549 lines
53 KiB
Plaintext
549 lines
53 KiB
Plaintext
main_MD> Reading input file
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read_input> Process type: melting
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Read_input> Process caloric with a T-change of 100.00000000000000 [K] and a rate of 3.9999999999999997E+023 [K/ns]
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read_input> Input for metadynamics has been read
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read_input> Metadynamics has not been chosen.
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read_input> Reading initial positions fromtoMelt_39.xyz
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read_input> Finish reading initial positions
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read_input> Validating positions
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read_input> Initializing random number generator
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read_input> Checking program
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read_rgl> START READING FILE ../pot.pot
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read_rgl>> END READING FILE ../pot.pot
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READ_RGL>> atomic speciesAgAg imet1 4 imet2 4
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READ_RGL>> atomic radius 1.4450000999999999 1.4450000999999999
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read_rgl> PARAMETERS SELECTION
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FOR IMET1 :: Ag 4
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ECOH :: 2.9500000000000002 A :: 0.10308871000000000 QSI :: 1.1895434899999999
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p :: 10.850000000000000 q :: 3.1800000000000002
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ATOMIC RADIUS :: 1.4450000999999999
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choice_pot> values:
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frac = 0.12062503764379931 arete = 4.0870774781009569
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choice_pot> mass is== 108.00000000000000 for elem1=
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read_input> ntipo1 = 39 ntipo2 = 0
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read_input> Finish reading input
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main_MD> Allocating global variables
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main_MD> Number of outputs that will be created: 450
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main_MD> Size of nv and nvoiz: 39 3900
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main_MD> Size of nv and nvoiz: 39 3900
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main_MD> Number of time-steps (npas) = 50000
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main_MD> Number of CVs (num_cv) = 1
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main_MD> Max allowed number of atoms = 2900
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main_MD> Max number of atoms = 39
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main_MD> Consider changing parameter nsiz in module_parameters.f90 for performance
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main_MD> collvar_wanted = F
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main_MD> INPUT AND POTENTIAL FILE READING IS DONE
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main_MD> THERMALIZATION IS STARTING
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init> 0.12182454231429392 0.10733895077528115 -8.1234278808671664E-002 initial drift of cluster / NP1 for coalescence
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init> 0.32424323740243483 0.34004167830873411 0.31147975539584788 scaling for velocity /for coalescence NP1
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init.f90 > facguy = 1.7836808691988246E-003
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preparo> IN BIGVOI : LIMIT 1.2247448652052084 1.2247448652052084 1.2247448652052084
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preparo> END t=0 TIME STEP
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) 1.75603 -0.34009 0.14382
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force_rgl> df(natom) -1.07658 2.32245 -0.10797
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preparo> THERMALIZATION PROCESS AT 276.22104293178319
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preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
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5000 -96.728448757606870 1.0356686761928633 -97.764117433799740 3.4986134880963588E-004
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preparo> END THERMALISATION ON NPAST DEFINE IN PARACLUSTER MODULE
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main_MD> Time-loop is starting for melting
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main_MD> Now the computation of EXECUTION TIME starts
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main_MD> Running from loop 1 to 9
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MELTING PROCESS: loop number 1 T-loop= 376.00000000000000
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main_MD> interactions number 1 at Temperature= 376.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -0.50353 0.10050 -0.60103
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force_rgl> df(natom) -0.72590 -1.60089 -0.36174
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5.0000 -97.33800 -95.78060 1.55740 1.64104 -96.17758 249.99855
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10.0000 -96.48524 -94.97513 1.51011 1.70431 -95.44991 317.33623
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15.0000 -96.59533 -94.57572 2.01960 1.77778 -94.60498 383.25301
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20.0000 -96.89557 -94.90927 1.98630 1.76303 -94.77464 371.12962
