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_49.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 = 49 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: 49 4900
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main_MD> Size of nv and nvoiz: 49 4900
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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 = 49
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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> 8.2257443134685942E-002 0.10797807630338140 -5.2324701176310384E-002 initial drift of cluster / NP1 for coalescence
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init> 0.31683829571366179 0.33672411245572265 0.32336352626400172 scaling for velocity /for coalescence NP1
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init.f90 > facguy = 1.7772065071117030E-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) -2.70814 -1.79869 -0.43658
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force_rgl> df(natom) 1.58337 -0.48838 -0.94578
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preparo> THERMALIZATION PROCESS AT 274.17150205835293
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preparo> TOTAL ENERGY, KINETIC EN., POT. ENERGY, DELTA
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5000 -122.35122600938244 1.4508859257112894 -123.80211193509373 3.5874960801535497E-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= 374.00000000000000
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main_MD> interactions number 1 at Temperature= 374.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) 0.05767 -0.65475 -0.73266
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force_rgl> df(natom) -0.06136 0.11210 -0.58057
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5.0000 -123.00427 -120.55023 2.45404 1.75201 -121.08973 318.27045
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10.0000 -122.42823 -120.09160 2.33663 1.80065 -120.43831 358.97659
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15.0000 -122.68253 -120.52856 2.15397 1.82178 -120.15544 383.29780
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20.0000 -123.12265 -120.50767 2.61499 1.78618 -120.63211 346.77627
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25.0000 -123.13403 -120.83258 2.30145 1.78333 -120.67027 356.96823
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30.0000 -122.78137 -120.38179 2.39957 1.78352 -120.66773 359.93599
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35.0000 -122.83717 -120.25560 2.58158 1.80905 -120.32585 380.17125
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40.0000 -122.37109 -120.29412 2.07697 1.81915 -120.19068 391.76309
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45.0000 -122.63246 -120.03538 2.59708 1.82336 -120.13427 397.89707
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50.0000 -123.13878 -120.92764 2.21114 1.79494 -120.51489 372.33119
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55.0000 -123.07491 -120.34291 2.73200 1.77974 -120.71834 354.79920
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60.0000 -122.63112 -120.22701 2.40411 1.82206 -120.15173 392.70917
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65.0000 -122.89235 -120.59604 2.29631 1.79540 -120.50873 360.50851
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70.0000 -122.87205 -120.59761 2.27443 1.79010 -120.57958 364.53383
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75.0000 -122.85653 -120.81823 2.03830 1.78904 -120.59379 366.88980
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80.0000 -123.10716 -120.86564 2.24153 1.77057 -120.84121 348.81841
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85.0000 -122.94680 -120.69599 2.25080 1.76617 -120.90008 348.16500
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90.0000 -122.48408 -119.98190 2.50217 1.78618 -120.63215 363.04670
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95.0000 -122.57471 -119.88687 2.68784 1.82753 -120.07843 402.70560
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100.0000 -122.97935 -120.32074 2.65861 1.83097 -120.03238 403.50340
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105.0000 -123.10281 -120.76150 2.34130 1.78708 -120.62004 358.77850
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110.0000 -123.19732 -120.82024 2.37707 1.77503 -120.78137 351.00003
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115.0000 -122.77777 -120.27815 2.49962 1.77397 -120.79564 346.69793
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120.0000 -122.91927 -120.61405 2.30522 1.81526 -120.24275 388.26732
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125.0000 -122.71434 -120.13597 2.57837 1.77942 -120.72268 357.17417
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130.0000 -123.18383 -120.68498 2.49885 1.79621 -120.49782 370.22346
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135.0000 -123.37210 -120.78439 2.58771 1.79890 -120.46180 376.08952
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140.0000 -123.15610 -120.64603 2.51008 1.75694 -121.02365 330.15795
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145.0000 -123.03819 -120.68602 2.35217 1.76919 -120.85966 348.90395
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150.0000 -122.63038 -120.09233 2.53805 1.81090 -120.30114 391.26749
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155.0000 -122.53332 -120.02571 2.50761 1.82017 -120.17704 397.06103
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160.0000 -122.97956 -120.67349 2.30608 1.81013 -120.31143 384.07309
