1LAMMPS (2 Jun 2020) 2 using 1 OpenMP thread(s) per MPI task 3# 3d EAM surface for global HD 4 5# nearest neighbor distance = a * sqrt(2)/2 = 2.77 Angs for Pt with a = 3.92 6# hop event on (100) surface is same distance 7# exchange event is 2 atoms moving same distance 8 9variable Tequil index 500.0 10variable Vmax index 0.5 11variable qfactor index 0.3 12variable cutbond index 3.2 13variable cutevent index 1.1 14variable steps index 100000 15variable nevent index 1000 16variable zoom index 1.8 17variable seed index 826626413 18variable tol index 1.0e-15 19 20units metal 21atom_style atomic 22atom_modify map array 23boundary p p p 24 25lattice fcc 3.92 26Lattice spacing in x,y,z = 3.92 3.92 3.92 27region box block 0 6 0 6 0 4 28create_box 3 box 29Created orthogonal box = (0.0 0.0 0.0) to (23.52 23.52 15.68) 30 2 by 2 by 1 MPI processor grid 31create_atoms 1 box 32Created 576 atoms 33 create_atoms CPU = 0.000 seconds 34 35mass * 1.0 36 37change_box all z final -0.1 5.0 boundary p p f 38 orthogonal box = (0.0 0.0 -0.392) to (23.52 23.52 19.6) 39WARNING: Reset image flags for non-periodic boundary (src/domain.cpp:1909) 40create_atoms 2 single 3.5 3.5 4 41Created 1 atoms 42 create_atoms CPU = 0.000 seconds 43 44# define frozen substrate and mobile atoms 45 46group adatom type 2 471 atoms in group adatom 48region base block INF INF INF INF 0 1.8 49set region base type 3 50 288 settings made for typegroup base type 3 51288 atoms in group base 52group mobile type 1 2 53289 atoms in group mobile 54 55# pair style 56 57pair_style eam/alloy 58pair_coeff * * ptvoterlammps.eam Pt Pt Pt 59 60neighbor 0.5 bin 61neigh_modify every 1 delay 5 check yes 62 63fix 1 mobile nve 64fix 2 mobile langevin ${Tequil} ${Tequil} 1.0 ${seed} zero yes 65fix 2 mobile langevin 500.0 ${Tequil} 1.0 ${seed} zero yes 66fix 2 mobile langevin 500.0 500.0 1.0 ${seed} zero yes 67fix 2 mobile langevin 500.0 500.0 1.0 826626413 zero yes 68 69timestep 0.005 70 71compute tmobile mobile temp 72 73thermo 100 74thermo_modify temp tmobile 75WARNING: Temperature for thermo pressure is not for group all (src/thermo.cpp:486) 76 77# thermal equilibration 78 79run 1000 80Neighbor list info ... 81 update every 1 steps, delay 5 steps, check yes 82 max neighbors/atom: 2000, page size: 100000 83 master list distance cutoff = 6.07583 84 ghost atom cutoff = 6.07583 85 binsize = 3.03792, bins = 8 8 7 86 1 neighbor lists, perpetual/occasional/extra = 1 0 0 87 (1) pair eam/alloy, perpetual 88 attributes: half, newton on 89 pair build: half/bin/atomonly/newton 90 stencil: half/bin/3d/newton 91 bin: standard 92Per MPI rank memory allocation (min/avg/max) = 3.328 | 3.328 | 3.328 Mbytes 93Step Temp E_pair E_mol TotEng Press 94 0 0 -3213.9136 0 -3213.9136 -51843.125 95 100 223.70164 -3209.0653 0 -3200.7375 -26575.84 96 200 345.18355 -3206.1371 0 -3193.2869 -42327.268 97 300 411.05681 -3203.8465 0 -3188.5442 -32455.226 98 400 446.05938 -3202.2976 0 -3185.6922 -35377.683 99 500 435.52439 -3200.2131 0 -3183.9999 -31477.028 100 600 474.70282 -3199.4049 0 -3181.7332 -34761.287 101 700 492.00191 -3201.1592 0 -3182.8435 -33036.989 102 800 440.88631 -3198.37 0 -3181.9572 -34669.762 103 900 475.14414 -3198.5845 0 -3180.8964 -31191.883 104 1000 476.87852 -3197.3442 0 -3179.5914 -33731.074 105Loop time of 0.195228 on 4 procs for 1000 steps with 577 atoms 106 