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25.0000 -96.74782 -95.14567 1.60215 1.73167 -95.13523 338.90787
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30.0000 -97.05429 -95.17855 1.87574 1.75747 -94.83859 366.54775
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35.0000 -96.33142 -94.66728 1.66414 1.73935 -95.04696 351.44539
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40.0000 -96.45200 -94.58314 1.86886 1.80503 -94.29155 416.98678
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45.0000 -96.52446 -94.41747 2.10699 1.77490 -94.63808 391.65852
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50.0000 -96.16524 -94.42732 1.73792 1.79009 -94.46335 402.13675
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55.0000 -96.21535 -94.59236 1.62298 1.76713 -94.72747 380.75553
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60.0000 -96.67995 -94.74925 1.93071 1.76396 -94.76385 374.67289
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65.0000 -96.57176 -94.42071 2.15105 1.78091 -94.56896 391.90570
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70.0000 -96.76811 -94.66172 2.10639 1.78258 -94.54976 393.92152
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75.0000 -96.70719 -94.92392 1.78327 1.75844 -94.82736 370.40970
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80.0000 -96.50515 -94.30644 2.19872 1.78437 -94.52922 396.15111
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85.0000 -95.93891 -93.91505 2.02387 1.82074 -94.11090 431.61124
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90.0000 -96.17165 -93.87381 2.29784 1.83656 -93.92899 447.24348
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95.0000 -96.15761 -94.29392 1.86369 1.83900 -93.90095 450.76658
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100.0000 -96.06794 -94.27667 1.79127 1.78377 -94.53613 376.65260
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105.0000 -96.24718 -94.01803 2.22915 1.81445 -94.18330 422.09610
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110.0000 -96.50353 -94.70339 1.80014 1.77736 -94.60985 385.63624
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115.0000 -96.50080 -94.91609 1.58471 1.75979 -94.81189 356.26688
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120.0000 -96.74271 -94.87831 1.86441 1.74550 -94.97619 357.12222
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125.0000 -97.08158 -95.38650 1.69508 1.75202 -94.90123 364.55649
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130.0000 -96.75444 -94.97213 1.78231 1.71932 -95.27723 334.08182
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135.0000 -96.87505 -95.29746 1.57759 1.73278 -95.12253 338.57764
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140.0000 -96.64205 -95.06823 1.57382 1.74199 -95.01653 355.91262
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145.0000 -96.42097 -94.21864 2.20233 1.76449 -94.75778 381.63168
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150.0000 -96.71487 -94.70209 2.01279 1.80633 -94.27666 426.59920
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155.0000 -96.50381 -94.55278 1.95103 1.77753 -94.60787 379.61871
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160.0000 -96.60312 -94.86795 1.73518 1.78465 -94.52594 370.93663
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165.0000 -96.40510 -95.00652 1.39858 1.74560 -94.97508 324.15253
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170.0000 -96.22502 -94.34868 1.87635 1.76560 -94.74504 338.80218
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175.0000 -95.98289 -94.07256 1.91033 1.81264 -94.20404 397.93570
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180.0000 -96.00588 -94.40495 1.60093 1.83246 -93.97614 427.71367
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185.0000 -96.83039 -95.06496 1.76543 1.75909 -94.81991 365.32578
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190.0000 -96.60138 -94.21066 2.39072 1.76405 -94.76283 375.29228
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195.0000 -96.67049 -94.74961 1.92087 1.77127 -94.67982 376.82713
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200.0000 -96.36427 -94.56242 1.80185 1.76368 -94.76715 373.23542
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205.0000 -97.01817 -95.64362 1.37455 1.73347 -95.11459 340.37673
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210.0000 -97.06013 -95.27002 1.79011 1.70373 -95.45658 307.31141
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215.0000 -96.54456 -94.21202 2.33254 1.75155 -94.90665 364.09691
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220.0000 -96.71228 -94.65012 2.06217 1.78863 -94.48024 404.35942
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225.0000 -96.59899 -94.89867 1.70032 1.79062 -94.45730 402.86952
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230.0000 -96.58262 -94.52386 2.05876 1.76525 -94.74902 374.34888
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235.0000 -96.31514 -94.54983 1.76531 1.77525 -94.63405 379.89253
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240.0000 -96.24750 -94.20587 2.04163 1.81380 -94.19076 415.20583
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245.0000 -96.62489 -94.70672 1.91817 1.77903 -94.59063 379.19662
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250.0000 -96.55912 -94.25822 2.30090 1.79331 -94.42632 402.26205
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MELTING PROCESS: loop number 2 T-loop= 476.00000000000000
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main_MD> interactions number 2 at Temperature= 476.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -4.62058 0.40067 -0.50751
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force_rgl> df(natom) 3.40194 -0.00632 -2.41498
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255.0000 -96.53612 -94.29797 2.23815 1.79756 -94.37747 411.53798