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165.0000 -122.29646 -120.02018 2.27629 1.83036 -120.04051 402.74432
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170.0000 -122.77666 -120.52342 2.25323 1.82039 -120.17405 389.66484
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175.0000 -122.92966 -121.07444 1.85522 1.78909 -120.59312 361.53819
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180.0000 -123.23882 -121.49496 1.74386 1.75386 -121.06489 335.21273
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185.0000 -123.07259 -120.64314 2.42946 1.77072 -120.83913 347.05504
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190.0000 -121.76671 -118.74350 3.02321 1.85715 -119.68174 429.47846
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195.0000 -122.49348 -120.34294 2.15054 1.85310 -119.73598 423.59303
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200.0000 -122.92642 -120.79886 2.12756 1.81491 -120.24739 392.14122
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205.0000 -122.88294 -120.91292 1.97002 1.78094 -120.70227 353.42882
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210.0000 -122.60139 -120.56901 2.03239 1.78592 -120.63561 360.41292
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215.0000 -122.47787 -120.14007 2.33781 1.79719 -120.48469 366.90493
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220.0000 -122.55848 -120.35174 2.20673 1.81296 -120.27349 375.67585
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225.0000 -122.77345 -120.65533 2.11812 1.79714 -120.48540 376.59998
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230.0000 -122.83026 -120.22654 2.60372 1.78677 -120.62422 369.51599
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235.0000 -123.10967 -120.58772 2.52194 1.80583 -120.36899 387.08473
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240.0000 -122.86167 -120.27215 2.58952 1.80004 -120.44659 382.34042
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245.0000 -122.25432 -119.81384 2.44048 1.83367 -119.99624 418.64571
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250.0000 -122.90163 -120.02115 2.88048 1.84272 -119.87498 416.83974
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MELTING PROCESS: loop number 2 T-loop= 474.00000000000000
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main_MD> interactions number 2 at Temperature= 474.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -1.05334 3.59955 -0.03493
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force_rgl> df(natom) 0.29502 0.05221 1.46242
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255.0000 -122.29235 -119.76017 2.53218 1.84701 -119.81758 422.63600
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260.0000 -122.21590 -119.15587 3.06004 1.87721 -119.41322 460.89892
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265.0000 -122.91114 -119.48242 3.42873 1.88493 -119.30988 462.75148
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270.0000 -121.88193 -119.41512 2.46681 1.91089 -118.96217 480.15616
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275.0000 -122.37863 -119.01049 3.36815 1.89385 -119.19031 466.61798
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280.0000 -121.71677 -118.60678 3.10999 1.91898 -118.85389 486.51028
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285.0000 -122.03672 -119.07575 2.96097 1.94269 -118.53644 501.80819
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290.0000 -122.33543 -119.78127 2.55416 1.85548 -119.70414 432.68911
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295.0000 -121.91202 -118.78604 3.12597 1.86982 -119.51220 447.29155
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300.0000 -122.54281 -119.41639 3.12642 1.89476 -119.17812 478.43425
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305.0000 -122.30025 -119.00445 3.29580 1.89872 -119.12519 479.18686
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310.0000 -121.73214 -118.70998 3.02215 1.93300 -118.66618 500.53165
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315.0000 -122.14712 -119.21516 2.93195 1.89560 -119.16692 471.85374
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320.0000 -122.46556 -119.76739 2.69817 1.88003 -119.37541 444.56185
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325.0000 -122.35133 -119.19442 3.15691 1.87917 -119.38697 457.02860
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330.0000 -122.49869 -119.32432 3.17437 1.88834 -119.26414 466.19752
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335.0000 -121.83780 -118.85868 2.97912 1.90799 -119.00099 460.33000
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340.0000 -121.93545 -118.87798 3.05747 1.91649 -118.88714 446.47756
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345.0000 -121.21184 -118.56036 2.65148 1.91897 -118.85402 448.63728
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350.0000 -121.69424 -118.25602 3.43822 1.95204 -118.41112 488.21567
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355.0000 -121.67419 -118.48421 3.18998 1.95154 -118.41785 472.97778
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360.0000 -121.48423 -118.05222 3.43201 1.95264 -118.40309 492.32251
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365.0000 -121.91218 -119.18011 2.73207 1.94328 -118.52846 493.12698
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370.0000 -122.64791 -119.34980 3.29811 1.89328 -119.19795 474.81533
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375.0000 -122.40488 -120.04452 2.36036 1.86376 -119.59326 461.35767
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380.0000 -122.88574 -119.52426 3.36149 1.83676 -119.95478 433.94792