107Performance: 2212.801 ns/day, 0.011 hours/ns, 5122.224 timesteps/s 10890.5% CPU use with 4 MPI tasks x 1 OpenMP threads 109 110MPI task timing breakdown: 111Section | min time | avg time | max time |%varavg| %total 112--------------------------------------------------------------- 113Pair | 0.14588 | 0.14716 | 0.14992 | 0.4 | 75.38 114Neigh | 0.009866 | 0.0099873 | 0.010199 | 0.1 | 5.12 115Comm | 0.022859 | 0.024568 | 0.027702 | 1.2 | 12.58 116Output | 0.00011969 | 0.0004012 | 0.0012434 | 0.0 | 0.21 117Modify | 0.0075953 | 0.010694 | 0.013921 | 2.6 | 5.48 118Other | | 0.002417 | | | 1.24 119 120Nlocal: 144.25 ave 147 max 141 min 121Histogram: 1 0 0 1 0 0 0 0 1 1 122Nghost: 527.5 ave 533 max 523 min 123Histogram: 1 0 0 0 2 0 0 0 0 1 124Neighs: 3477.25 ave 3585 max 3399 min 125Histogram: 1 0 1 0 1 0 0 0 0 1 126 127Total # of neighbors = 13909 128Ave neighs/atom = 24.1057 129Neighbor list builds = 91 130Dangerous builds = 0 131reset_timestep 0 132 133# pin base so will not move during quenches 134 135fix freeze base setforce 0.0 0.0 0.0 136 137# event detection 138 139compute event all event/displace ${cutevent} 140compute event all event/displace 1.1 141 142# hyper/global 143 144fix HG mobile hyper/global ${cutbond} ${qfactor} ${Vmax} ${Tequil} 145fix HG mobile hyper/global 3.2 ${qfactor} ${Vmax} ${Tequil} 146fix HG mobile hyper/global 3.2 0.3 ${Vmax} ${Tequil} 147fix HG mobile hyper/global 3.2 0.3 0.5 ${Tequil} 148fix HG mobile hyper/global 3.2 0.3 0.5 500.0 149 150# thermo output 151 152thermo_style custom step temp pe f_HG f_HG[*] 153WARNING: New thermo_style command, previous thermo_modify settings will be lost (src/output.cpp:709) 154 155thermo_modify lost ignore 156thermo_modify temp tmobile 157WARNING: Temperature for thermo pressure is not for group all (src/thermo.cpp:486) 158 159thermo ${nevent} 160thermo 1000 161 162# dump output options 163 164region substrate block INF INF INF INF 1.8 3.8 165region adatoms block INF INF INF INF 3.8 INF 166variable acolor atom rmask(base)+2*rmask(substrate)+3*rmask(adatoms) 167 168dump 1 all image 1000000 global.*.jpg v_acolor type zoom ${zoom} adiam 2.5 view 0.0 0.0 up 0 1 0 axes yes 0.9 0.01 169dump 1 all image 1000000 global.*.jpg v_acolor type zoom 1.8 adiam 2.5 view 0.0 0.0 up 0 1 0 axes yes 0.9 0.01 170dump_modify 1 pad 6 amap 1 3 sa 1 3 blue red green 171 172# run 173 174hyper ${steps} ${nevent} HG event min ${tol} ${tol} 1000 1000 dump 1 175hyper 100000 ${nevent} HG event min ${tol} ${tol} 1000 1000 dump 1 176hyper 100000 1000 HG event min ${tol} ${tol} 1000 1000 dump 1 177hyper 100000 1000 HG event min 1.0e-15 ${tol} 1000 1000 dump 1 178hyper 100000 1000 HG event min 1.0e-15 1.0e-15 1000 1000 dump 1 179WARNING: Resetting reneighboring criteria during hyper (src/REPLICA/hyper.cpp:131) 180Neighbor list info ... 181 update every 1 steps, delay 0 steps, check yes 182 max neighbors/atom: 2000, page size: 100000 183 master list distance cutoff = 6.07583 184 ghost atom cutoff = 6.07583 185 binsize = 3.03792, bins = 8 8 7 186 2 neighbor lists, perpetual/occasional/extra = 1 1 0 187 (1) pair eam/alloy, perpetual 188 attributes: half, newton on 189 pair build: half/bin/atomonly/newton 190 stencil: half/bin/3d/newton 191 bin: standard 192 (2) fix hyper/global, occasional, copy from (1) 193 attributes: half, newton on 194 pair build: copy 195 stencil: none 196 bin: none 197Per MPI rank memory allocation (min/avg/max) = 6.015 | 6.015 | 6.015 Mbytes 198Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 199 0 476.87852 -3197.3442 0 0 0 0 0 0 0 0 0 0 0 0 0 200 53 476.87852 -3217.9192 0 0 0 0 0 0 0 0 0 0 0 0 0 201Loop time of 0.016781 on 4 procs for 53 steps with 577 atoms 202 203Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 204 0 476.87852 -3197.3442 0.33187212 2213.7063 0.17396269 129 131 5.9965398 0 0 0 3.3552688 0 0 0 205 1000 487.34979 -3198.3697 0.19401776 90.283981 0.23468448 543 548 5.9965398 0.165 0 0 3.9974111 6134.6092 0 0 206Loop time of 0.145301 on 4 procs for 1000 steps with 577 atoms 207 208Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 209 1000 487.34979 -3198.3697 0.19401776 90.283981 0.23468448 543 548 5.9965398 0.165 0 0 3.9974111 6134.6092 0 0 210 1059 487.34979 -3217.9192 0.19401776 90.283981 0.23468448 543 548 5.9965398 0.15580737 0 0 3.9974111 6134.6092 0 0 211Loop time of 0.0201806 on 4 procs for 59 steps with 577 atoms 212 213Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 214 1000 487.34979 -3198.3697 0.19401776 90.283981 0.23468448 543 548 5.9965398 0.165 0 0 3.9974111 6134.6092 0 0 215 2000 522.93873 -3197.4748 0.1540961 35.745266 0.24952495 120 131 5.9965398 0.1645 0 0 4.0370436 10213.644 0 0 216Loop time of 0.147897 on 4 procs for 1000 steps with 577 atoms 217 218Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 219 2000 522.93873 -3197.4748 0.1540961 35.745266 0.24952495 120 131 5.9965398 0.1645 0 0 4.0370436 10213.644 0 0 220 2058 522.93873 -3217.9192 0.1540961 35.745266 0.24952495 120 131 5.9965398 0.15986395 0 0 4.0370436 10213.644 0 0 221Loop time of 0.0195917 on 4 procs for 58 steps with 577 atoms 222 223Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 224 2000 522.93873 -3197.4748 0.1540961 35.745266 0.24952495 120 131 5.9965398 0.1645 0 0 4.0370436 10213.644 0 0 225 3000 485.3853 -3198.0446 0.081070283 6.5637429 0.27460399 120 131 5.9965398 0.145 0 0 4.0370436 13331.739 0 0 226Loop time of 0.147192 on 4 procs for 1000 steps with 577 atoms 227 228Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 229 3000 485.3853 -3198.0446 0.081070283 6.5637429 0.27460399 120 131 5.9965398 0.145 0 0 4.0370436 13331.739 0 0 230 3061 485.3853 -3217.9192 0.081070283 6.5637429 0.27460399 120 131 5.9965398 0.14211042 0 0 4.0370436 13331.739 0 0 231Loop time of 0.0219681 on 4 procs for 61 steps with 577 atoms 232 233Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 234 3000 485.3853 -3198.0446 0.081070283 6.5637429 0.27460399 120 131 5.9965398 0.145 0 0 4.0370436 13331.739 0 0 235 4000 518.88739 -3198.6269 0 1 0.33014438 548 555 5.9965398 0.1715 0 0 4.0370436 14346.606 0 0 236Loop time of 0.146592 on 4 procs for 1000 steps with 577 atoms 237 238Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 239 4000 518.88739 -3198.6269 0 1 0.33014438 548 555 5.9965398 0.1715 0 0 4.0370436 14346.606 0 0 240 4057 518.88739 -3217.9192 0 1 0.33014438 548 555 5.9965398 0.16909046 0 0 4.0370436 14346.606 0 0 241Loop time of 0.0203461 on 4 procs for 57 steps with 577 atoms 242 243Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 244 4000 518.88739 -3198.6269 0 1 0.33014438 548 555 5.9965398 0.1715 0 0 4.0370436 14346.606 0 0 245 5000 514.60377 -3197.5544 0.049185081 3.131578 0.28486257 283 288 