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260.0000 -96.57588 -93.91105 2.66483 1.82367 -94.07725 434.06599
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265.0000 -95.86167 -93.31251 2.54917 1.85439 -93.72396 440.77905
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270.0000 -95.06947 -91.67749 3.39198 1.92182 -92.94846 533.68092
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275.0000 -94.65829 -92.48816 2.17014 1.98553 -92.21581 568.59774
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280.0000 -95.90775 -93.31223 2.59552 1.92044 -92.96437 474.46631
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285.0000 -95.25423 -92.38748 2.86675 1.91059 -93.07764 478.13277
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290.0000 -95.85351 -93.45917 2.39434 1.87955 -93.43453 455.94544
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295.0000 -95.14641 -92.40909 2.73732 1.91806 -92.99167 487.18031
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300.0000 -95.15806 -92.67851 2.47955 1.94560 -92.67496 519.23123
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305.0000 -95.56890 -93.07640 2.49250 1.92218 -92.94437 489.45549
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310.0000 -94.94699 -92.02517 2.92181 1.97583 -92.32729 550.48678
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315.0000 -95.51879 -92.94048 2.57831 1.94136 -92.72372 515.26176
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320.0000 -95.46085 -92.71180 2.74905 1.93015 -92.85266 493.61768
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325.0000 -95.86083 -92.96428 2.89655 1.94759 -92.65205 531.71283
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330.0000 -95.12291 -93.12700 1.99591 1.93658 -92.77873 528.03609
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335.0000 -95.13515 -92.47680 2.65835 1.94151 -92.72205 495.73054
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340.0000 -95.32854 -92.83082 2.49772 1.94058 -92.73277 515.33031
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345.0000 -95.04147 -92.46738 2.57409 1.94769 -92.65096 524.15631
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350.0000 -95.69581 -93.19415 2.50166 1.95123 -92.61028 524.02037
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355.0000 -95.98902 -93.39518 2.59383 1.90387 -93.15484 481.63458
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360.0000 -95.59955 -93.40120 2.19836 1.89756 -93.22743 459.42121
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365.0000 -96.12092 -93.31790 2.80302 1.87841 -93.44766 445.45595
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370.0000 -95.83025 -93.16113 2.66912 1.91328 -93.04671 479.52969
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375.0000 -95.27662 -92.46967 2.80695 1.91060 -93.07751 483.10035
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380.0000 -95.72687 -93.46236 2.26451 1.93587 -92.78693 511.64264
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385.0000 -95.49706 -93.07761 2.41944 1.88588 -93.36173 474.30863
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390.0000 -95.22327 -93.04601 2.17726 1.90541 -93.13718 484.08336
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395.0000 -95.87818 -93.51276 2.36543 1.87858 -93.44579 423.03150
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400.0000 -95.80161 -93.71871 2.08289 1.87249 -93.51572 463.67083
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405.0000 -96.18261 -93.66345 2.51916 1.87397 -93.49876 463.68479
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410.0000 -95.92918 -93.95182 1.97736 1.83990 -93.89055 418.69985
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415.0000 -95.43772 -93.10772 2.33000 1.88457 -93.37682 478.94468
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420.0000 -95.25172 -92.44738 2.80434 1.93706 -92.77320 517.79426
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425.0000 -95.18645 -92.32565 2.86079 1.95560 -92.56002 519.53123
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430.0000 -95.30881 -92.63648 2.67233 1.97453 -92.34234 538.60741
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435.0000 -95.80759 -93.51021 2.29737 1.92886 -92.86755 479.43873
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440.0000 -94.89965 -92.55596 2.34369 1.90978 -93.08693 464.99729
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445.0000 -96.03472 -93.43704 2.59768 1.93785 -92.76414 495.26333
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450.0000 -95.41147 -93.18917 2.22229 1.89104 -93.30250 463.33066
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455.0000 -95.94716 -93.81299 2.13416 1.88222 -93.40393 441.68047
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460.0000 -95.15001 -93.42517 1.72485 1.90575 -93.13325 476.96939
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465.0000 -95.36917 -93.07222 2.29694 1.89489 -93.25818 459.52064
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470.0000 -94.99845 -92.66787 2.33058 1.94802 -92.64715 497.33482
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475.0000 -95.67544 -93.44150 2.23394 1.89116 -93.30111 469.78098
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480.0000 -95.80356 -93.23724 2.56632 1.87219 -93.51927 444.91202
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485.0000 -95.70297 -93.64687 2.05610 1.88105 -93.41729 469.15737
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490.0000 -96.43427 -94.40886 2.02541 1.82618 -94.04836 424.68934
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495.0000 -96.65176 -94.44585 2.20591 1.78598 -94.51070 394.35969
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500.0000 -95.87933 -94.01207 1.86726 1.83341 -93.96516 433.90173
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MELTING PROCESS: loop number 3 T-loop= 576.00000000000000
