0000 -217.60870 -204.92697 12.68173 3.19343 -203.84223 1103.73972
7165.0000 -221.07033 -207.89050 13.17983 3.08938 -205.94732 1072.53420
7170.0000 -220.31633 -207.08615 13.23018 3.02693 -207.21079 1033.50011
7175.0000 -221.29829 -208.41490 12.88339 3.03780 -206.99090 1061.65470
7180.0000 -220.76909 -209.23058 11.53850 2.96200 -208.52430 1019.76255
7185.0000 -220.80069 -206.72490 14.07580 3.01242 -207.50432 1045.32870
7190.0000 -218.06718 -205.30329 12.76390 3.13799 -204.96375 1103.15571
7195.0000 -220.14363 -207.21744 12.92619 2.99998 -207.75604 1033.81636
7200.0000 -218.82818 -205.61717 13.21101 3.02499 -207.24995 1033.98471
7205.0000 -219.79099 -207.05454 12.73645 3.02417 -207.26665 1035.22710
7210.0000 -219.28794 -207.37504 11.91291 3.03668 -207.01353 1024.22270
7215.0000 -217.61957 -205.13864 12.48093 3.09670 -205.79913 1078.93987
7220.0000 -218.95149 -206.40991 12.54158 3.08556 -206.02448 1072.04039
7225.0000 -220.11720 -209.14211 10.97509 2.97218 -208.31835 1005.01887
7230.0000 -220.95331 -209.29870 11.65461 2.95479 -208.67023 981.14631
7235.0000 -220.95000 -207.37619 13.57381 2.96097 -208.54518 1005.82651
7240.0000 -217.85172 -206.21886 11.63286 3.06976 -206.34418 1071.29775
7245.0000 -220.57526 -207.15386 13.42140 3.03749 -206.99710 1067.81138
7250.0000 -217.20092 -205.89682 11.30410 3.02149 -207.32081 1034.94315
MELTING PROCESS: loop number 30 T-loop= 1047.0000000000000
main_MD> interactions number 30 at Temperature= 1047.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 3.21219 -1.85110 3.43115
force_rgl> df(natom) 0.04002 3.81631 2.92577
7255.0000 -219.76877 -206.85776 12.91101 3.01526 -207.44676 1042.93524
7260.0000 -217.52856 -206.21988 11.30868 3.05650 -206.61244 1054.43836
7265.0000 -220.37781 -207.06357 13.31424 3.06912 -206.35724 1075.65819
7270.0000 -219.64165 -207.79839 11.84326 2.97961 -208.16807 985.80656
7275.0000 -219.60508 -207.57163 12.03345 2.99653 -207.82570 1006.19009
7280.0000 -219.62970 -207.96165 11.66804 2.96736 -208.41589 987.27494
7285.0000 -216.36766 -204.44345 11.92421 3.03389 -207.07002 1014.38942
7290.0000 -219.54446 -207.46476 12.07970 3.10633 -205.60435 1093.16539
7295.0000 -221.75220 -209.12322 12.62898 2.95691 -208.62737 988.24580
7300.0000 -221.41313 -209.80562 11.60751 2.92795 -209.21334 982.23826
7305.0000 -218.78797 -207.69528 11.09269 2.97165 -208.32914 1009.41073
7310.0000 -220.16044 -208.83092 11.32952 2.95285 -208.70952 1000.18201
7315.0000 -222.52936 -209.54470 12.98466 2.93149 -209.14167 985.02334
7320.0000 -219.35884 -206.94047 12.41836 3.00868 -207.57998 1035.73636
7325.0000 -219.20411 -205.93473 13.26938 3.10502 -205.63092 1074.19944
7330.0000 -218.65150 -203.36330 15.28820 3.15137 -204.69316 1103.07775
7335.0000 -219.39031 -206.89186 12.49844 3.13812 -204.96127 1099.10406
7340.0000 -219.22786 -207.51582 11.71204 3.04258 -206.89405 1034.81277
7345.0000 -219.45184 -206.45229 12.99955 3.03136 -207.12109 1034.53597
7350.0000 -220.81449 -209.06314 11.75135 2.97373 -208.28709 990.72740
7355.0000 -222.04183 -210.93706 11.10477 2.88887 -210.00394 931.54537
7360.0000 -219.90083 -208.52962 11.37121 2.93482 -209.07416 952.05767
7365.0000 -221.18891 -208.85772 12.33120 2.95784 -208.60859 980.92082
7370.0000 -219.82087 -207.78128 12.03959 2.98062 -208.14772 979.62516
7375.0000 -219.81352 -206.21240 13.60112 3.02763 -207.19657 1019.73634
7380.0000 -216.75157 -205.82801 10.92356 3.05982 -206.54540 1035.99896
7385.0000 -220.32776 -207.92071 12.40705 3.04876 -206.76912 1061.39489