5.9965398 0.2044 0 0 4.0370436 15492.612 0 0 246Loop time of 0.146422 on 4 procs for 1000 steps with 577 atoms 247 248Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 249 5000 514.60377 -3197.5544 0.049185081 3.131578 0.28486257 283 288 5.9965398 0.2044 0 0 4.0370436 15492.612 0 0 250 5052 514.60377 -3217.9192 0.049185081 3.131578 0.28486257 283 288 5.9965398 0.20229612 0 0 4.0370436 15492.612 0 0 251Loop time of 0.0185522 on 4 procs for 52 steps with 577 atoms 252 253Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 254 5000 514.60377 -3197.5544 0.049185081 3.131578 0.28486257 283 288 5.9965398 0.2044 0 0 4.0370436 15492.612 0 0 255 6000 506.58554 -3198.6556 0.030839451 2.0457268 0.29060093 543 544 5.9965398 0.19533333 0 0 4.0370436 19375.801 0 0 256Loop time of 0.152313 on 4 procs for 1000 steps with 577 atoms 257 258Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 259 6000 506.58554 -3198.6556 0.030839451 2.0457268 0.29060093 543 544 5.9965398 0.19533333 0 0 4.0370436 19375.801 0 0 260 6059 506.58554 -3217.9192 0.030839451 2.0457268 0.29060093 543 544 5.9965398 0.19343126 0 0 4.0370436 19375.801 0 0 261Loop time of 0.0202745 on 4 procs for 59 steps with 577 atoms 262 263Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 264 6000 506.58554 -3198.6556 0.030839451 2.0457268 0.29060093 543 544 5.9965398 0.19533333 0 0 4.0370436 19375.801 0 0 265 7000 501.46891 -3198.8168 0.19756174 98.024002 0.23332142 404 411 5.9965398 0.19728571 0 0 4.0370436 20874.431 0 0 266Loop time of 0.146604 on 4 procs for 1000 steps with 577 atoms 267 268Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 269 7000 501.46891 -3198.8168 0.19756174 98.024002 0.23332142 404 411 5.9965398 0.19728571 0 0 4.0370436 20874.431 0 0 270 7061 501.46891 -3217.9192 0.19756174 98.024002 0.23332142 404 411 5.9965398 0.19558136 0 0 4.0370436 20874.431 0 0 271Loop time of 0.0208374 on 4 procs for 61 steps with 577 atoms 272 273Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 274 7000 501.46891 -3198.8168 0.19756174 98.024002 0.23332142 404 411 5.9965398 0.19728571 0 0 4.0370436 20874.431 0 0 275 8000 554.51151 -3197.0193 0.14419359 28.405722 0.25307144 566 567 5.9965398 0.191125 0 0 4.0370436 23877.855 0 0 276Loop time of 0.14606 on 4 procs for 1000 steps with 577 atoms 277 278Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 279 8000 554.51151 -3197.0193 0.14419359 28.405722 0.25307144 566 567 5.9965398 0.191125 0 0 4.0370436 23877.855 0 0 280 8060 554.51151 -3217.9192 0.14419359 28.405722 0.25307144 566 567 5.9965398 0.18970223 0 0 4.0370436 23877.855 0 0 281Loop time of 0.0208338 on 4 procs for 60 steps with 577 atoms 282 283Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 284 8000 554.51151 -3197.0193 0.14419359 28.405722 0.25307144 566 567 5.9965398 0.191125 0 0 4.0370436 23877.855 0 0 285 9000 463.4842 -3196.912 0.21724312 154.77893 0.22560194 268 279 5.9965398 0.19755556 0 0 4.0370436 25828.393 0 0 286Loop time of 0.146869 on 4 procs for 1000 steps with 577 atoms 287 288Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 289 9000 463.4842 -3196.912 0.21724312 154.77893 0.22560194 268 279 5.9965398 0.19755556 0 0 4.0370436 25828.393 0 0 290 9058 463.4842 -3217.9192 0.21724312 154.77893 0.22560194 268 279 5.9965398 0.19629057 0 0 4.0370436 25828.393 0 0 291Loop time of 0.020185 on 4 procs for 