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385.0000 -122.23901 -119.24692 2.99209 1.88606 -119.29461 469.08949
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390.0000 -122.56967 -119.40626 3.16341 1.86897 -119.52347 464.31957
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395.0000 -122.56787 -119.43749 3.13037 1.90659 -119.01979 508.62244
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400.0000 -123.33621 -119.97228 3.36393 1.86896 -119.52362 468.01693
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405.0000 -122.57833 -120.19274 2.38558 1.82329 -120.13519 428.68130
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410.0000 -122.49167 -119.76572 2.72595 1.83738 -119.94651 431.27370
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415.0000 -122.35493 -119.10990 3.24502 1.87220 -119.48032 460.35506
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420.0000 -122.58250 -119.55705 3.02545 1.90183 -119.08355 480.58400
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425.0000 -122.97812 -120.04363 2.93449 1.84390 -119.85917 440.29260
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430.0000 -122.96169 -120.20718 2.75451 1.83297 -120.00553 430.12498
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435.0000 -122.59396 -119.26733 3.32663 1.81887 -120.19434 419.83346
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440.0000 -122.42839 -119.41391 3.01448 1.87810 -119.40130 477.21526
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445.0000 -122.13367 -118.78302 3.35065 1.88842 -119.26306 473.22993
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450.0000 -122.08076 -118.94148 3.13928 1.91303 -118.93348 498.93343
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455.0000 -122.46823 -119.49030 2.97792 1.91975 -118.84349 512.27935
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460.0000 -121.98269 -118.56260 3.42010 1.93334 -118.66151 524.41299
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465.0000 -122.30987 -119.26067 3.04921 1.90073 -119.09821 496.29557
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470.0000 -121.60738 -118.46707 3.14031 1.91001 -118.97396 506.04852
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475.0000 -122.59468 -119.91611 2.67857 1.87761 -119.40777 474.67634
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480.0000 -121.96922 -119.05160 2.91762 1.88482 -119.31130 485.50829
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485.0000 -121.75422 -119.22922 2.52500 1.88000 -119.37576 472.99038
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490.0000 -122.47778 -119.47012 3.00766 1.86585 -119.56536 462.37813
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495.0000 -122.48259 -119.13920 3.34339 1.89838 -119.12966 498.22825
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500.0000 -122.55141 -119.35902 3.19239 1.88717 -119.27988 486.36182
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MELTING PROCESS: loop number 3 T-loop= 574.00000000000000
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main_MD> interactions number 3 at Temperature= 574.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) 3.73408 -0.87709 -1.55334
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force_rgl> df(natom) 0.55836 -0.54224 -1.94807
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505.0000 -122.46369 -119.35027 3.11342 1.89767 -119.13920 492.06672
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510.0000 -121.26395 -117.53928 3.72467 1.94653 -118.48498 518.07342
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515.0000 -121.13639 -117.36066 3.77573 2.00926 -117.64497 576.07456
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520.0000 -120.93674 -117.65479 3.28195 1.99891 -117.78360 532.52992
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525.0000 -119.21937 -115.89277 3.32660 2.05496 -117.03309 571.01632
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530.0000 -120.73503 -117.18590 3.54913 2.11373 -116.24601 626.98947
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535.0000 -120.43074 -116.73946 3.69128 2.08746 -116.59778 588.15329
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540.0000 -119.84141 -116.13045 3.71096 2.06792 -116.85951 562.46509
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545.0000 -120.17938 -116.86246 3.31692 2.09446 -116.50404 588.73517
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550.0000 -120.27833 -116.45448 3.82385 2.07498 -116.76488 570.56206
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555.0000 -120.71172 -116.90499 3.80673 2.08449 -116.63756 576.07687
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560.0000 -120.20078 -116.70796 3.49283 2.09839 -116.45143 577.74523
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565.0000 -120.00693 -116.04037 3.96656 2.10906 -116.30854 596.24383
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570.0000 -120.36022 -115.99352 4.36670 2.15906 -115.63903 614.78133
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575.0000 -119.33398 -114.66323 4.67075 2.16890 -115.50734 652.61850
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580.0000 -119.54031 -115.54735 3.99296 2.16477 -115.56266 639.64261
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585.0000 -119.12433 -114.92831 4.19601 2.16908 -115.50494 651.44523
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590.0000 -119.90721 -116.33825 3.56896 2.16381 -115.57545 619.53942
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595.0000 -119.81890 -116.13406 3.68484 2.12751 -116.06161 585.57096