7390.0000 -219.13303 -206.21568 12.91735 2.94698 -208.82816 995.95421
7395.0000 -218.83793 -208.01824 10.81969 2.98280 -208.10365 1041.85312
7400.0000 -220.67200 -209.50845 11.16354 2.95339 -208.69846 990.79688
7405.0000 -221.13855 -207.21390 13.92465 2.97200 -208.32203 978.15160
7410.0000 -218.17834 -206.20436 11.97398 3.07099 -206.31938 1048.31156
7415.0000 -215.49070 -204.78245 10.70825 3.11790 -205.37026 1113.45472
7420.0000 -218.23058 -206.04930 12.18129 3.11686 -205.39136 1080.22345
7425.0000 -219.00960 -207.77762 11.23198 3.04902 -206.76386 1036.30221
7430.0000 -217.89474 -204.30636 13.58838 3.09559 -205.82165 1081.00612
7435.0000 -219.89489 -206.48190 13.41299 3.08064 -206.12413 1064.44722
7440.0000 -220.57231 -208.16320 12.40911 3.02461 -207.25759 1011.84274
7445.0000 -218.14997 -205.47698 12.67299 3.04922 -206.75986 1034.60452
7450.0000 -218.74193 -206.50783 12.23410 3.07174 -206.30426 1026.82709
7455.0000 -219.51636 -207.89537 11.62098 2.96037 -208.55733 968.72052
7460.0000 -219.12843 -206.91229 12.21614 3.03224 -207.10330 1038.45967
7465.0000 -218.20593 -204.96018 13.24574 3.11855 -205.35704 1103.39296
7470.0000 -219.26038 -208.71419 10.54620 3.04747 -206.79514 1042.81799
7475.0000 -221.82831 -209.98162 11.84669 2.93146 -209.14229 954.87180
7480.0000 -222.04689 -210.59811 11.44877 2.87024 -210.38087 933.27530
7485.0000 -220.10587 -208.49330 11.61256 2.97339 -208.29399 1024.63767
7490.0000 -219.74101 -207.54842 12.19258 2.99407 -207.87552 1020.32660
7495.0000 -219.49530 -206.83911 12.65620 3.04685 -206.80765 1053.94218
7500.0000 -221.25759 -209.07810 12.17949 2.98283 -208.10301 1012.21984
MELTING PROCESS: loop number 31 T-loop= 1072.0000000000000
main_MD> interactions number 31 at Temperature= 1072.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.24003 0.23721 0.53713
force_rgl> df(natom) 0.39711 -0.21918 -2.35100
7505.0000 -217.78562 -206.12106 11.66456 3.02142 -207.32211 1026.21508
7510.0000 -218.00504 -206.58082 11.42422 3.03786 -206.98952 1029.20843
7515.0000 -218.14929 -205.00508 13.14421 3.07601 -206.21776 1042.86493
7520.0000 -218.04902 -204.15192 13.89709 3.15081 -204.70440 1099.08213
7525.0000 -219.34339 -205.88173 13.46166 3.08555 -206.02476 1076.43027
7530.0000 -216.13719 -201.37500 14.76220 3.13064 -205.11258 1122.04254
7535.0000 -217.37293 -204.22148 13.15145 3.26477 -202.39898 1181.77666
7540.0000 -218.54853 -205.22131 13.32721 3.10265 -205.67886 1086.86676
7545.0000 -219.14464 -206.13622 13.00842 3.00490 -207.65645 1005.31529
7550.0000 -221.13674 -209.68752 11.44921 2.99090 -207.93962 1029.58383
7555.0000 -219.33467 -207.89139 11.44327 2.93271 -209.11702 976.76116
7560.0000 -217.15295 -204.74397 12.40898 3.09564 -205.82064 1081.10381
7565.0000 -219.69669 -206.19703 13.49966 3.11458 -205.43741 1100.82045
7570.0000 -220.38013 -208.02638 12.35375 3.01737 -207.40418 1055.60700
7575.0000 -218.73311 -205.49108 13.24204 3.03056 -207.13739 1025.15973
7580.0000 -219.04208 -206.86287 12.17921 3.09618 -205.80975 1081.01640
7585.0000 -219.62545 -205.55724 14.06821 3.08247 -206.08702 1068.96334
7590.0000 -221.17943 -209.29838 11.88105 3.00670 -207.61994 1048.24781
7595.0000 -220.61485 -207.07088 13.54397 2.96526 -208.45837 993.62258
7600.0000 -215.47844 -202.25853 13.21991 3.15381 -204.64385 1130.34571
7605.0000 -218.02390 -205.27368 12.75022 3.17377 -204.23999 1151.21353
7610.0000 -218.47095 -205.39737 13.07358 3.15691 -204.58104 1141.33964
7615.0000 -219.03771 -205.38844 13.64927 3.07976 -206.14192 1064.57133