58 steps with 577 atoms 292 293Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 294 9000 463.4842 -3196.912 0.21724312 154.77893 0.22560194 268 279 5.9965398 0.19755556 0 0 4.0370436 25828.393 0 0 295 10000 522.84322 -3198.0918 0.14965464 32.244128 0.25112181 400 411 5.9965398 0.1939 0 0 4.0593269 33904.005 0 0 296Loop time of 0.145414 on 4 procs for 1000 steps with 577 atoms 297 298Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 299 10000 522.84322 -3198.0918 0.14965464 32.244128 0.25112181 400 411 5.9965398 0.1939 0 0 4.0593269 33904.005 0 0 300 10054 522.84322 -3217.9192 0.14965464 32.244128 0.25112181 400 411 5.9965398 0.19285856 0 0 4.0593269 33904.005 0 0 301Loop time of 0.0188997 on 4 procs for 54 steps with 577 atoms 302 303Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 304 10000 522.84322 -3198.0918 0.14965464 32.244128 0.25112181 400 411 5.9965398 0.1939 0 0 4.0593269 33904.005 0 0 305 11000 496.84666 -3197.603 0.099165645 9.9895191 0.26860786 566 567 5.9965398 0.18272727 0 0 4.0593269 42381.675 0 0 306Loop time of 0.147122 on 4 procs for 1000 steps with 577 atoms 307 308Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 309 11000 496.84666 -3197.603 0.099165645 9.9895191 0.26860786 566 567 5.9965398 0.18272727 0 0 4.0593269 42381.675 0 0 310 11052 496.84666 -3217.9192 0.099165645 9.9895191 0.26860786 566 567 5.9965398 0.18186754 0 0 4.0593269 42381.675 0 0 311Loop time of 0.01815 on 4 procs for 52 steps with 577 atoms 312 313Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 314 11000 496.84666 -3197.603 0.099165645 9.9895191 0.26860786 566 567 5.9965398 0.18272727 0 0 4.0593269 42381.675 0 0 315 12000 505.35386 -3197.4499 0 1 0.3380327 543 544 5.9965398 0.1845 0 0 4.0593269 45849.92 0 0 316Loop time of 0.149886 on 4 procs for 1000 steps with 577 atoms 317 318Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 319 12000 505.35386 -3197.4499 0 1 0.3380327 543 544 5.9965398 0.1845 0 0 4.0593269 45849.92 0 0 320 12062 505.35386 -3217.9192 0 1 0.3380327 543 544 5.9965398 0.18355165 0 0 4.0593269 45849.92 0 0 321Loop time of 0.021822 on 4 procs for 62 steps with 577 atoms 322 323Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 324 12000 505.35386 -3197.4499 0 1 0.3380327 543 544 5.9965398 0.1845 0 0 4.0593269 45849.92 0 0 325 13000 480.8416 -3198.2763 0.309288 1310.6367 0.1852786 400 411 5.9965398 0.18761538 0 0 4.0593269 47530.263 0 0 326Loop time of 0.149809 on 4 procs for 1000 steps with 577 atoms 327 328Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 329 13000 480.8416 -3198.2763 0.309288 1310.6367 0.1852786 400 411 5.9965398 0.18761538 0 0 4.0593269 47530.263 0 0 330 13059 480.8416 -3217.9192 0.309288 1310.6367 0.1852786 400 411 5.9965398 0.18676775 0 0 4.0593269 47530.263 0 0 331Loop time of 0.0209084 on 4 procs for 59 steps with 577 atoms 332 333Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 334 13000 480.8416 -3198.2763 0.309288 1310.6367 0.1852786 400 411 5.9965398 0.18761538 0 0 4.0593269 47530.263 0 0 335 14000 500.22368 -3198.4114 0.29111143 859.54923 0.19390705 283 276 5.9965398 0.18785714 0 0 4.0593269 53252.052 0 0 336Loop time of 0.145794 on 4 procs for 1000 steps with 577 atoms 337 338Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 339 14000 500.22368 -3198.4114 0.29111143 859.54923 0.19390705 283 276 5.9965398 0.18785714 