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600.0000 -118.55618 -114.93341 3.62277 2.17263 -115.45739 630.61262
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605.0000 -119.62201 -116.30514 3.31687 2.16891 -115.50717 638.03150
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610.0000 -119.77955 -116.32935 3.45020 2.09924 -116.44008 596.21461
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615.0000 -120.97729 -117.75556 3.22173 2.08854 -116.58337 570.14912
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620.0000 -120.22866 -117.16320 3.06546 2.02827 -117.39038 519.55670
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625.0000 -120.76538 -117.13871 3.62667 2.05002 -117.09918 539.32921
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630.0000 -120.86524 -117.41883 3.44641 2.00921 -117.64562 525.11722
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635.0000 -119.72249 -116.67877 3.04372 2.05861 -116.98419 559.00169
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640.0000 -119.45997 -116.19778 3.26220 2.10421 -116.37356 596.91130
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645.0000 -121.03385 -116.96556 4.06829 2.08181 -116.67350 595.61615
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650.0000 -119.55995 -116.05438 3.50557 2.06306 -116.92461 576.07408
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655.0000 -119.57254 -115.59147 3.98107 2.12188 -116.13695 596.38973
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660.0000 -119.82071 -115.27734 4.54338 2.15847 -115.64694 644.67830
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665.0000 -119.79004 -115.58860 4.20144 2.15795 -115.65399 624.79396
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670.0000 -121.20355 -117.45984 3.74371 2.08133 -116.67985 569.83761
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675.0000 -120.37740 -116.50490 3.87250 2.07026 -116.82818 575.60286
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680.0000 -120.19672 -115.63190 4.56482 2.10275 -116.39304 582.21402
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685.0000 -120.26817 -115.81291 4.45526 2.15377 -115.70984 643.46858
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690.0000 -120.42750 -115.88211 4.54539 2.15328 -115.71645 637.97499
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695.0000 -119.79989 -116.37336 3.42653 2.10345 -116.38366 580.56755
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700.0000 -120.21379 -116.00858 4.20522 2.10104 -116.41599 587.08652
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705.0000 -120.73335 -117.00479 3.72857 2.09459 -116.50237 609.46609
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710.0000 -121.64285 -117.61496 4.02790 2.03767 -117.26459 552.95293
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715.0000 -120.58255 -116.99311 3.58945 2.04555 -117.15900 583.83021
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720.0000 -120.49254 -117.19615 3.29639 2.05433 -117.04140 584.47031
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725.0000 -120.29079 -117.28487 3.00592 2.04097 -117.22041 580.25574
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730.0000 -121.04725 -117.80211 3.24514 2.01484 -117.57023 548.74879
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735.0000 -120.05908 -116.16085 3.89823 2.08371 -116.64804 578.14965
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740.0000 -119.49105 -116.06066 3.43039 2.17250 -115.45916 642.05995
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745.0000 -120.56918 -116.90540 3.66378 2.11696 -116.20283 610.54083
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750.0000 -119.82882 -115.80736 4.02146 2.14236 -115.86269 634.33033
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MELTING PROCESS: loop number 4 T-loop= 674.00000000000000
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main_MD> interactions number 4 at Temperature= 674.00000000000000
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force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
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force_rgl> df(1) -2.99971 1.59976 0.51732
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force_rgl> df(natom) 1.16774 3.08932 -2.00696
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755.0000 -119.79904 -115.34040 4.45864 2.13559 -115.95329 604.37961
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760.0000 -119.52038 -116.32386 3.19651 2.13652 -115.94084 610.34432
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765.0000 -120.07185 -115.76695 4.30490 2.12533 -116.09073 614.77903
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770.0000 -119.66295 -115.35507 4.30788 2.15241 -115.72805 631.74838
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775.0000 -119.40049 -115.59543 3.80506 2.19126 -115.20789 636.73183
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780.0000 -118.90301 -115.51228 3.39073 2.15989 -115.62795 613.27238
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785.0000 -119.66572 -116.54882 3.11689 2.13756 -115.92693 597.26397
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790.0000 -119.45410 -115.78039 3.67370 2.13123 -116.01174 621.34756
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795.0000 -119.34036 -116.05974 3.28062 2.15491 -115.69460 635.04857
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800.0000 -119.58098 -115.54205 4.03893 2.09916 -116.44119 584.52103
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805.0000 -119.62605 -115.56087 4.06518 2.19577 -115.14749 660.37032
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810.0000 -120.06077 -115.72378 4.33699 2.13847 -115.91474 618.88812