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main_MD> interactions number 3 at Temperature= 576.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -1.42256 0.24524 2.68978
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force_rgl> df(natom) -1.03871 -0.30484 -0.42096
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505.0000 -95.55653 -93.46962 2.08690 1.84573 -93.82354 439.06425
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510.0000 -95.31750 -92.20132 3.11618 1.89432 -93.26476 459.17620
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515.0000 -94.90063 -92.10880 2.79183 1.98640 -92.20578 543.51761
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520.0000 -93.99109 -91.20440 2.78669 2.00387 -92.00484 578.36077
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525.0000 -93.32322 -90.20256 3.12066 2.09461 -90.96136 636.61918
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530.0000 -94.12254 -91.15865 2.96389 2.11508 -90.72596 614.91594
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535.0000 -95.49098 -92.45294 3.03804 2.00886 -91.94742 552.56189
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540.0000 -94.33227 -91.41607 2.91619 1.99755 -92.07758 561.41157
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545.0000 -95.04944 -92.25943 2.79001 1.99688 -92.08529 561.87241
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550.0000 -94.62637 -92.06088 2.56550 2.01698 -91.85415 565.40959
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555.0000 -95.06392 -91.41308 3.65084 2.03225 -91.67849 582.74749
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560.0000 -95.21327 -92.29556 2.91771 1.99863 -92.06512 538.58936
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565.0000 -95.40486 -92.59434 2.81052 1.96254 -92.48020 525.17024
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570.0000 -95.22271 -92.06130 3.16142 1.98246 -92.25108 556.81469
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575.0000 -95.62993 -93.69906 1.93087 1.96936 -92.40179 547.05797
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580.0000 -94.93757 -92.59074 2.34682 1.92476 -92.91467 511.90337
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585.0000 -94.99316 -92.52569 2.46747 1.97983 -92.28129 559.41783
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590.0000 -94.62356 -91.50706 3.11649 2.00986 -91.93593 579.85049
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595.0000 -94.31874 -91.05970 3.25904 2.06580 -91.29266 631.97725
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600.0000 -94.67638 -91.57415 3.10223 2.05903 -91.37053 625.04622
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605.0000 -94.80127 -92.59449 2.20678 1.98355 -92.23858 543.67137
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610.0000 -94.92155 -91.76863 3.15292 2.02819 -91.72517 573.21111
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615.0000 -95.05831 -92.30717 2.75114 1.98225 -92.25347 540.46219
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620.0000 -94.48415 -91.06722 3.41694 2.03784 -91.61420 596.79422
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625.0000 -94.26327 -90.68837 3.57490 2.09430 -90.96488 635.17547
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630.0000 -94.28318 -91.36672 2.91645 2.07182 -91.22346 592.00468
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635.0000 -95.08849 -91.02842 4.06007 2.06239 -91.33189 644.24919
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640.0000 -94.57296 -91.43033 3.14263 2.09617 -90.94340 655.67402
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645.0000 -94.31106 -91.31339 2.99767 2.03737 -91.61960 569.75574
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650.0000 -94.62414 -91.07462 3.54952 2.05162 -91.45571 583.66313
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655.0000 -95.16620 -92.00688 3.15932 2.05255 -91.44508 596.50623
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660.0000 -93.77025 -91.60423 2.16602 1.99136 -92.14877 516.92741
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665.0000 -94.73746 -91.73204 3.00542 2.03016 -91.70250 580.89827
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670.0000 -94.32300 -91.69770 2.62530 2.02514 -91.76030 583.30293
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675.0000 -94.41737 -91.05753 3.35984 2.06730 -91.27537 614.73730
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680.0000 -93.65615 -90.67295 2.98320 2.11835 -90.68830 624.24574
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685.0000 -95.29675 -92.15214 3.14461 2.06107 -91.34705 617.85175
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690.0000 -95.33974 -92.58041 2.75933 1.97752 -92.30785 565.87878
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695.0000 -94.40088 -90.93132 3.46955 2.01326 -91.89687 600.89818
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700.0000 -94.41908 -91.38884 3.03023 2.05957 -91.36433 626.90606
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705.0000 -93.81947 -90.97245 2.84702 2.07181 -91.22350 614.71934
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710.0000 -94.33281 -90.86106 3.47175 2.06806 -91.26669 610.76081
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715.0000 -94.34223 -91.01834 3.32389 2.07550 -91.18105 621.75368
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720.0000 -94.67734 -91.03931 3.63803 2.04569 -91.52395 593.49718
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725.0000 -94.95087 -91.48376 3.46712 2.07349 -91.20419 627.92107
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730.0000 -94.67004 -92.11809 2.55195 2.01700 -91.85384 612.03046
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735.0000 -94.54945 -92.13934 2.41011 2.02528 -91.75864 603.00546
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740.0000 -94.83397 -91.82360 3.01037 2.01110 -91.92171 546.74122