7620.0000 -218.30956 -206.92327 11.38629 3.05550 -206.63282 1067.10197
7625.0000 -217.98004 -205.94620 12.03383 3.11238 -205.48200 1095.98436
7630.0000 -217.17699 -205.71329 11.46370 3.08086 -206.11972 1106.67465
7635.0000 -220.53454 -208.43563 12.09891 3.04619 -206.82117 1033.41020
7640.0000 -221.82683 -210.86109 10.96573 2.90886 -209.59946 969.99092
7645.0000 -220.67180 -208.40800 12.26380 2.93072 -209.15717 984.40633
7650.0000 -219.23549 -206.09499 13.14050 3.03850 -206.97666 1029.41396
7655.0000 -218.41743 -205.77497 12.64246 3.08869 -205.96133 1061.96737
7660.0000 -220.46767 -207.18063 13.28704 3.02913 -207.16613 1005.06782
7665.0000 -219.15866 -208.66428 10.49438 3.02267 -207.29700 997.40795
7670.0000 -219.28431 -205.28876 13.99555 3.01717 -207.40809 984.85490
7675.0000 -217.21875 -205.71808 11.50067 3.13788 -204.96615 1082.73108
7680.0000 -217.40012 -202.97058 14.42954 3.16859 -204.34480 1100.90780
7685.0000 -219.07305 -203.88173 15.19132 3.17952 -204.12355 1143.86873
7690.0000 -214.53485 -202.36352 12.17133 3.24139 -202.87190 1153.34227
7695.0000 -215.05031 -202.50684 12.54346 3.29274 -201.83306 1165.43343
7700.0000 -217.55019 -204.08754 13.46265 3.26302 -202.43431 1160.34361
7705.0000 -220.28196 -207.16521 13.11675 3.11114 -205.50702 1076.59061
7710.0000 -219.44708 -207.84222 11.60487 2.97590 -208.24323 1034.64226
7715.0000 -221.56535 -208.46649 13.09886 2.99196 -207.91819 1019.78035
7720.0000 -218.07918 -205.44346 12.63572 3.02914 -207.16607 1011.97878
7725.0000 -218.89332 -205.62948 13.26384 3.06191 -206.50302 1057.93919
7730.0000 -217.73950 -205.81129 11.92820 3.01714 -207.40886 1018.73829
7735.0000 -219.04412 -206.31120 12.73292 3.13841 -204.95525 1097.68807
7740.0000 -220.24105 -207.65696 12.58410 3.03599 -207.02738 1055.32412
7745.0000 -219.68634 -208.13037 11.55597 2.97265 -208.30897 982.05090
7750.0000 -216.99434 -204.48175 12.51259 3.05818 -206.57846 1065.13206
MELTING PROCESS: loop number 32 T-loop= 1097.0000000000000
main_MD> interactions number 32 at Temperature= 1097.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.53391 -0.93065 -1.72555
force_rgl> df(natom) -0.44675 -2.68980 -0.69870
7755.0000 -219.07094 -206.56399 12.50694 3.07675 -206.20274 1084.24299
7760.0000 -218.74417 -207.00927 11.73490 3.02630 -207.22352 1063.07863
7765.0000 -216.38151 -203.14249 13.23902 3.17114 -204.29324 1123.30389
7770.0000 -213.46934 -200.37534 13.09400 3.26471 -202.40011 1175.82761
7775.0000 -215.97380 -202.49628 13.47752 3.20152 -203.67861 1140.99347
7780.0000 -216.60056 -202.25959 14.34097 3.20545 -203.59897 1139.68068
7785.0000 -217.42376 -203.30022 14.12353 3.25122 -202.67300 1162.35769
7790.0000 -217.36220 -203.78950 13.57271 3.23625 -202.97597 1162.10869
7795.0000 -217.60932 -204.55781 13.05151 3.20116 -203.68577 1141.52677
7800.0000 -215.36860 -203.16387 12.20473 3.18561 -204.00042 1126.37972
7805.0000 -217.33397 -203.07481 14.25916 3.28116 -202.06728 1211.66076
7810.0000 -219.42710 -206.05706 13.37005 3.13717 -204.98042 1095.33729
7815.0000 -216.92397 -205.35795 11.56603 3.08698 -205.99580 1058.26540
7820.0000 -218.72171 -206.35287 12.36884 3.15777 -204.56365 1121.74593
7825.0000 -215.67605 -204.51725 11.15880 3.14574 -204.80710 1095.47163
7830.0000 -215.53323 -201.95538 13.57785 3.23655 -202.96975 1138.93908
7835.0000 -216.51340 -203.35145 13.16194 3.22163 -203.27161 1112.23201
7840.0000 -219.23663 -205.79516 13.44147 3.14845 -204.75222 1102.25058
7845.0000 -218.28011 -206.71232 11.56779 3.07585 -206.22095 1071.13027