0 0 4.0593269 53252.052 0 0 340 14055 500.22368 -3217.9192 0.29111143 859.54923 0.19390705 283 276 5.9965398 0.18712202 0 0 4.0593269 53252.052 0 0 341Loop time of 0.0188122 on 4 procs for 55 steps with 577 atoms 342 343Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 344 14000 500.22368 -3198.4114 0.29111143 859.54923 0.19390705 283 276 5.9965398 0.18785714 0 0 4.0593269 53252.052 0 0 345 15000 538.71132 -3198.8617 0.3801243 6783.9082 0.14689325 44 77 5.9965398 0.18586667 0 0 4.0593269 57737.583 0 0 346Loop time of 0.147841 on 4 procs for 1000 steps with 577 atoms 347 348Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 349 15000 538.71132 -3198.8617 0.3801243 6783.9082 0.14689325 44 77 5.9965398 0.18586667 0 0 4.0593269 57737.583 0 0 350 15057 538.71132 -3217.9192 0.3801243 6783.9082 0.14689325 44 77 5.9965398 0.18516305 0 0 4.0593269 57737.583 0 0 351Loop time of 0.0198176 on 4 procs for 57 steps with 577 atoms 352 353Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 354 15000 538.71132 -3198.8617 0.3801243 6783.9082 0.14689325 44 77 5.9965398 0.18586667 0 0 4.0593269 57737.583 0 0 355 16000 543.33859 -3199.9956 0.19111474 84.401396 0.23579514 132 139 5.9965398 0.181125 0 0 4.0593269 63865.395 0 0 356Loop time of 0.146735 on 4 procs for 1000 steps with 577 atoms 357 358Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 359 16000 543.33859 -3199.9956 0.19111474 84.401396 0.23579514 132 139 5.9965398 0.181125 0 0 4.0593269 63865.395 0 0 360 16055 543.33859 -3217.9192 0.19111474 84.401396 0.23579514 132 139 5.9965398 0.18050452 0 0 4.0593269 63865.395 0 0 361Loop time of 0.0192626 on 4 procs for 55 steps with 577 atoms 362 363Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 364 16000 543.33859 -3199.9956 0.19111474 84.401396 0.23579514 132 139 5.9965398 0.181125 0 0 4.0593269 63865.395 0 0 365 17000 490.07066 -3199.3253 0 1 0.5532913 542 548 5.9965398 0.18670588 0.00011764706 0 4.3314109 65817.26 0 0 366Loop time of 0.149352 on 4 procs for 1000 steps with 577 atoms 367 368Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 369 17000 490.07066 -3199.3253 0 1 0.5532913 542 548 5.9965398 0.18670588 0.00011764706 0 4.3314109 65817.26 0 0 370 17062 490.07066 -3217.9192 0 1 0.5532913 542 548 5.9965398 0.18602743 0.00011721955 0 4.3314109 65817.26 0 0 371Loop time of 0.0210718 on 4 procs for 62 steps with 577 atoms 372 373Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 374 17000 490.07066 -3199.3253 0 1 0.37750286 546 577 5.9965398 0.18670588 0.00011764706 2.3326658 4.3314109 65817.26 1 2 375 18000 505.37149 -3196.5764 0.05904738 3.9370481 0.28172943 577 559 5.9965398 0.1985 0.00011111111 2.3326658 4.3314109 66073.732 1 2 376Loop time of 0.1473 on 4 procs for 1000 steps with 577 atoms 377 378Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 379 18000 505.37149 -3196.5764 0.05904738 3.9370481 0.28172943 577 559 5.9965398 0.1985 0.00011111111 2.3326658 4.3314109 66073.732 1 2 380 18054 505.37149 -3217.9192 0.05904738 3.9370481 0.28172943 577 559 5.9965398 0.19790628 0.00011077877 2.3326658 4.3314109 66073.732 1 2 381Loop time of 0.0193232 on 4 procs for 54 steps with 577 atoms 382 383Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 384 18000 505.37149 -3196.5764 0.05904738 3.9370481 0.28172943 577 559 5.9965398 0.1985 0.00011111111 2.3326658 4.3314109 