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745.0000 -93.82124 -91.14188 2.67937 2.04948 -91.48035 582.79267
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750.0000 -94.84614 -91.69791 3.14822 2.05598 -91.40563 592.70009
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MELTING PROCESS: loop number 4 T-loop= 676.00000000000000
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main_MD> interactions number 4 at Temperature= 676.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -1.02477 -0.07604 2.88352
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force_rgl> df(natom) -0.85441 -1.27259 -1.54215
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755.0000 -93.96237 -90.16626 3.79611 2.10625 -90.82746 655.43011
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760.0000 -93.01640 -88.94011 4.07628 2.23570 -89.33878 744.53088
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765.0000 -92.51008 -88.59024 3.91984 2.27023 -88.94167 764.84415
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770.0000 -93.81808 -89.76059 4.05750 2.30978 -88.48678 781.09635
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775.0000 -92.99091 -89.85300 3.13791 2.18066 -89.97177 708.11431
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780.0000 -93.52821 -90.36190 3.16631 2.17744 -90.00877 660.58321
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785.0000 -93.89230 -89.48699 4.40531 2.16849 -90.11163 677.61210
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790.0000 -93.16245 -89.75117 3.41127 2.20077 -89.74048 732.38657
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795.0000 -93.73143 -89.70844 4.02299 2.20064 -89.74190 731.55458
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800.0000 -93.88478 -90.08703 3.79776 2.18444 -89.92823 706.10408
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805.0000 -93.72233 -90.73240 2.98992 2.14960 -90.32896 680.49855
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810.0000 -93.97324 -90.10945 3.86379 2.15638 -90.25096 650.44948
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815.0000 -92.84962 -90.16979 2.67983 2.17463 -90.04104 660.26497
|
|
820.0000 -93.38118 -88.93872 4.44246 2.24851 -89.19139 765.96741
|
|
825.0000 -93.61768 -90.28265 3.33502 2.19270 -89.83329 753.45332
|
|
830.0000 -94.04809 -89.50833 4.53976 2.21544 -89.57173 736.59208
|
|
835.0000 -92.56145 -89.06337 3.49807 2.22913 -89.41434 767.13524
|
|
840.0000 -93.75825 -90.37659 3.38166 2.18226 -89.95330 699.96441
|
|
845.0000 -93.97642 -90.32598 3.65043 2.15747 -90.23845 684.38030
|
|
850.0000 -93.91079 -89.97163 3.93916 2.14569 -90.37394 699.42068
|
|
855.0000 -94.10291 -90.49163 3.61128 2.15274 -90.29286 704.49317
|
|
860.0000 -93.82015 -89.39073 4.42942 2.16066 -90.20173 693.74074
|
|
865.0000 -93.71575 -89.97013 3.74563 2.15207 -90.30054 666.12246
|
|
870.0000 -94.19530 -89.98532 4.20999 2.12827 -90.57426 636.04765
|
|
875.0000 -94.46413 -90.66873 3.79539 2.14699 -90.35894 674.74515
|
|
880.0000 -93.74460 -89.81522 3.92938 2.17167 -90.07514 715.71481
|
|
885.0000 -93.88720 -90.29948 3.58772 2.18946 -89.87052 698.67026
|
|
890.0000 -93.32181 -90.37929 2.94251 2.19799 -89.77240 718.45052
|
|
895.0000 -93.43184 -89.84311 3.58873 2.18082 -89.96990 738.19097
|
|
900.0000 -93.77109 -89.87333 3.89776 2.18328 -89.94159 720.25124
|
|
905.0000 -94.10959 -90.28291 3.82667 2.14181 -90.41847 703.80568
|
|
910.0000 -93.11359 -89.70554 3.40805 2.15280 -90.29208 702.47131
|
|
915.0000 -93.85822 -90.87619 2.98203 2.16424 -90.16059 672.74006
|
|
920.0000 -94.32139 -90.60073 3.72066 2.12082 -90.65991 661.18478
|
|
925.0000 -93.94602 -90.97986 2.96616 2.12381 -90.62549 615.82567
|
|
930.0000 -94.11827 -90.25942 3.85886 2.16158 -90.19120 686.29840
|
|
935.0000 -93.28597 -89.92958 3.35639 2.19945 -89.75565 704.20267
|
|
940.0000 -93.27469 -90.27975 2.99493 2.15590 -90.25646 703.12891
|
|
945.0000 -94.17624 -90.48253 3.69372 2.16041 -90.20457 705.27928
|
|
950.0000 -92.96010 -90.36526 2.59484 2.14167 -90.42007 644.15116
|
|
955.0000 -93.74068 -90.32795 3.41273 2.20862 -89.65020 697.59944
|
|
960.0000 -92.58028 -88.72001 3.86027 2.25164 -89.15543 771.72852
|
|
965.0000 -92.40328 -89.30960 3.09368 2.27598 -88.87549 767.99549
|
|
970.0000 -92.67064 -89.00020 3.67044 2.19956 -89.75437 711.80515
|
|
975.0000 -92.43663 -89.76949 2.66714 2.23593 -89.33608 748.13792
|
|
980.0000 -94.99453 -91.50794 3.48659 2.13016 -90.55253 657.49936
|
|
985.0000 -94.21012 -91.62719 2.58293 2.06799 -91.26746 586.32122
|
|
990.0000 -93.76558 -90.84354 2.92204 2.07162 -91.22567 605.00974
|
|
995.0000 -94.61312 -91.36692 3.24620 2.05401 -91.42821 604.07351
|
|
1000.0000 -94.99226 -91.47219 3.52007 2.07986 -91.13099 647.31037
|
|
MELTING PROCESS: loop number 5 T-loop= 776.00000000000000
|
|
main_MD> interactions number 5 at Temperature= 776.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) -3.71461 1.23318 -0.71111
|
|
force_rgl> df(natom) 0.03265 2.69457 0.32389
|
|
1005.0000 -94.76071 -91.23650 3.52420 2.13002 -90.55413 702.64724
|
|
1010.0000 -94.02536 -91.47356 2.55180 2.05610 -91.40426 601.23652
|
|
1015.0000 -94.29916 -91.62371 2.67545 2.12797 -90.57766 670.51972
|
|
1020.0000 -94.02541 -90.66491 3.36050 2.06402 -91.31309 621.42461
|
|
1025.0000 -92.82959 -88.88347 3.94612 2.19608 -89.79438 703.53085
|
|
1030.0000 -93.73785 -90.33234 3.40551 2.22571 -89.45368 742.58589
|
|
1035.0000 -93.69924 -90.78549 2.91376 2.15731 -90.24026 684.44969
|
|
1040.0000 -94.60273 -90.50222 4.10050 2.13161 -90.53584 681.39121
|
|
1045.0000 -93.67292 -89.20690 4.46602 2.21372 -89.59150 731.85766
|
|
1050.0000 -93.29467 -89.03825 4.25643 2.22799 -89.42737 742.27176
|
|
1055.0000 -93.82554 -89.77384 4.05170 2.20748 -89.66326 737.06957
|
|
1060.0000 -91.99191 -88.25133 3.74057 2.30749 -88.51309 805.04199
|
|
1065.0000 -92.88153 -88.89232 3.98921 2.29418 -88.66619 778.12013
|
|
1070.0000 -92.57543 -88.50701 4.06842 2.26301 -89.02469 743.02470