7850.0000 -219.51143 -206.54068 12.97075 3.04923 -206.75960 1025.58060
7855.0000 -219.90721 -206.15269 13.75453 3.10742 -205.58225 1092.83245
7860.0000 -217.70190 -206.19111 11.51079 3.06729 -206.39426 1056.97609
7865.0000 -218.40868 -205.55573 12.85295 3.09725 -205.78807 1050.53573
7870.0000 -221.35537 -208.34007 13.01530 3.05840 -206.57402 1046.54865
7875.0000 -218.95875 -205.19279 13.76597 3.02373 -207.27542 1034.23761
7880.0000 -217.83713 -205.41733 12.41980 3.10277 -205.67628 1105.55977
7885.0000 -219.38180 -206.23045 13.15135 3.08815 -205.97225 1041.43826
7890.0000 -219.06304 -208.59535 10.46769 3.05072 -206.72949 1021.63701
7895.0000 -219.29467 -206.85022 12.44445 3.05177 -206.70814 1050.67344
7900.0000 -217.56721 -206.53535 11.03186 3.09160 -205.90243 1083.32823
7905.0000 -218.24161 -205.02984 13.21177 3.14389 -204.84446 1114.98385
7910.0000 -217.16865 -203.68514 13.48351 3.11598 -205.40906 1080.47873
7915.0000 -217.73677 -203.84508 13.89169 3.22284 -203.24715 1155.42518
7920.0000 -214.85191 -202.16021 12.69170 3.26729 -202.34799 1172.41133
7925.0000 -218.11660 -203.41299 14.70361 3.20473 -203.61361 1117.09565
7930.0000 -215.25945 -204.03294 11.22651 3.22388 -203.22609 1156.39277
7935.0000 -215.00679 -202.89661 12.11018 3.23052 -203.09191 1149.75863
7940.0000 -218.63131 -206.87149 11.75982 3.14237 -204.87527 1098.09083
7945.0000 -218.15342 -204.92819 13.22523 3.10119 -205.70827 1074.33570
7950.0000 -220.87974 -207.05107 13.82867 3.12610 -205.20444 1106.87644
7955.0000 -218.28260 -206.60632 11.67628 3.06593 -206.42181 1076.40121
7960.0000 -218.73498 -204.44155 14.29343 3.08660 -206.00361 1082.29870
7965.0000 -219.89361 -207.90990 11.98371 3.16259 -204.46604 1083.34657
7970.0000 -217.32725 -203.77353 13.55372 3.08446 -206.04684 1064.23089
7975.0000 -218.86220 -206.26818 12.59402 3.10792 -205.57222 1085.43403
7980.0000 -217.47987 -204.48273 12.99715 3.12244 -205.27849 1094.62751
7985.0000 -218.36035 -206.20074 12.15961 3.11296 -205.47014 1048.27823
7990.0000 -218.31356 -206.28115 12.03242 3.07891 -206.15917 1080.10850
7995.0000 -214.90174 -202.31423 12.58751 3.15161 -204.68820 1118.02714
8000.0000 -216.61425 -203.22975 13.38451 3.22562 -203.19094 1141.79247
MELTING PROCESS: loop number 33 T-loop= 1122.0000000000000
main_MD> interactions number 33 at Temperature= 1122.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.36115 1.85349 -0.92483
force_rgl> df(natom) -1.41048 -2.45406 -0.98571
8005.0000 -216.91666 -203.05255 13.86411 3.26876 -202.31817 1194.70626
8010.0000 -219.23500 -206.53579 12.69921 3.15588 -204.60189 1099.65224
8015.0000 -219.43312 -208.09668 11.33644 2.99098 -207.93803 995.08928
8020.0000 -219.36659 -207.02871 12.33788 2.97889 -208.18274 1010.73646
8025.0000 -219.51614 -204.99788 14.51826 3.05167 -206.71011 1087.78535
8030.0000 -218.05089 -205.30958 12.74131 3.07560 -206.22598 1053.41538
8035.0000 -218.19699 -206.58382 11.61317 3.09334 -205.86721 1097.10989
8040.0000 -218.42141 -206.66386 11.75755 3.05397 -206.66367 1073.59903
8045.0000 -218.85395 -204.49447 14.35948 3.08094 -206.11802 1049.73639
8050.0000 -217.14736 -205.67282 11.47454 3.12907 -205.14437 1067.94562
8055.0000 -218.32016 -204.30485 14.01531 3.17052 -204.30564 1130.34155
8060.0000 -217.18703 -203.20578 13.98126 3.16794 -204.35792 1126.58523
8065.0000 -218.08030 -205.29403 12.78628 3.11496 -205.42983 1098.94901
8070.0000 -218.21067 -207.82716 10.38351 3.08115 -206.11374 1057.74865
8075.0000 -218.51730 -206.04781 12.46949 3.03933 -206.95982 1045.01355