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815.0000 -119.65525 -115.13528 4.51997 2.15225 -115.73026 636.42080
|
|
820.0000 -119.39870 -114.23420 5.16450 2.20574 -115.01396 670.61386
|
|
825.0000 -119.64981 -115.29411 4.35570 2.23694 -114.59625 677.72841
|
|
830.0000 -118.55836 -114.53402 4.02433 2.23257 -114.65478 639.97801
|
|
835.0000 -118.36826 -113.88064 4.48762 2.22350 -114.77625 673.93438
|
|
840.0000 -119.22178 -115.10876 4.11302 2.21616 -114.87450 668.22823
|
|
845.0000 -119.52941 -115.51765 4.01176 2.16051 -115.61970 630.73478
|
|
850.0000 -120.08885 -116.36388 3.72497 2.15703 -115.66627 636.65502
|
|
855.0000 -118.60606 -114.70996 3.89610 2.16158 -115.60536 637.81953
|
|
860.0000 -119.08190 -114.80667 4.27523 2.21747 -114.85698 671.42761
|
|
865.0000 -118.85947 -115.40466 3.45481 2.19877 -115.10734 646.58784
|
|
870.0000 -119.67439 -115.61668 4.05771 2.21580 -114.87932 688.47187
|
|
875.0000 -119.65910 -115.83358 3.82552 2.10908 -116.30830 582.02303
|
|
880.0000 -119.19253 -114.66685 4.52568 2.18477 -115.29475 651.05566
|
|
885.0000 -119.95748 -115.24081 4.71667 2.19281 -115.18718 637.49503
|
|
890.0000 -118.69515 -114.38675 4.30840 2.26419 -114.23128 702.47969
|
|
895.0000 -119.08239 -115.21388 3.86851 2.17087 -115.48095 621.68187
|
|
900.0000 -119.79345 -115.08072 4.71273 2.20077 -115.08054 665.56805
|
|
905.0000 -118.42728 -113.70317 4.72411 2.29114 -113.87044 740.72524
|
|
910.0000 -118.89276 -114.78628 4.10648 2.27629 -114.06933 712.45938
|
|
915.0000 -118.41994 -113.60686 4.81308 2.28366 -113.97057 724.62043
|
|
920.0000 -118.87624 -114.63449 4.24175 2.29104 -113.87180 711.45682
|
|
925.0000 -119.23163 -114.94115 4.29048 2.22894 -114.70332 683.83835
|
|
930.0000 -118.70988 -114.98597 3.72392 2.24631 -114.47076 711.80299
|
|
935.0000 -118.59409 -114.13268 4.46141 2.25065 -114.41259 715.68761
|
|
940.0000 -120.19862 -115.35047 4.84815 2.23809 -114.58081 689.92865
|
|
945.0000 -119.94205 -116.18238 3.75967 2.15404 -115.70625 635.69856
|
|
950.0000 -120.59171 -116.89712 3.69459 2.10602 -116.34929 583.61235
|
|
955.0000 -119.94019 -115.93514 4.00505 2.15042 -115.75480 630.56300
|
|
960.0000 -119.94358 -116.00081 3.94277 2.12534 -116.09066 598.87621
|
|
965.0000 -119.25609 -115.39564 3.86045 2.16546 -115.55342 646.75663
|
|
970.0000 -119.26011 -115.22830 4.03180 2.18835 -115.24691 677.63457
|
|
975.0000 -119.95990 -116.33494 3.62496 2.11445 -116.23644 625.08042
|
|
980.0000 -119.48247 -115.10641 4.37606 2.15087 -115.74869 650.49619
|
|
985.0000 -118.82019 -114.59014 4.23005 2.21551 -114.88324 685.32168
|
|
990.0000 -119.60086 -115.35453 4.24633 2.19283 -115.18683 664.93902
|
|
995.0000 -119.91746 -115.46811 4.44935 2.17092 -115.48029 637.57064
|
|
1000.0000 -119.11791 -114.29051 4.82740 2.16372 -115.57669 643.18545
|
|
MELTING PROCESS: loop number 5 T-loop= 774.00000000000000
|
|
main_MD> interactions number 5 at Temperature= 774.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 4.87849 2.53396 -1.26241
|
|
force_rgl> df(natom) 0.04442 -2.98661 -3.25730
|
|
1005.0000 -119.32947 -115.11680 4.21268 2.20476 -115.02711 668.53818
|
|
1010.0000 -118.75256 -114.72409 4.02846 2.23156 -114.66826 690.85182
|
|
1015.0000 -118.48610 -114.75018 3.73593 2.22037 -114.81813 670.50721
|
|
1020.0000 -118.94186 -114.44166 4.50020 2.25249 -114.38798 714.40884
|
|
1025.0000 -117.61647 -114.20522 3.41125 2.23763 -114.58697 700.64407
|
|
1030.0000 -119.31526 -114.61173 4.70352 2.22059 -114.81514 688.80902
|
|
1035.0000 -117.86705 -112.63708 5.22997 2.34983 -113.08460 774.30141
|
|
1040.0000 -118.13141 -113.24244 4.88897 2.37350 -112.76754 798.61080
|
|
1045.0000 -118.33215 -113.47398 4.85817 2.32000 -113.48396 768.31080
|
|
1050.0000 -118.37082 -113.45092 4.91989 2.31242 -113.58555 749.47826
|
|
1055.0000 -118.29138 -112.42676 5.86462 2.34251 -113.18256 769.02760
|
|
1060.0000 -117.39740 -113.35080 4.04660 2.36063 -112.93996 768.09559
|
|
1065.0000 -117.72399 -112.31705 5.40694 2.40843 -112.29984 858.41842
|
|
1070.0000 -116.87031 -111.60167 5.26864 2.43458 -111.94965 856.75808
|
|
1075.0000 -118.08973 -112.64442 5.44531 2.39281 -112.50901 791.61643
|
|
1080.0000 -118.34239 -113.39232 4.95007 2.37142 -112.79549 793.32745
|
|
1085.0000 -118.48481 -114.60306 3.88175 2.26242 -114.25507 713.02598
|
|
1090.0000 -118.92522 -113.85735 5.06787 2.25060 -114.41326 710.84487
|
|
1095.0000 -118.50070 -113.27503 5.22567 2.33569 -113.27393 770.64822
|
|
1100.0000 -118.99085 -114.10841 4.88244 2.29590 -113.80668 757.50561
|
|
1105.0000 -119.25548 -115.83003 3.42546 2.23987 -114.55695 716.13282
|
|
1110.0000 -117.90295 -114.17127 3.73168 2.18527 -115.28806 635.74055
|
|
1115.0000 -117.07357 -112.66673 4.40685 2.33252 -113.31629 737.91538
|
|
1120.0000 -119.09186 -114.42868 4.66318 2.32319 -113.44125 736.45241
|
|
1125.0000 -119.20270 -114.22543 4.97726 2.27224 -114.12359 709.19813
|
|
1130.0000 -116.69670 -112.15451 4.54220 2.36814 -112.83944 787.96205
|
|
1135.0000 -117.26102 -111.39223 5.86879 2.46115 -111.59398 860.35656
|
|
1140.0000 -116.76748 -112.22571 4.54176 2.43218 -111.98178 855.60793
|
|
1145.0000 -118.88423 -113.93765 4.94658 2.34009 -113.21495 781.12417
|
|
1150.0000 -118.60586 -114.53931 4.06656 2.26812 -114.17875 717.52203
|
|
1155.0000 -118.28449 -113.53615 4.74834 2.26081 -114.27660 724.78174
|
|
1160.0000 -118.71906 -113.76094 4.95812 2.28554 -113.94547 723.80697
|
|
1165.0000 -117.25836 -112.98658 4.27179 2.31392 -113.56538 755.50558
|
|
1170.0000 -116.72697 -111.49201 5.23496 2.41501 -112.21183 810.35359
|
|
1175.0000 -117.57611 -112.93412 4.64199 2.40954 -112.28501 808.20497
|
|