|
|
1075.0000 -92.49420 -88.91934 3.57486 2.32353 -88.32866 782.98495
|
|
1080.0000 -92.66574 -88.25468 4.41106 2.23766 -89.31626 777.75884
|
|
1085.0000 -93.75569 -89.73142 4.02427 2.26661 -88.98328 782.77186
|
|
1090.0000 -92.34993 -89.34941 3.00051 2.22422 -89.47079 763.40656
|
|
1095.0000 -93.00503 -89.64668 3.35835 2.21028 -89.63111 745.32840
|
|
1100.0000 -92.21210 -89.57757 2.63453 2.27003 -88.94394 759.52386
|
|
1105.0000 -93.53336 -90.50940 3.02396 2.18817 -89.88536 707.93217
|
|
1110.0000 -92.68930 -89.95041 2.73890 2.17639 -90.02084 710.21111
|
|
1115.0000 -92.54810 -88.96514 3.58296 2.21450 -89.58252 707.14722
|
|
1120.0000 -93.31662 -89.32920 3.98742 2.23768 -89.31593 761.19313
|
|
1125.0000 -93.58104 -89.50079 4.08025 2.20498 -89.69209 724.37026
|
|
1130.0000 -93.53634 -89.52712 4.00922 2.18521 -89.91940 727.07825
|
|
1135.0000 -94.02692 -89.95431 4.07262 2.21146 -89.61756 764.48934
|
|
1140.0000 -93.30153 -89.72650 3.57503 2.21674 -89.55682 716.64843
|
|
1145.0000 -92.48292 -88.88617 3.59674 2.25825 -89.07939 787.97493
|
|
1150.0000 -93.00425 -88.51324 4.49100 2.32857 -88.27077 826.22921
|
|
1155.0000 -93.80344 -90.21502 3.58842 2.26349 -89.01911 815.48079
|
|
1160.0000 -92.86700 -89.23293 3.63407 2.19799 -89.77245 732.20518
|
|
1165.0000 -91.74139 -87.69760 4.04379 2.30995 -88.48485 810.35502
|
|
1170.0000 -92.90119 -87.55200 5.34920 2.38841 -87.58253 869.33096
|
|
1175.0000 -92.57185 -88.71250 3.85935 2.32915 -88.26410 836.94571
|
|
1180.0000 -92.49855 -88.68116 3.81739 2.30252 -88.57033 785.71268
|
|
1185.0000 -92.45186 -88.36755 4.08431 2.31000 -88.48428 795.35646
|
|
1190.0000 -93.81393 -90.19129 3.62264 2.22693 -89.43964 787.38973
|
|
1195.0000 -93.33598 -88.81469 4.52130 2.23842 -89.30752 809.95947
|
|
1200.0000 -93.14181 -88.53831 4.60350 2.29799 -88.62235 828.24998
|
|
1205.0000 -91.11361 -86.66285 4.45076 2.35387 -87.97973 838.58646
|
|
1210.0000 -91.89866 -86.66055 5.23811 2.52876 -85.96850 947.19871
|
|
1215.0000 -91.92042 -87.73117 4.18925 2.36883 -87.80776 797.57431
|
|
1220.0000 -93.10353 -89.27619 3.82734 2.26857 -88.96074 765.01333
|
|
1225.0000 -93.40603 -90.22324 3.18279 2.18691 -89.89983 702.25772
|
|
1230.0000 -92.51237 -88.28723 4.22514 2.25245 -89.14616 741.65377
|
|
1235.0000 -93.33909 -89.81447 3.52462 2.22528 -89.45857 762.59363
|
|
1240.0000 -93.62733 -89.33197 4.29535 2.19919 -89.75864 717.27491
|
|
1245.0000 -93.58236 -89.79463 3.78773 2.21868 -89.53446 728.67360
|
|
1250.0000 -93.47627 -90.47228 3.00399 2.18965 -89.86828 712.03673
|
|
MELTING PROCESS: loop number 6 T-loop= 876.00000000000000
|
|
main_MD> interactions number 6 at Temperature= 876.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) -1.30788 -2.72021 -3.75612
|
|
force_rgl> df(natom) 2.44581 -0.21895 -0.14825
|
|
1255.0000 -92.97032 -88.74255 4.22776 2.24971 -89.17762 750.02067
|
|
1260.0000 -92.67547 -87.98997 4.68550 2.31155 -88.46646 807.11560
|
|
1265.0000 -91.29515 -85.91209 5.38306 2.43939 -86.99628 929.43161
|
|
1270.0000 -90.27988 -86.02822 4.25166 2.53211 -85.92997 1007.23397
|
|
1275.0000 -92.67954 -87.87926 4.80029 2.42518 -87.15965 896.22105
|
|
1280.0000 -91.87131 -87.85459 4.01672 2.35071 -88.01615 843.32327
|
|
1285.0000 -93.04744 -88.56132 4.48612 2.31372 -88.44153 778.52882
|
|
1290.0000 -92.01858 -87.60471 4.41386 2.44021 -86.98685 940.08381
|
|
1295.0000 -92.67911 -89.03077 3.64834 2.33584 -88.18713 849.46932
|
|
1300.0000 -91.88388 -86.88047 5.00341 2.38113 -87.66628 858.78967
|
|
1305.0000 -90.58454 -86.78054 3.80401 2.40455 -87.39690 844.40468
|
|
1310.0000 -90.84518 -85.64395 5.20122 2.46969 -86.64781 914.70346
|
|
1315.0000 -91.35928 -86.60000 4.75928 2.52331 -86.03115 977.18381
|
|
1320.0000 -92.06991 -88.26754 3.80237 2.42520 -87.15947 893.00053
|
|
1325.0000 -91.98249 -87.93071 4.05178 2.37309 -87.75875 853.11665
|
|
1330.0000 -91.27955 -87.65889 3.62065 2.42008 -87.21831 884.32934
|
|
1335.0000 -91.94555 -87.34111 4.60444 2.42015 -87.21751 929.45782
|
|
1340.0000 -92.98211 -88.23063 4.75148 2.39996 -87.44973 853.21797
|
|
1345.0000 -91.44035 -87.80065 3.63969 2.35114 -88.01117 850.23767
|
|
1350.0000 -91.35278 -87.43157 3.92122 2.37934 -87.68688 857.27989
|
|
1355.0000 -91.91085 -86.65997 5.25088 2.42300 -87.18478 884.70654
|
|
1360.0000 -91.33861 -86.53738 4.80123 2.53277 -85.92236 1012.74569
|
|
1365.0000 -92.86826 -88.39445 4.47381 2.32007 -88.36841 841.09321
|
|
1370.0000 -92.79522 -87.90490 4.89033 2.35918 -87.91871 834.04667
|
|
1375.0000 -90.69923 -85.00027 5.69897 2.47507 -86.58587 956.42104
|
|
1380.0000 -90.90188 -86.15561 4.74627 2.55181 -85.70344 1017.20568
|
|
1385.0000 -92.74893 -87.59053 5.15840 2.42989 -87.10549 881.61406
|
|
1390.0000 -92.53998 -87.28268 5.25730 2.40212 -87.42484 891.22825
|
|
1395.0000 -91.43358 -86.13058 5.30299 2.40724 -87.36596 902.84472
|
|
1400.0000 -92.06324 -86.79779 5.26545 2.45936 -86.76662 909.67463
|
|
1405.0000 -91.52571 -86.53136 4.99435 2.45257 -86.84463 931.36381
|
|
1410.0000 -91.32858 -86.82238 4.50620 2.47945 -86.53558 1007.46664
|
|
1415.0000 -91.37992 -87.61532 3.76460 2.38443 -87.62827 838.18190
|
|
1420.0000 -93.00722 -89.79665 3.21057 2.32128 -88.35455 837.60614
|
|
1425.0000 -92.96893 -88.96851 4.00042 2.18086 -89.96941 701.62578
|
|
1430.0000 -92.04566 -87.33868 4.70699 2.32706 -88.28806 831.62245
|
|
1435.0000 -93.21185 -88.22533 4.98652 2.42949 -87.11007 936.87017
|
|
1440.0000 -93.16561 -88.91433 4.25128 2.32363 -88.32749 817.77911
|
|
1445.0000 -91.18748 -86.87073 4.31675 2.37589 -87.72654 853.36518
|
|
1450.0000 -91.49090 -87.61166 3.87925 2.41894 -87.23144 886.87701
|
|
1455.0000 -91.96273 -87.68283 4.27990 2.37653 -87.71915 870.57657
|
|
1460.0000 -92.08436 -87.07491 5.00945 2.44195 -86.96684 914.21699
|
|
1465.0000 -90.59800 -86.33666 4.26133 2.44859 -86.89049 921.92482
|
|
1470.0000 -90.30711 -86.30726 3.99984 2.49746 -86.32842 967.98769
|
|
1475.0000 -91.87841 -87.32735 4.55106 2.51694 -86.10439 976.16225