66073.732 1 2 385 19000 503.43264 -3199.2564 0.34097427 2734.4218 0.16918815 120 131 5.9965398 0.20194737 0.00010526316 2.3326658 4.3314109 67732.221 1 2 386Loop time of 0.151556 on 4 procs for 1000 steps with 577 atoms 387 388Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 389 19000 503.43264 -3199.2564 0.34097427 2734.4218 0.16918815 120 131 5.9965398 0.20194737 0.00010526316 2.3326658 4.3314109 67732.221 1 2 390 19051 503.43264 -3217.9192 0.34097427 2734.4218 0.16918815 120 131 5.9965398 0.20140675 0.00010498137 2.3326658 4.3314109 67732.221 1 2 391Loop time of 0.0205157 on 4 procs for 51 steps with 577 atoms 392 393Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 394 19000 503.43264 -3199.2564 0.34097427 2734.4218 0.16918815 120 131 5.9965398 0.20194737 0.00010526316 2.3326658 4.3314109 67732.221 1 2 395 20000 559.61766 -3198.5969 0.16649032 47.659186 0.24501376 547 577 5.9965398 0.199 0.0001 2.3326658 4.3314109 69744.058 1 2 396Loop time of 0.156098 on 4 procs for 1000 steps with 577 atoms 397 398Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 399 20000 559.61766 -3198.5969 0.16649032 47.659186 0.24501376 547 577 5.9965398 0.199 0.0001 2.3326658 4.3314109 69744.058 1 2 400 20053 559.61766 -3217.9192 0.16649032 47.659186 0.24501376 547 577 5.9965398 0.19847404 9.97357e-05 2.3326658 4.3314109 69744.058 1 2 401Loop time of 0.0182987 on 4 procs for 53 steps with 577 atoms 402 403Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 404 20000 559.61766 -3198.5969 0.16649032 47.659186 0.24501376 547 577 5.9965398 0.199 0.0001 2.3326658 4.3314109 69744.058 1 2 405 21000 503.72669 -3199.3736 0.012368068 1.3324917 0.29626635 422 428 5.9965398 0.20119048 9.5238095e-05 2.3326658 4.3314109 71770.464 1 2 406Loop time of 0.154307 on 4 procs for 1000 steps with 577 atoms 407 408Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 409 21000 503.72669 -3199.3736 0.012368068 1.3324917 0.29626635 422 428 5.9965398 0.20119048 9.5238095e-05 2.3326658 4.3314109 71770.464 1 2 410 21058 503.72669 -3217.9192 0.012368068 1.3324917 0.29626635 422 428 5.9965398 0.20063634 9.4975781e-05 2.3326658 4.3314109 71770.464 1 2 411Loop time of 0.0207435 on 4 procs for 58 steps with 577 atoms 412 413Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 414 21000 503.72669 -3199.3736 0.012368068 1.3324917 0.29626635 422 428 5.9965398 0.20119048 9.5238095e-05 2.3326658 4.3314109 71770.464 1 2 415 22000 486.98754 -3197.1447 0.23977869 261.13202 0.21642513 279 272 5.9965398 0.19681818 9.0909091e-05 2.3326658 4.3314109 75656.753 1 2 416Loop time of 0.157122 on 4 procs for 1000 steps with 577 atoms 417 418Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 419 22000 486.98754 -3197.1447 0.23977869 261.13202 0.21642513 279 272 5.9965398 0.19681818 9.0909091e-05 2.3326658 4.3314109 75656.753 1 2 420 22058 486.98754 -3217.9192 0.23977869 261.13202 0.21642513 279 272 5.9965398 0.19630066 9.0670052e-05 2.3326658 4.3314109 75656.753 1 2 421Loop time of 0.0203064 on 4 procs for 58 steps with 577 atoms 422 423Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 424 22000 486.98754 -3197.1447 0.23977869 261.13202 0.21642513 279 272 5.9965398 0.19681818 9.0909091e-05 2.3326658 4.3314109 75656.753 1 2 425 23000 511.33335 -3198.5706 0 1 0.30898744 559 552 5.9965398 0.19234783 8.6956522e-05 2.3326658 4.3314109 82685.638 