8080.0000 -217.35357 -203.11185 14.24172 3.19114 -203.88857 1124.46190
8085.0000 -217.89397 -204.46793 13.42604 3.20798 -203.54783 1163.84686
8090.0000 -218.17414 -205.44164 12.73250 3.12431 -205.24061 1086.15130
8095.0000 -215.74460 -201.77947 13.96513 3.22649 -203.17339 1165.30934
8100.0000 -216.08815 -204.43200 11.65616 3.25475 -202.60162 1164.74520
8105.0000 -215.96246 -204.69859 11.26387 3.20035 -203.70222 1119.01610
8110.0000 -216.77466 -203.83146 12.94321 3.13678 -204.98822 1088.82229
8115.0000 -219.52409 -207.44013 12.08397 3.05775 -206.58714 1022.69190
8120.0000 -218.47357 -204.02891 14.44467 3.11590 -205.41066 1097.42601
8125.0000 -218.68294 -204.52263 14.16031 3.17398 -204.23569 1114.68799
8130.0000 -218.09025 -204.34793 13.74232 3.20423 -203.62364 1123.15220
8135.0000 -219.71011 -205.21822 14.49189 3.09641 -205.80507 1055.08262
8140.0000 -219.67385 -206.11416 13.55969 3.17199 -204.27599 1137.86863
8145.0000 -217.83550 -205.45848 12.37702 3.05124 -206.71895 1042.83964
8150.0000 -218.97431 -206.27290 12.70141 3.10214 -205.68910 1079.85052
8155.0000 -217.90300 -204.76292 13.14008 3.09716 -205.78987 1080.63366
8160.0000 -217.28350 -205.27002 12.01349 3.16990 -204.31821 1116.30205
8165.0000 -218.53105 -204.66761 13.86345 3.14638 -204.79402 1071.78964
8170.0000 -216.69927 -204.03197 12.66730 3.19035 -203.90459 1144.56088
8175.0000 -215.49137 -203.10768 12.38369 3.23629 -202.97497 1175.43154
8180.0000 -215.84713 -203.02598 12.82114 3.21760 -203.35312 1153.90098
8185.0000 -219.39269 -205.77256 13.62013 3.22912 -203.12021 1185.02818
8190.0000 -215.56683 -203.89973 11.66710 3.18419 -204.02909 1123.85309
8195.0000 -215.24087 -201.44786 13.79301 3.27608 -202.16997 1180.68453
8200.0000 -215.12894 -200.44364 14.68530 3.28414 -202.00693 1173.18814
8205.0000 -213.55147 -201.73129 11.82018 3.36755 -200.31949 1239.12430
8210.0000 -213.91833 -200.27993 13.63840 3.25270 -202.64315 1151.88777
8215.0000 -215.81946 -200.92637 14.89309 3.31779 -201.32623 1231.38163
8220.0000 -214.99321 -199.32429 15.66892 3.32447 -201.19097 1223.67102
8225.0000 -215.47264 -202.10406 13.36858 3.33934 -200.89019 1262.82751
8230.0000 -213.32334 -200.18944 13.13389 3.32988 -201.08166 1229.39763
8235.0000 -216.72939 -201.88265 14.84674 3.29817 -201.72311 1213.70171
8240.0000 -217.63540 -205.30163 12.33378 3.17202 -204.27525 1128.58778
8245.0000 -219.50217 -206.32454 13.17763 3.04259 -206.89395 1037.37224
8250.0000 -216.53563 -204.34835 12.18728 3.12296 -205.26791 1074.99994
MELTING PROCESS: loop number 34 T-loop= 1147.0000000000000
main_MD> interactions number 34 at Temperature= 1147.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -4.03725 -0.84220 2.75820
force_rgl> df(natom) 1.08925 -0.14826 0.52346
8255.0000 -218.87974 -205.87478 13.00495 3.15675 -204.58423 1116.68433
8260.0000 -216.35217 -203.67701 12.67516 3.18808 -203.95049 1116.83811
8265.0000 -217.90881 -203.61932 14.28949 3.21231 -203.46016 1146.58067
8270.0000 -217.84959 -204.36728 13.48232 3.15477 -204.62435 1099.22931
8275.0000 -217.40133 -204.32737 13.07396 3.23861 -202.92809 1172.99637
8280.0000 -218.78409 -204.20064 14.58345 3.09679 -205.79736 1094.29091
8285.0000 -217.00505 -203.88643 13.11862 3.22775 -203.14783 1178.61261
8290.0000 -216.86300 -202.99778 13.86522 3.17591 -204.19672 1148.99324
8295.0000 -220.04092 -206.24367 13.79725 3.14349 -204.85246 1114.75384
8300.0000 -219.25935 -205.30376 13.95559 3.12711 -205.18399 1090.44661
8305.0000 -217.15212 -203.15308 13.99905 3.18625 -203.98736 1141.11213
8310.0000 -217.52145 -205.94438 11.57707 3.12845 -205.15679 1115.56110