|
|
1480.0000 -91.97864 -87.15894 4.81970 2.35282 -87.99185 857.28160
|
|
1485.0000 -90.96750 -86.93576 4.03174 2.43589 -87.03653 914.76727
|
|
1490.0000 -92.40764 -87.96795 4.43969 2.35819 -87.93009 870.78852
|
|
1495.0000 -91.42014 -86.91666 4.50349 2.39646 -87.48999 862.22267
|
|
1500.0000 -90.57023 -86.62045 3.94977 2.42407 -87.17242 914.19231
|
|
MELTING PROCESS: loop number 7 T-loop= 976.00000000000000
|
|
main_MD> interactions number 7 at Temperature= 976.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 0.50243 -1.25673 -1.17901
|
|
force_rgl> df(natom) -3.91929 -1.83879 0.82649
|
|
1505.0000 -91.24941 -85.63322 5.61619 2.49629 -86.34183 927.32563
|
|
1510.0000 -90.34927 -84.38509 5.96418 2.62614 -84.84861 1057.74770
|
|
1515.0000 -90.20818 -84.93294 5.27524 2.63335 -84.76567 1009.27583
|
|
1520.0000 -89.86051 -86.05989 3.80062 2.58340 -85.34014 991.87143
|
|
1525.0000 -89.85645 -84.49325 5.36320 2.66594 -84.39087 1094.55078
|
|
1530.0000 -91.65971 -86.88238 4.77733 2.58048 -85.37361 1044.27399
|
|
1535.0000 -91.76924 -86.98131 4.78794 2.40261 -87.41927 862.07408
|
|
1540.0000 -91.64824 -86.70398 4.94426 2.45647 -86.79988 877.75234
|
|
1545.0000 -91.09339 -86.87130 4.22209 2.45387 -86.82975 915.87212
|
|
1550.0000 -91.11860 -86.12698 4.99162 2.49284 -86.38161 942.50053
|
|
1555.0000 -90.84145 -86.22315 4.61831 2.45985 -86.76095 943.32735
|
|
1560.0000 -92.12081 -87.51835 4.60246 2.42697 -87.13905 873.58696
|
|
1565.0000 -90.22058 -85.25287 4.96771 2.48309 -86.49366 959.24694
|
|
1570.0000 -90.47390 -85.12884 5.34507 2.54325 -85.80184 993.22500
|
|
1575.0000 -89.92176 -84.76615 5.15561 2.57582 -85.42725 975.76541
|
|
1580.0000 -89.80907 -84.59393 5.21514 2.60339 -85.11019 1052.37891
|
|
1585.0000 -89.55372 -83.53001 6.02371 2.67917 -84.23871 1109.39316
|
|
1590.0000 -89.74738 -85.25978 4.48760 2.68499 -84.17182 1070.84996
|
|
1595.0000 -90.34232 -86.00261 4.33971 2.59958 -85.15396 1030.09976
|
|
1600.0000 -90.72348 -84.68180 6.04168 2.60804 -85.05668 1028.38547
|
|
1605.0000 -89.67723 -83.80546 5.87177 2.69924 -84.00789 1101.25770
|
|
1610.0000 -89.94025 -84.72371 5.21654 2.66507 -84.40087 1128.51750
|
|
1615.0000 -89.02053 -83.97299 5.04754 2.63129 -84.78931 1058.02409
|
|
1620.0000 -88.95443 -85.17996 3.77447 2.61928 -84.92744 1061.86780
|
|
1625.0000 -91.00261 -86.77484 4.22777 2.54673 -85.76175 973.27534
|
|
1630.0000 -92.45967 -88.39510 4.06457 2.36688 -87.83011 834.15943
|
|
1635.0000 -92.17960 -87.21997 4.95964 2.37261 -87.76429 833.92540
|
|
1640.0000 -90.84590 -86.40415 4.44175 2.47315 -86.60796 936.69378
|
|
1645.0000 -89.10022 -83.90080 5.19942 2.62171 -84.89956 1066.50590
|
|
1650.0000 -88.01184 -82.97519 5.03665 2.67241 -84.31648 1140.62015
|
|
1655.0000 -89.87425 -84.55171 5.32254 2.68701 -84.14855 1110.39035
|
|
1660.0000 -91.23615 -84.87554 6.36061 2.63613 -84.73363 1066.88171
|
|
1665.0000 -88.97943 -84.01824 4.96119 2.66775 -84.36998 1121.93738
|
|
1670.0000 -92.05277 -86.63141 5.42136 2.57840 -85.39764 1027.08880
|
|
1675.0000 -91.75307 -87.23113 4.52194 2.48233 -86.50242 926.52083
|
|
1680.0000 -91.79427 -87.34945 4.44482 2.36171 -87.88959 836.77324
|
|
1685.0000 -92.10853 -87.23475 4.87378 2.39301 -87.52965 903.04187
|
|
1690.0000 -91.48666 -86.82999 4.65667 2.41621 -87.26286 917.53764
|
|
1695.0000 -91.62235 -86.89882 4.72353 2.47822 -86.54974 927.36007
|
|
1700.0000 -91.47833 -86.57770 4.90063 2.42480 -87.16402 918.45276
|
|
1705.0000 -92.23485 -86.29009 5.94476 2.46368 -86.71689 977.35045
|
|
1710.0000 -89.78707 -85.75383 4.03324 2.55402 -85.67796 1047.16171
|
|
1715.0000 -91.48754 -85.92625 5.56128 2.59382 -85.22021 1054.35612
|
|
1720.0000 -90.58776 -86.17032 4.41745 2.46535 -86.69771 933.71636
|
|
1725.0000 -90.89621 -86.30908 4.58712 2.52551 -86.00587 947.52495
|
|
1730.0000 -91.63438 -85.76782 5.86656 2.61605 -84.96456 1092.21804
|
|
1735.0000 -91.69458 -86.78595 4.90862 2.49622 -86.34265 959.57345
|
|
1740.0000 -91.77970 -86.64581 5.13389 2.51433 -86.13445 992.88620
|
|
1745.0000 -90.49452 -87.06266 3.43186 2.45052 -86.86820 885.71674
|
|
1750.0000 -90.88450 -86.55198 4.33252 2.45363 -86.83251 941.70686
|
|
MELTING PROCESS: loop number 8 T-loop= 1076.0000000000000
|
|
main_MD> interactions number 8 at Temperature= 1076.0000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 1.08066 2.70193 -0.59871
|
|
force_rgl> df(natom) -2.13558 -0.17242 -0.66834
|
|
1755.0000 -89.96012 -84.88052 5.07960 2.60842 -85.05229 992.94328
|
|
1760.0000 -89.95911 -85.52555 4.43356 2.57451 -85.44229 1094.47448
|
|
1765.0000 -90.24010 -84.95522 5.28489 2.55791 -85.63319 970.75373
|
|
1770.0000 -89.59990 -83.42052 6.17938 2.65400 -84.52819 1063.99113
|
|
1775.0000 -89.80283 -85.23864 4.56419 2.70971 -83.88748 1093.58002
|
|
1780.0000 -90.63787 -86.51963 4.11824 2.52896 -85.96619 1015.46882
|
|
1785.0000 -89.96117 -85.57786 4.38331 2.55457 -85.67166 947.26610
|
|
1790.0000 -91.35648 -86.40687 4.94961 2.62472 -84.86490 1033.74913
|
|
1795.0000 -90.13031 -85.08943 5.04088 2.52684 -85.99053 957.63643
|
|
1800.0000 -90.91887 -85.86971 5.04916 2.47649 -86.56961 941.58907
|
|
1805.0000 -92.66282 -87.39065 5.27216 2.47964 -86.53339 971.22842
|
|
1810.0000 -90.38314 -85.57875 4.80439 2.50869 -86.19925 968.43960
|
|
1815.0000 -89.90734 -84.39839 5.50895 2.66650 -84.38444 1078.06195
|
|
1820.0000 -91.93239 -86.07457 5.85782 2.61996 -84.91964 1104.74359
|
|
1825.0000 -89.83569 -85.75151 4.08419 2.52706 -85.98804 991.29064
|
|
1830.0000 -88.74042 -83.97674 4.76367 2.55150 -85.70693 1029.38261
|
|
1835.0000 -90.86989 -85.05271 5.81718 2.60620 -85.07792 1051.53916
|
|
1840.0000 -88.36646 -83.47021 4.89625 2.63065 -84.79674 1103.65272
|
|
1845.0000 -91.09011 -85.26492 5.82520 2.72863 -83.66984 1172.81675
|
|
1850.0000 -89.49528 -84.79637 4.69891 2.65832 -84.47853 1083.09221
|
|
1855.0000 -91.28045 -85.91326 5.36719 2.66253 -84.43011 1074.39111
|
|
1860.0000 -91.27054 -87.25841 4.01213 2.48587 -86.46169 957.38499