1180.0000 -117.16837 -112.60405 4.56432 2.39866 -112.43064 773.89155
|
|
1185.0000 -117.31838 -112.97676 4.34162 2.38069 -112.67133 780.12700
|
|
1190.0000 -117.90605 -112.39326 5.51279 2.36889 -112.82930 765.92632
|
|
1195.0000 -119.10224 -114.36903 4.73321 2.36154 -112.92771 772.86761
|
|
1200.0000 -118.72299 -114.09285 4.63014 2.26795 -114.18094 701.06515
|
|
1205.0000 -119.06240 -113.51668 5.54572 2.28666 -113.93047 698.41175
|
|
1210.0000 -118.45176 -114.27783 4.17393 2.29825 -113.77518 762.15543
|
|
1215.0000 -118.27190 -114.26265 4.00925 2.26837 -114.17539 690.59961
|
|
1220.0000 -117.20370 -112.55455 4.64915 2.37330 -112.77028 801.18560
|
|
1225.0000 -117.09211 -112.29084 4.80126 2.39262 -112.51162 811.81300
|
|
1230.0000 -119.26699 -113.99470 5.27230 2.32999 -113.35021 760.77709
|
|
1235.0000 -117.58595 -112.13634 5.44962 2.27556 -114.07908 699.07671
|
|
1240.0000 -117.01394 -112.15633 4.85761 2.42926 -112.02094 812.68326
|
|
1245.0000 -119.09314 -112.71770 6.37544 2.37966 -112.68510 787.22560
|
|
1250.0000 -117.64388 -111.92081 5.72307 2.38525 -112.61029 853.21089
|
|
MELTING PROCESS: loop number 6 T-loop= 874.00000000000000
|
|
main_MD> interactions number 6 at Temperature= 874.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) -0.40827 0.13428 1.69769
|
|
force_rgl> df(natom) 1.15560 -0.56809 -0.40103
|
|
1255.0000 -116.13903 -110.57034 5.56869 2.52057 -110.79832 934.70851
|
|
1260.0000 -115.75535 -109.48459 6.27076 2.62189 -109.44151 978.20506
|
|
1265.0000 -114.71557 -108.36592 6.34965 2.69738 -108.43065 1025.86153
|
|
1270.0000 -116.42179 -111.13462 5.28717 2.54747 -110.43805 908.38636
|
|
1275.0000 -116.31115 -111.84866 4.46249 2.44185 -111.85240 863.12423
|
|
1280.0000 -117.42473 -112.44372 4.98101 2.41199 -112.25214 834.85444
|
|
1285.0000 -116.26049 -109.25418 7.00631 2.51786 -110.83454 899.56452
|
|
1290.0000 -115.90565 -108.90622 6.99943 2.67890 -108.67817 1034.25057
|
|
1295.0000 -116.27917 -108.97182 7.30734 2.65396 -109.01207 995.66641
|
|
1300.0000 -114.70218 -108.04511 6.65707 2.66044 -108.92529 1025.19414
|
|
1305.0000 -114.03942 -109.31688 4.72253 2.63686 -109.24102 969.22111
|
|
1310.0000 -117.29898 -112.94993 4.34905 2.48922 -111.21799 878.32429
|
|
1315.0000 -118.08308 -113.40622 4.67686 2.34162 -113.19444 782.00360
|
|
1320.0000 -117.22536 -112.64908 4.57629 2.38199 -112.65392 797.72257
|
|
1325.0000 -117.18874 -112.45821 4.73053 2.41505 -112.21127 809.40349
|
|
1330.0000 -115.98077 -111.11472 4.86605 2.43074 -112.00116 861.44851
|
|
1335.0000 -117.07170 -111.03177 6.03994 2.51710 -110.84470 907.99596
|
|
1340.0000 -117.45488 -111.72237 5.73251 2.48885 -111.22307 855.43596
|
|
1345.0000 -116.79606 -110.61779 6.17827 2.52475 -110.74234 883.45539
|
|
1350.0000 -114.91596 -109.93995 4.97601 2.56390 -110.21805 961.44080
|
|
1355.0000 -117.15369 -111.73420 5.41949 2.48719 -111.24529 838.44961
|
|
1360.0000 -118.27026 -112.76399 5.50627 2.45599 -111.66303 878.55630
|
|
1365.0000 -117.66095 -112.05550 5.60545 2.38994 -112.54752 813.35262
|
|
1370.0000 -116.50222 -110.22029 6.28194 2.45840 -111.63080 869.86890
|
|
1375.0000 -115.36449 -110.09950 5.26499 2.53725 -110.57486 923.78843
|
|
1380.0000 -115.78803 -109.76763 6.02040 2.59813 -109.75969 946.41251
|
|
1385.0000 -115.07715 -109.42190 5.65526 2.57251 -110.10273 915.99171
|
|
1390.0000 -118.24239 -112.68438 5.55800 2.48542 -111.26895 887.49385
|
|
1395.0000 -117.58360 -111.99799 5.58562 2.42866 -112.02899 835.36251
|
|
1400.0000 -115.85802 -111.11627 4.74175 2.46490 -111.54372 866.78864
|
|
1405.0000 -117.60315 -111.70805 5.89510 2.54864 -110.42235 919.27529
|
|
1410.0000 -117.44046 -110.73488 6.70558 2.47611 -111.39358 910.74213
|
|
1415.0000 -116.56177 -110.56875 5.99301 2.52716 -110.71002 885.46533
|
|
1420.0000 -116.99238 -111.16467 5.82771 2.53959 -110.54356 936.76524
|
|
1425.0000 -117.81253 -112.02376 5.78878 2.45994 -111.61017 884.47397
|
|
1430.0000 -117.41248 -111.02659 6.38589 2.43004 -112.01046 870.89277
|
|
1435.0000 -117.29362 -111.99493 5.29869 2.44769 -111.77420 884.31214
|
|
1440.0000 -115.42554 -110.91899 4.50655 2.42435 -112.08669 831.59801
|
|
1445.0000 -115.97563 -111.32965 4.64598 2.47097 -111.46248 840.41766
|
|
1450.0000 -116.87652 -111.44537 5.43116 2.48822 -111.23144 890.89934
|
|
1455.0000 -117.84341 -112.32691 5.51649 2.46873 -111.49241 887.32158
|
|
1460.0000 -116.54284 -111.08555 5.45729 2.42339 -112.09950 817.01931
|
|
1465.0000 -117.50053 -111.83170 5.66883 2.46170 -111.58657 863.12231
|
|
1470.0000 -117.04003 -111.39652 5.64351 2.45217 -111.71416 857.21768
|
|
1475.0000 -116.64361 -109.78743 6.85618 2.50364 -111.02490 872.30472
|
|
1480.0000 -118.00453 -112.79814 5.20639 2.47686 -111.38351 875.72674
|
|
1485.0000 -116.71855 -112.02215 4.69640 2.42647 -112.05827 833.84772
|
|
1490.0000 -116.64626 -110.68107 5.96518 2.47406 -111.42105 847.01843
|
|
1495.0000 -117.77116 -111.59886 6.17230 2.46128 -111.59213 846.88285
|
|
1500.0000 -117.51700 -112.11695 5.40005 2.38678 -112.58972 788.67775
|
|
MELTING PROCESS: loop number 7 T-loop= 974.00000000000000
|
|
main_MD> interactions number 7 at Temperature= 974.00000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 2.34744 -0.98456 0.01005
|
|
force_rgl> df(natom) -2.38255 0.09348 -2.42783
|
|
1505.0000 -116.14817 -110.18669 5.96147 2.52104 -110.79201 886.28217
|
|
1510.0000 -114.92029 -108.89481 6.02548 2.65917 -108.94231 986.11235
|
|
1515.0000 -117.43092 -111.03244 6.39848 2.58092 -109.99010 947.63999
|
|
1520.0000 -115.75628 -109.02555 6.73073 2.59524 -109.79834 973.39751
|
|
1525.0000 -115.45215 -109.13127 6.32088 2.68266 -108.62774 1016.70212
|
|
1530.0000 -115.36203 -108.72498 6.63706 2.71238 -108.22977 1067.81772