8315.0000 -218.53122 -205.27937 13.25185 3.14464 -204.82921 1111.81939
8320.0000 -219.49839 -206.72837 12.77001 3.09718 -205.78952 1089.50541
8325.0000 -219.06473 -208.21857 10.84616 2.99972 -207.76119 1038.34020
8330.0000 -215.25431 -202.47777 12.77654 3.14289 -204.86460 1130.20549
8335.0000 -218.10770 -204.70792 13.39978 3.17613 -204.19220 1133.42986
8340.0000 -217.57556 -201.67027 15.90530 3.28039 -202.08293 1217.20961
8345.0000 -215.17660 -203.02472 12.15188 3.21853 -203.33441 1142.64874
8350.0000 -215.96830 -202.96840 12.99990 3.21424 -203.42117 1134.24433
8355.0000 -215.22373 -202.66845 12.55528 3.21669 -203.37156 1149.14908
8360.0000 -217.10464 -202.04442 15.06022 3.26189 -202.45716 1178.88375
8365.0000 -217.80284 -203.96968 13.83316 3.24342 -202.83086 1150.71922
8370.0000 -218.31966 -202.67791 15.64175 3.20379 -203.63269 1109.05644
8375.0000 -217.34115 -202.83424 14.50691 3.26745 -202.34474 1199.59737
8380.0000 -216.80001 -202.56606 14.23395 3.25504 -202.59566 1175.54013
8385.0000 -217.39572 -202.34557 15.05015 3.25804 -202.53507 1191.15623
8390.0000 -215.52727 -201.24275 14.28451 3.28820 -201.92492 1215.32892
8395.0000 -217.09713 -203.64941 13.44771 3.28784 -201.93216 1186.88269
8400.0000 -217.67701 -204.69815 12.97886 3.14251 -204.87229 1095.79047
8405.0000 -217.99421 -207.12474 10.86947 3.12291 -205.26899 1076.57354
8410.0000 -219.26269 -206.94883 12.31385 3.08204 -206.09570 1055.34678
8415.0000 -217.87570 -205.95527 11.92043 3.09839 -205.76500 1096.11520
8420.0000 -218.18979 -206.31622 11.87357 3.11416 -205.44592 1093.02467
8425.0000 -216.13538 -201.59830 14.53708 3.18119 -204.08981 1113.24051
8430.0000 -215.54705 -202.31353 13.23352 3.24092 -202.88133 1145.38069
8435.0000 -218.00575 -203.65334 14.35241 3.23825 -202.93532 1149.60800
8440.0000 -216.29822 -202.30987 13.98836 3.23755 -202.94956 1204.66556
8445.0000 -216.48052 -203.04784 13.43268 3.24777 -202.74285 1167.78781
8450.0000 -216.58477 -202.07005 14.51472 3.24903 -202.71724 1175.37360
8455.0000 -217.23830 -205.11742 12.12088 3.20248 -203.65910 1112.58194
8460.0000 -215.96209 -201.36180 14.60028 3.27440 -202.20414 1181.95288
8465.0000 -217.64398 -202.63276 15.01123 3.25559 -202.58470 1168.91824
8470.0000 -217.28617 -204.85144 12.43473 3.22310 -203.24199 1149.40367
8475.0000 -217.45738 -205.30583 12.15156 3.06928 -206.35389 1079.24112
8480.0000 -217.12246 -203.04242 14.08004 3.18199 -204.07361 1128.50496
8485.0000 -216.43582 -203.43935 12.99647 3.20612 -203.58553 1131.53279
8490.0000 -217.53938 -202.08745 15.45193 3.28808 -201.92722 1200.51658
8495.0000 -216.73509 -202.10523 14.62986 3.31527 -201.37709 1230.90792
8500.0000 -214.37309 -200.63297 13.74012 3.32839 -201.11175 1215.71168
MELTING PROCESS: loop number 35 T-loop= 1172.0000000000000
main_MD> interactions number 35 at Temperature= 1172.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) -0.58268 1.10217 -1.77321
force_rgl> df(natom) 3.12285 0.37335 0.99549
8505.0000 -216.33207 -202.08248 14.24960 3.32196 -201.24188 1215.99308
8510.0000 -216.81993 -204.11312 12.70681 3.27691 -202.15321 1203.25276
8515.0000 -218.40812 -205.99408 12.41404 3.11700 -205.38845 1096.80124
8520.0000 -217.47481 -203.21885 14.25596 3.16042 -204.51004 1090.23360
8525.0000 -216.10872 -201.87394 14.23478 3.26966 -202.29988 1200.12713
8530.0000 -215.79983 -201.86468 13.93515 3.30714 -201.54160 1196.52101
8535.0000 -215.85983 -201.67015 14.18967 3.27055 -202.28197 1205.28281
8540.0000 -216.76106 -203.27954 13.48152 3.25700 -202.55606 1181.06732