|
|
1865.0000 -91.97589 -86.55270 5.42320 2.42338 -87.18032 874.35395
|
|
1870.0000 -90.41938 -86.36269 4.05669 2.45939 -86.76626 981.84343
|
|
1875.0000 -91.82580 -86.44846 5.37734 2.47826 -86.54926 962.89112
|
|
1880.0000 -89.12559 -85.16524 3.96035 2.50724 -86.21594 1014.50504
|
|
1885.0000 -88.97704 -83.70289 5.27416 2.65342 -84.53484 1112.70836
|
|
1890.0000 -90.26171 -84.93571 5.32599 2.70463 -83.94595 1124.98112
|
|
1895.0000 -90.89769 -85.57162 5.32607 2.62296 -84.88513 1076.68365
|
|
1900.0000 -89.21140 -83.57229 5.63910 2.68190 -84.20734 1120.41767
|
|
1905.0000 -87.92557 -81.67807 6.24749 2.81712 -82.65227 1205.39115
|
|
1910.0000 -87.15846 -82.34141 4.81706 2.82406 -82.57240 1217.49534
|
|
1915.0000 -89.93721 -85.22746 4.70974 2.76422 -83.26056 1170.45782
|
|
1920.0000 -89.58067 -84.78604 4.79463 2.59060 -85.25726 1036.20040
|
|
1925.0000 -90.13972 -83.96412 6.17560 2.68530 -84.16817 1134.07983
|
|
1930.0000 -89.84941 -84.11629 5.73312 2.74204 -83.51568 1191.80901
|
|
1935.0000 -90.12122 -84.90097 5.22024 2.70845 -83.90195 1092.08592
|
|
1940.0000 -90.18546 -83.95782 6.22764 2.63760 -84.71672 1080.61248
|
|
1945.0000 -90.65222 -84.66567 5.98655 2.58212 -85.35476 1054.91548
|
|
1950.0000 -90.56178 -84.85022 5.71156 2.66323 -84.42202 1134.20378
|
|
1955.0000 -90.50038 -84.73271 5.76767 2.62649 -84.84457 1093.37964
|
|
1960.0000 -90.60981 -85.07754 5.53227 2.56659 -85.53343 1017.58320
|
|
1965.0000 -91.05527 -85.37716 5.67811 2.58830 -85.28375 1028.31713
|
|
1970.0000 -90.28016 -84.30807 5.97209 2.58082 -85.36976 1014.27309
|
|
1975.0000 -89.90769 -84.62690 5.28079 2.69331 -84.07605 1104.14555
|
|
1980.0000 -90.14389 -85.02535 5.11854 2.62773 -84.83033 1023.81530
|
|
1985.0000 -89.64925 -83.97918 5.67007 2.64148 -84.67214 1081.01806
|
|
1990.0000 -89.71330 -84.33812 5.37518 2.61393 -84.98901 1058.60388
|
|
1995.0000 -87.80051 -83.43005 4.37045 2.70875 -83.89855 1123.89861
|
|
2000.0000 -91.21088 -84.94758 6.26330 2.67928 -84.23745 1099.51585
|
|
MELTING PROCESS: loop number 9 T-loop= 1176.0000000000000
|
|
main_MD> interactions number 9 at Temperature= 1176.0000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 9.29294 -0.86000 -1.28887
|
|
force_rgl> df(natom) -1.83292 1.68169 -0.68695
|
|
2005.0000 -89.57740 -83.59626 5.98114 2.61806 -84.94145 1068.21072
|
|
2010.0000 -89.85241 -82.96139 6.89103 2.79117 -82.95068 1204.05375
|
|
2015.0000 -89.19374 -84.24117 4.95257 2.75888 -83.32202 1228.79389
|
|
2020.0000 -89.09946 -84.09903 5.00043 2.74067 -83.53144 1137.78232
|
|
2025.0000 -90.93127 -84.54449 6.38678 2.67289 -84.31089 1116.56861
|
|
2030.0000 -90.06660 -83.89770 6.16890 2.69928 -84.00747 1143.11051
|
|
2035.0000 -90.06320 -85.04437 5.01883 2.68697 -84.14896 1160.68109
|
|
2040.0000 -89.76439 -84.79652 4.96787 2.62844 -84.82215 1080.08424
|
|
2045.0000 -90.72985 -85.50644 5.22341 2.56310 -85.57350 965.13148
|
|
2050.0000 -89.21536 -82.87242 6.34294 2.66657 -84.38362 1128.96751
|
|
2055.0000 -90.15894 -83.66351 6.49542 2.71947 -83.77518 1135.83382
|
|
2060.0000 -89.08140 -82.72008 6.36132 2.86033 -82.15535 1232.62256
|
|
2065.0000 -88.42635 -82.20552 6.22083 2.82787 -82.52865 1236.46037
|
|
2070.0000 -90.61294 -84.79559 5.81736 2.77785 -83.10387 1177.86239
|
|
2075.0000 -89.05718 -82.99271 6.06447 2.69701 -84.03356 1088.37944
|
|
2080.0000 -89.21757 -85.03507 4.18251 2.73663 -83.57788 1134.29060
|
|
2085.0000 -89.48419 -83.11882 6.36537 2.67466 -84.29059 1111.70817
|
|
2090.0000 -88.61770 -82.24504 6.37266 2.73563 -83.58935 1139.22072
|
|
2095.0000 -87.88519 -82.29434 5.59085 2.79880 -82.86296 1237.07106
|
|
2100.0000 -88.58963 -81.65300 6.93664 2.87855 -81.94572 1276.14605
|
|
2105.0000 -88.47083 -80.98068 7.49015 2.99673 -80.58666 1384.46664
|
|
2110.0000 -87.73363 -81.88675 5.84688 2.90685 -81.62026 1249.29611
|
|
2115.0000 -88.87710 -83.15140 5.72570 2.86039 -82.15463 1214.27046
|
|
2120.0000 -90.15426 -84.81537 5.33889 2.63532 -84.74295 1101.89329
|
|
2125.0000 -87.55251 -82.37791 5.17460 2.70782 -83.90925 1120.28988
|
|
2130.0000 -89.37800 -82.95469 6.42332 2.81700 -82.65366 1255.31663
|
|
2135.0000 -89.70860 -83.81853 5.89007 2.73066 -83.64650 1127.23702
|
|
2140.0000 -90.12033 -84.37015 5.75018 2.64141 -84.67296 1078.28916
|
|
2145.0000 -89.07246 -83.14994 5.92252 2.67464 -84.29084 1082.44211
|
|
2150.0000 -89.88203 -83.87123 6.01080 2.68972 -84.11735 1150.47015
|
|
2155.0000 -89.08700 -83.73603 5.35097 2.73829 -83.55879 1157.82270
|
|
2160.0000 -89.08192 -83.11926 5.96266 2.73986 -83.54076 1111.26934
|
|
2165.0000 -88.45798 -82.67669 5.78128 2.77377 -83.15079 1191.30136
|
|
2170.0000 -88.29438 -81.43404 6.86034 2.94667 -81.16238 1381.06531
|
|
2175.0000 -88.54291 -82.03254 6.51037 2.84783 -82.29910 1233.24888
|
|
2180.0000 -88.13514 -81.93298 6.20215 2.82563 -82.55438 1187.28353
|
|
2185.0000 -87.86261 -82.59415 5.26846 2.85477 -82.21930 1253.67340
|
|
2190.0000 -89.43972 -81.12302 8.31670 2.95062 -81.11695 1339.77770
|
|
2195.0000 -88.21062 -82.91976 5.29086 2.87881 -81.94277 1280.00130
|
|
2200.0000 -89.72582 -83.73436 5.99146 2.79270 -82.93307 1217.73931
|
|
2205.0000 -88.92123 -82.56739 6.35384 2.82628 -82.54686 1229.39162
|
|
2210.0000 -89.44708 -84.00778 5.43931 2.71297 -83.84993 1127.59631
|
|
2215.0000 -89.40604 -83.98715 5.41889 2.68951 -84.11983 1096.08398
|
|
2220.0000 -89.90397 -84.08448 5.81950 2.71872 -83.78389 1136.46098
|
|
2225.0000 -91.31610 -84.34535 6.97075 2.65035 -84.57009 1078.01976
|
|
2230.0000 -88.93891 -82.79035 6.14855 2.67912 -84.23933 1109.53338
|
|
2235.0000 -88.03025 -82.19813 5.83213 2.91924 -81.47788 1376.55377
|
|
2240.0000 -89.46960 -83.05143 6.41817 2.79817 -82.87011 1271.02140
|
|
2245.0000 -90.53960 -82.94552 7.59409 2.76714 -83.22705 1141.74370
|
|
2250.0000 -88.10155 -82.49711 5.60444 2.77069 -83.18618 1155.90181
|
|
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 1 [min], 57.1039078 [s].
|
|
main_MD> Deallocating global variables
|