|
|
1535.0000 -115.98771 -109.67697 6.31073 2.64987 -109.06681 971.62204
|
|
1540.0000 -115.70179 -110.09677 5.60502 2.66318 -108.88867 988.68208
|
|
1545.0000 -115.83634 -109.55299 6.28335 2.61639 -109.51520 984.31194
|
|
1550.0000 -115.35396 -110.07207 5.28189 2.62142 -109.44783 963.58061
|
|
1555.0000 -115.92421 -110.27537 5.64884 2.54337 -110.49294 883.78318
|
|
1560.0000 -115.59040 -110.25828 5.33212 2.52478 -110.74184 891.64723
|
|
1565.0000 -116.38704 -109.28871 7.09834 2.64486 -109.13400 1029.69438
|
|
1570.0000 -114.86326 -107.11912 7.74414 2.65614 -108.98294 1029.36278
|
|
1575.0000 -114.33724 -108.53946 5.79779 2.70087 -108.38402 1044.84666
|
|
1580.0000 -115.21147 -108.34610 6.86537 2.65999 -108.93135 1014.89578
|
|
1585.0000 -115.98721 -108.96068 7.02653 2.73040 -107.98853 1053.90455
|
|
1590.0000 -116.03680 -109.64963 6.38716 2.59555 -109.79418 945.32546
|
|
1595.0000 -114.63915 -109.29005 5.34910 2.59357 -109.82077 918.24907
|
|
1600.0000 -116.73790 -111.71832 5.01957 2.56227 -110.23989 972.50870
|
|
1605.0000 -116.96168 -111.71252 5.24916 2.44328 -111.83322 851.07228
|
|
1610.0000 -115.36186 -109.35878 6.00308 2.51290 -110.90094 910.66745
|
|
1615.0000 -113.78886 -108.27978 5.50908 2.69877 -108.41207 1022.14137
|
|
1620.0000 -115.01659 -109.14116 5.87543 2.67686 -108.70539 1028.03045
|
|
1625.0000 -116.76601 -110.21554 6.55047 2.57553 -110.06232 984.25931
|
|
1630.0000 -117.36082 -112.08592 5.27490 2.53386 -110.62030 918.43411
|
|
1635.0000 -116.07124 -111.01024 5.06100 2.46892 -111.48994 825.01315
|
|
1640.0000 -116.87876 -110.35366 6.52510 2.53066 -110.66312 927.72237
|
|
1645.0000 -115.47931 -110.24308 5.23623 2.62625 -109.38319 996.81594
|
|
1650.0000 -114.94604 -108.51861 6.42743 2.69586 -108.45100 1017.93814
|
|
1655.0000 -115.12516 -108.72867 6.39650 2.67782 -108.69263 1027.55280
|
|
1660.0000 -116.74555 -110.27053 6.47502 2.63331 -109.28857 1009.52869
|
|
1665.0000 -115.55457 -109.38435 6.17021 2.60164 -109.71270 984.20273
|
|
1670.0000 -114.48476 -109.03768 5.44708 2.61643 -109.51465 977.27866
|
|
1675.0000 -115.09317 -109.33457 5.75859 2.63849 -109.21920 983.91387
|
|
1680.0000 -117.04267 -110.01214 7.03053 2.58170 -109.97969 933.30995
|
|
1685.0000 -116.21929 -110.75578 5.46351 2.59292 -109.82942 967.40290
|
|
1690.0000 -117.21662 -112.01431 5.20230 2.51931 -110.81509 895.14044
|
|
1695.0000 -115.39237 -109.88310 5.50926 2.50851 -110.95969 896.28538
|
|
1700.0000 -115.16248 -108.90876 6.25372 2.60712 -109.63937 958.81041
|
|
1705.0000 -116.80933 -111.47057 5.33876 2.60250 -109.70123 992.05211
|
|
1710.0000 -116.45133 -111.34622 5.10511 2.50788 -110.96821 901.00949
|
|
1715.0000 -115.77040 -110.27773 5.49266 2.48069 -111.33225 913.84324
|
|
1720.0000 -116.35109 -110.47984 5.87125 2.53077 -110.66162 911.92481
|
|
1725.0000 -115.67503 -107.93632 7.73871 2.64635 -109.11398 1010.74284
|
|
1730.0000 -114.69097 -107.62167 7.06930 2.73563 -107.91847 1064.43832
|
|
1735.0000 -115.24417 -108.72823 6.51594 2.66944 -108.80484 1000.36747
|
|
1740.0000 -115.06316 -107.89265 7.17051 2.68263 -108.62819 1010.88726
|
|
1745.0000 -114.87321 -110.03208 4.84112 2.60778 -109.63044 1026.39826
|
|
1750.0000 -116.77319 -110.46432 6.30887 2.58167 -109.98013 974.80892
|
|
MELTING PROCESS: loop number 8 T-loop= 1074.0000000000000
|
|
main_MD> interactions number 8 at Temperature= 1074.0000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) -1.17911 3.27438 0.10243
|
|
force_rgl> df(natom) 3.39725 -0.63935 -3.00851
|
|
1755.0000 -116.81827 -109.96380 6.85447 2.64016 -109.19682 1032.88282
|
|
1760.0000 -114.38676 -107.94863 6.43813 2.65734 -108.96682 1031.03791
|
|
1765.0000 -112.91810 -107.02954 5.88856 2.77339 -107.41284 1093.58842
|
|
1770.0000 -114.92832 -107.41792 7.51040 2.78732 -107.22631 1100.61694
|
|
1775.0000 -114.43741 -108.76452 5.67288 2.71799 -108.15475 1048.35297
|
|
1780.0000 -116.11445 -110.46593 5.64853 2.58188 -109.97722 978.14037
|
|
1785.0000 -115.09039 -108.27933 6.81105 2.66853 -108.81704 1005.22890
|
|
1790.0000 -114.25273 -108.71164 5.54109 2.68508 -108.59533 1052.92964
|
|
1795.0000 -113.44175 -106.71462 6.72713 2.79361 -107.14209 1131.01950
|
|
1800.0000 -113.45640 -106.18466 7.27174 2.79902 -107.06962 1091.57091
|
|
1805.0000 -114.14297 -105.11184 9.03113 2.81454 -106.86182 1114.28598
|
|
1810.0000 -114.64601 -106.79007 7.85594 2.88732 -105.88728 1207.69700
|
|
1815.0000 -114.02764 -108.21282 5.81483 2.71127 -108.24469 1031.33621
|
|
1820.0000 -115.81889 -109.87070 5.94819 2.70730 -108.29788 1059.23608
|
|
1825.0000 -114.94153 -109.37148 5.57005 2.61500 -109.53377 974.79045
|
|
1830.0000 -113.39647 -108.09102 5.30545 2.68324 -108.62004 1021.14353
|
|
1835.0000 -114.11715 -108.22849 5.88866 2.69788 -108.42402 1015.04665
|
|
1840.0000 -116.09038 -109.57164 6.51873 2.67449 -108.73720 1005.42556
|
|
1845.0000 -113.79690 -106.45498 7.34192 2.75147 -107.70639 1043.78765
|
|
1850.0000 -114.50656 -108.99536 5.51120 2.73028 -107.99015 1071.20847
|
|
1855.0000 -114.45242 -107.97459 6.47782 2.65771 -108.96187 994.18415
|
|
1860.0000 -112.22812 -104.89978 7.32834 2.81099 -106.90945 1129.58549
|
|
1865.0000 -111.29350 -104.54764 6.74586 2.99732 -104.41438 1248.06451
|
|
1870.0000 -114.62005 -106.73948 7.88057 2.91372 -105.53374 1220.82501
|
|
1875.0000 -113.70645 -106.47957 7.22688 2.78476 -107.26067 1074.14364
|
|
1880.0000 -115.09418 -109.03815 6.05603 2.78271 -107.28807 1094.67918
|
|
1885.0000 -114.51198 -107.70220 6.80978 2.63511 -109.26445 991.20545
|
|
1890.0000 -113.07586 -104.04044 9.03542 2.85208 -106.35914 1174.05189
|
|
1895.0000 -112.78173 -105.49823 7.28350 2.92536 -105.37793 1224.71523
|
|