8545.0000 -215.94760 -202.13114 13.81646 3.18975 -203.91665 1132.43456
8550.0000 -217.63747 -203.17579 14.46168 3.20164 -203.67607 1126.50117
8555.0000 -215.64846 -204.29468 11.35378 3.23442 -203.01282 1164.11645
8560.0000 -216.51340 -203.12049 13.39291 3.25100 -202.67747 1166.90345
8565.0000 -216.46660 -200.24759 16.21901 3.30533 -201.57828 1234.29916
8570.0000 -215.48075 -200.50921 14.97154 3.41468 -199.36598 1276.47110
8575.0000 -214.87517 -201.72662 13.14855 3.32172 -201.24671 1206.17174
8580.0000 -216.29279 -203.04979 13.24300 3.23703 -202.96020 1139.24450
8585.0000 -219.27250 -204.98504 14.28746 3.20393 -203.62971 1136.24919
8590.0000 -219.32287 -206.07781 13.24506 3.11904 -205.34728 1083.81029
8595.0000 -216.98847 -205.65876 11.32971 3.19167 -203.87784 1123.34250
8600.0000 -218.24989 -204.54242 13.70748 3.16452 -204.42701 1108.36148
8605.0000 -217.60240 -202.81207 14.79033 3.16663 -204.38450 1127.75899
8610.0000 -213.83932 -200.38406 13.45526 3.30854 -201.51344 1203.79102
8615.0000 -217.21353 -203.74152 13.47201 3.24950 -202.70772 1180.77143
8620.0000 -215.20458 -201.89686 13.30772 3.22098 -203.28486 1133.15092
8625.0000 -217.67330 -203.10041 14.57289 3.28737 -201.94161 1185.95747
8630.0000 -216.22371 -204.03312 12.19058 3.22024 -203.29987 1157.05502
8635.0000 -214.84680 -200.30039 14.54641 3.26671 -202.35955 1200.69822
8640.0000 -214.55926 -201.06878 13.49049 3.32102 -201.26076 1214.37457
8645.0000 -215.41260 -201.06265 14.34995 3.34149 -200.84664 1215.65168
8650.0000 -214.45878 -201.39647 13.06231 3.30123 -201.66115 1246.03352
8655.0000 -217.79346 -203.89006 13.90340 3.23408 -203.01969 1154.73885
8660.0000 -217.43432 -203.92224 13.51208 3.15558 -204.60805 1112.96518
8665.0000 -217.09213 -203.29624 13.79589 3.19501 -203.81025 1115.34688
8670.0000 -216.98028 -202.89087 14.08940 3.25878 -202.52001 1201.09080
8675.0000 -217.69801 -204.10409 13.59393 3.19405 -203.82973 1129.55098
8680.0000 -215.91190 -201.42282 14.48909 3.26931 -202.30704 1178.43545
8685.0000 -214.33542 -199.70727 14.62815 3.34312 -200.81365 1240.21992
8690.0000 -215.65341 -200.31164 15.34177 3.36716 -200.32740 1219.13166
8695.0000 -216.77308 -202.30856 14.46452 3.31993 -201.28290 1191.56148
8700.0000 -218.29929 -203.78291 14.51638 3.20964 -203.51420 1135.61923
8705.0000 -216.66234 -202.39563 14.26671 3.27942 -202.10247 1191.81624
8710.0000 -215.33466 -202.15058 13.18408 3.30917 -201.50051 1197.75787
8715.0000 -215.71831 -202.07184 13.64647 3.26786 -202.33636 1164.84485
8720.0000 -216.74467 -202.91883 13.82584 3.35005 -200.67359 1236.37779
8725.0000 -216.80386 -204.83118 11.97267 3.21674 -203.37051 1177.40576
8730.0000 -217.38777 -205.04187 12.34589 3.11440 -205.44114 1126.12211
8735.0000 -218.67494 -203.75721 14.91773 3.15346 -204.65086 1112.95784
8740.0000 -217.30732 -204.59260 12.71472 3.23954 -202.90942 1170.25364
8745.0000 -218.87950 -205.89712 12.98237 3.18348 -204.04348 1145.71387
8750.0000 -219.91971 -206.38618 13.53352 3.10496 -205.63203 1096.65836
MELTING PROCESS: loop number 36 T-loop= 1197.0000000000000
main_MD> interactions number 36 at Temperature= 1197.0000000000000
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
force_rgl> df(1) 0.75762 -0.35666 -0.14219
force_rgl> df(natom) 0.52165 -6.01688 2.88595
8755.0000 -216.15037 -204.30619 11.84419 3.16631 -204.39084 1099.39193
8760.0000 -215.25570 -199.91118 15.34452 3.24786 -202.74094 1190.86942
8765.0000 -215.01592 -198.85186 16.16406 3.38020 -200.06366 1227.73202