1900.0000 -112.51418 -106.63033 5.88385 2.88937 -105.85982 1125.91163
|
|
1905.0000 -113.35392 -106.68402 6.66990 2.86401 -106.19941 1107.15222
|
|
1910.0000 -114.78375 -106.63735 8.14640 2.75803 -107.61857 1072.24752
|
|
1915.0000 -112.92987 -106.70318 6.22669 2.81762 -106.82061 1118.26623
|
|
1920.0000 -114.03118 -105.62346 8.40772 2.85763 -106.28479 1128.42063
|
|
1925.0000 -112.48475 -105.24760 7.23715 2.95248 -105.01476 1221.90948
|
|
1930.0000 -114.08072 -107.04007 7.04064 2.81092 -106.91032 1109.11770
|
|
1935.0000 -114.06675 -107.83375 6.23300 2.77821 -107.34826 1148.07640
|
|
1940.0000 -116.95580 -108.48936 8.46644 2.70663 -108.30677 1034.11709
|
|
1945.0000 -114.41969 -107.84197 6.57772 2.71246 -108.22869 1033.80310
|
|
1950.0000 -116.36643 -109.75777 6.60867 2.74123 -107.84354 1079.72906
|
|
1955.0000 -114.77693 -108.30955 6.46738 2.66255 -108.89704 990.01650
|
|
1960.0000 -115.32586 -108.85763 6.46824 2.67316 -108.75497 991.80560
|
|
1965.0000 -113.65431 -106.40152 7.25279 2.77413 -107.40299 1099.55942
|
|
1970.0000 -114.33021 -107.25776 7.07245 2.78962 -107.19551 1120.41159
|
|
1975.0000 -115.31391 -108.96087 6.35303 2.67395 -108.74448 1048.47972
|
|
1980.0000 -115.90063 -109.39738 6.50325 2.67596 -108.71753 1029.03029
|
|
1985.0000 -115.12722 -108.86780 6.25942 2.64320 -109.15613 994.67677
|
|
1990.0000 -115.56536 -107.15917 8.40619 2.68578 -108.58601 1043.49301
|
|
1995.0000 -115.30214 -109.27022 6.03192 2.73599 -107.91370 1033.36807
|
|
2000.0000 -115.35151 -109.04271 6.30879 2.64949 -109.07200 1035.72054
|
|
MELTING PROCESS: loop number 9 T-loop= 1174.0000000000000
|
|
main_MD> interactions number 9 at Temperature= 1174.0000000000000
|
|
force_rgl> LIMIT ON DISTANCE 0.99999991752029205 0.99999991752029205 0.99999991752029205
|
|
force_rgl> df(1) 4.71513 2.22491 1.03300
|
|
force_rgl> df(natom) 0.75851 -0.49688 -1.20403
|
|
2005.0000 -114.66957 -106.56514 8.10442 2.74077 -107.84967 1107.79452
|
|
2010.0000 -113.72769 -107.77568 5.95200 2.85156 -106.36618 1171.05537
|
|
2015.0000 -115.06407 -106.77908 8.28499 2.75938 -107.60047 1096.96200
|
|
2020.0000 -114.64165 -106.86744 7.77421 2.81735 -106.82428 1104.86641
|
|
2025.0000 -112.10051 -104.68438 7.41613 2.95291 -105.00898 1210.19266
|
|
2030.0000 -111.61350 -104.59955 7.01395 3.02693 -104.01782 1230.23917
|
|
2035.0000 -112.37865 -105.41929 6.95936 2.96585 -104.83572 1261.25794
|
|
2040.0000 -114.40189 -106.11384 8.28806 2.88697 -105.89204 1181.87249
|
|
2045.0000 -112.62803 -104.42205 8.20598 2.94347 -105.13545 1226.35217
|
|
2050.0000 -112.38995 -104.07671 8.31324 3.04295 -103.80334 1232.52250
|
|
2055.0000 -112.23024 -104.42381 7.80644 3.01773 -104.14102 1298.29083
|
|
2060.0000 -112.36146 -104.53159 7.82986 2.96502 -104.84683 1273.96727
|
|
2065.0000 -114.49645 -106.54700 7.94946 2.83779 -106.55050 1148.84967
|
|
2070.0000 -113.06485 -104.59173 8.47312 2.88244 -105.95257 1170.19717
|
|
2075.0000 -113.07581 -107.01525 6.06057 2.89840 -105.73894 1187.74422
|
|
2080.0000 -113.06246 -105.15062 7.91184 2.90331 -105.67322 1145.78655
|
|
2085.0000 -114.30053 -107.16797 7.13256 2.84999 -106.38713 1139.92981
|
|
2090.0000 -115.87251 -108.33813 7.53438 2.80945 -106.92996 1120.14648
|
|
2095.0000 -114.06402 -108.09096 5.97306 2.69644 -108.44322 1041.52329
|
|
2100.0000 -114.22155 -107.68017 6.54138 2.73946 -107.86725 1040.37294
|
|
2105.0000 -114.31467 -107.46849 6.84618 2.75352 -107.67899 1121.09325
|
|
2110.0000 -114.49778 -108.27016 6.22762 2.76933 -107.46724 1100.80112
|
|
2115.0000 -115.08672 -108.91724 6.16948 2.65507 -108.99718 1018.94778
|
|
2120.0000 -113.87091 -105.89061 7.98031 2.78239 -107.29232 1109.63172
|
|
2125.0000 -113.45424 -105.02092 8.43331 2.91994 -105.45052 1246.56822
|
|
2130.0000 -112.75960 -105.43124 7.32836 2.90665 -105.62845 1236.00486
|
|
2135.0000 -113.70955 -106.42596 7.28358 2.93960 -105.18718 1184.80030
|
|
2140.0000 -112.44470 -105.50504 6.93967 2.88134 -105.96736 1124.08722
|
|
2145.0000 -110.80029 -104.66803 6.13226 2.87978 -105.98821 1159.70914
|
|
2150.0000 -110.62219 -102.58052 8.04167 3.13232 -102.60658 1376.10921
|
|
2155.0000 -111.55535 -102.64064 8.91471 3.16616 -102.15350 1347.71970
|
|
2160.0000 -112.34879 -104.83872 7.51007 3.01810 -104.13611 1303.02822
|
|
2165.0000 -113.78534 -105.89696 7.88838 2.84335 -106.47606 1147.14696
|
|
2170.0000 -115.74061 -107.48936 8.25125 2.83111 -106.64001 1130.56509
|
|
2175.0000 -114.18469 -107.44544 6.73925 2.78816 -107.21511 1120.13796
|
|
2180.0000 -113.88237 -106.30333 7.57904 2.84267 -106.48523 1157.21385
|
|
2185.0000 -111.73792 -104.85256 6.88537 2.87616 -106.03671 1186.49575
|
|
2190.0000 -112.52285 -104.27197 8.25088 2.98269 -104.61026 1278.58947
|
|
2195.0000 -112.16346 -104.10854 8.05492 2.95722 -104.95127 1252.57173
|
|
2200.0000 -113.46687 -105.77819 7.68867 2.99356 -104.46474 1265.66539
|
|
2205.0000 -114.24753 -106.02275 8.22478 2.85163 -106.36514 1124.86647
|
|
2210.0000 -113.78779 -106.69126 7.09654 2.82591 -106.70957 1155.14041
|
|
2215.0000 -113.43336 -105.09181 8.34155 2.86429 -106.19570 1186.67180
|
|
2220.0000 -112.65867 -104.13694 8.52173 2.96385 -104.86252 1268.87900
|
|
2225.0000 -110.93299 -103.42613 7.50686 3.04231 -103.81193 1317.62645
|
|
2230.0000 -113.14090 -106.31087 6.83003 2.96156 -104.89323 1270.37931
|
|
2235.0000 -110.79599 -102.69064 8.10535 2.86891 -106.13385 1142.27459
|
|
2240.0000 -112.99324 -103.75867 9.23457 3.07042 -103.43550 1331.37180
|
|
2245.0000 -113.05643 -105.22791 7.82851 2.97001 -104.78003 1250.40640
|
|
2250.0000 -113.61472 -105.71324 7.90147 2.98318 -104.60365 1242.11386
|
|
main_MD> EXECUTION TIME: 0 [day], 0 [hour], 2 [min], 19.1893249 [s].
|
|
main_MD> Deallocating global variables
|