8770.0000 -213.97797 -198.67858 15.29939 3.46290 -198.39039 1309.95181
8775.0000 -215.70824 -202.11013 13.59811 3.39064 -199.85243 1240.06491
8780.0000 -218.31635 -201.76478 16.55157 3.25473 -202.60203 1178.18280
8785.0000 -215.26121 -202.87077 12.39043 3.20953 -203.51652 1160.67449
8790.0000 -215.58731 -198.33405 17.25327 3.33841 -200.90900 1211.17930
8795.0000 -216.58507 -202.31112 14.27394 3.33733 -200.93094 1236.06479
8800.0000 -213.37306 -199.88384 13.48922 3.34149 -200.84670 1199.04149
8805.0000 -213.36404 -199.09577 14.26828 3.34124 -200.85187 1215.11556
8810.0000 -215.35057 -200.37209 14.97848 3.42727 -199.11122 1289.79638
8815.0000 -215.97282 -202.29014 13.68269 3.27200 -202.25270 1178.61175
8820.0000 -217.93509 -204.13667 13.79843 3.24507 -202.79740 1163.97275
8825.0000 -215.66228 -201.41271 14.24957 3.22466 -203.21031 1176.11979
8830.0000 -216.51274 -201.25975 15.25299 3.35792 -200.51432 1238.32619
8835.0000 -216.80262 -201.58529 15.21733 3.28853 -201.91811 1220.03791
8840.0000 -215.05641 -200.79139 14.26502 3.28809 -201.92718 1214.48296
8845.0000 -214.53163 -199.39044 15.14119 3.35072 -200.66008 1225.79638
8850.0000 -216.56491 -202.54750 14.01741 3.33825 -200.91231 1201.37692
8855.0000 -217.10007 -202.54169 14.55838 3.22561 -203.19107 1142.52935
8860.0000 -215.05983 -204.01494 11.04490 3.21843 -203.33649 1138.67158
8865.0000 -218.13263 -204.47293 13.65971 3.20461 -203.61592 1150.91035
8870.0000 -215.33844 -201.27896 14.05948 3.27292 -202.23409 1192.87822
8875.0000 -216.84005 -202.44604 14.39402 3.25732 -202.54963 1170.60169
8880.0000 -217.73153 -203.26994 14.46160 3.24026 -202.89485 1173.18252
8885.0000 -215.14977 -201.31941 13.83035 3.23526 -202.99595 1144.82826
8890.0000 -216.78172 -201.87363 14.90809 3.31582 -201.36611 1208.37106
8895.0000 -216.96453 -202.03684 14.92768 3.28224 -202.04552 1178.78866
8900.0000 -215.66113 -200.79875 14.86238 3.36405 -200.39024 1249.96827
8905.0000 -216.92311 -202.04091 14.88219 3.34663 -200.74278 1237.66749
8910.0000 -217.41637 -204.10366 13.31272 3.29079 -201.87251 1191.55896
8915.0000 -213.96705 -202.21339 11.75366 3.21104 -203.48594 1094.11079
8920.0000 -215.29370 -202.83393 12.45977 3.30229 -201.63971 1197.44087
8925.0000 -215.15304 -200.66508 14.48796 3.32638 -201.15246 1200.82493
8930.0000 -218.54317 -202.33619 16.20698 3.34852 -200.70447 1252.23567
8935.0000 -216.17557 -201.56540 14.61017 3.33832 -200.91084 1204.63719
8940.0000 -215.11501 -201.72746 13.38756 3.32057 -201.27003 1202.77473
8945.0000 -216.57199 -201.31847 15.25352 3.34146 -200.84732 1247.69880
8950.0000 -218.26287 -203.16656 15.09631 3.30334 -201.61865 1216.30284
8955.0000 -217.56111 -202.58423 14.97688 3.27622 -202.16721 1193.71378
8960.0000 -218.17034 -205.10762 13.06272 3.22528 -203.19779 1153.02777
8965.0000 -217.23166 -202.45463 14.77703 3.17958 -204.12250 1140.25346
8970.0000 -215.36340 -201.73779 13.62561 3.23040 -203.09420 1153.79760
8975.0000 -215.14107 -199.34422 15.79685 3.35780 -200.51682 1234.53380
8980.0000 -217.45633 -202.99055 14.46578 3.28171 -202.05609 1194.07351
8985.0000 -215.99267 -200.05598 15.93670 3.32483 -201.18372 1229.77074
8990.0000 -214.41648 -201.98189 12.43459 3.30305 -201.62451 1209.28101
8995.0000 -219.02019 -203.23085 15.78933 3.19504 -203.80959 1135.28377
9000.0000 -217.09866 -202.20849 14.89017 3.22742 -203.15459 1152.64829
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 16 [min], 37.7343200 [s].
main_MD> Deallocating global variables
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