1 2 426Loop time of 0.174749 on 4 procs for 1000 steps with 577 atoms 427 428Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 429 23000 511.33335 -3198.5706 0 1 0.30898744 559 552 5.9965398 0.19234783 8.6956522e-05 2.3326658 4.3314109 82685.638 1 2 430 23061 511.33335 -3217.9192 0 1 0.30898744 559 552 5.9965398 0.19183904 8.6726508e-05 2.3326658 4.3314109 82685.638 1 2 431Loop time of 0.0211805 on 4 procs for 61 steps with 577 atoms 432 433Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 434 23000 511.33335 -3198.5706 0 1 0.30898744 559 552 5.9965398 0.19234783 8.6956522e-05 2.3326658 4.3314109 82685.638 1 2 435 24000 439.83658 -3199.3369 0.11373595 14.008983 0.26368073 559 552 5.9965398 0.19383333 8.3333333e-05 2.3326658 4.3314109 86916.692 1 2 436Loop time of 0.153472 on 4 procs for 1000 steps with 577 atoms 437 438Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 439 24000 439.83658 -3199.3369 0.11373595 14.008983 0.26368073 559 552 5.9965398 0.19383333 8.3333333e-05 2.3326658 4.3314109 86916.692 1 2 440 24058 439.83658 -3217.9192 0.11373595 14.008983 0.26368073 559 552 5.9965398 0.19336603 8.313243e-05 2.3326658 4.3314109 86916.692 1 2 441Loop time of 0.020292 on 4 procs for 58 steps with 577 atoms 442 443Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 444 24000 439.83658 -3199.3369 0.11373595 14.008983 0.26368073 559 552 5.9965398 0.19383333 8.3333333e-05 2.3326658 4.3314109 86916.692 1 2 445 25000 482.02958 -3198.1109 0.063469298 4.3625623 0.28031326 542 555 5.9965398 0.20524 8e-05 2.3326658 4.3314109 87784.27 1 2 446Loop time of 0.148144 on 4 procs for 1000 steps with 577 atoms 447 448Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 449 25000 482.02958 -3198.1109 0.063469298 4.3625623 0.28031326 542 555 5.9965398 0.20524 8e-05 2.3326658 4.3314109 87784.27 1 2 450 25059 482.02958 -3217.9192 0.063469298 4.3625623 0.28031326 542 555 5.9965398 0.20475677 7.9811645e-05 2.3326658 4.3314109 87784.27 1 2 451Loop time of 0.0205369 on 4 procs for 59 steps with 577 atoms 452 453Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 454 25000 482.02958 -3198.1109 0.063469298 4.3625623 0.28031326 542 555 5.9965398 0.20524 8e-05 2.3326658 4.3314109 87784.27 1 2 455 26000 486.52764 -3198.3906 0.116385 14.89731 0.262775 397 400 5.9965398 0.20761538 7.6923077e-05 2.3326658 4.3314109 91753.377 1 2 456Loop time of 0.14674 on 4 procs for 1000 steps with 577 atoms 457 458Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 459 26000 486.52764 -3198.3906 0.116385 14.89731 0.262775 397 400 5.9965398 0.20761538 7.6923077e-05 2.3326658 4.3314109 91753.377 1 2 460 26053 486.52764 -3217.9192 0.116385 14.89731 0.262775 397 400 5.9965398 0.20719303 7.6766591e-05 2.3326658 4.3314109 91753.377 1 2 461Loop time of 0.0185652 on 4 procs for 53 steps with 577 atoms 462 463Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 464 26000 486.52764 -3198.3906 0.116385 14.89731 0.262775 397 400 5.9965398 0.20761538 7.6923077e-05 2.3326658 4.3314109 91753.377 1 2 465 27000 491.56858 -3198.0209 0.10940684 12.669841 0.26515424 547 577 5.9965398 0.20855556 7.4074074e-05 2.3326658 4.3314109 94297.122 1 2 466Loop time of 0.14728 on 4 procs for 1000 steps with 577 atoms 467 468Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 469 27000 491.56858 -3198.0209 0.10940684 12.669841 0.26515424 547 577 5.9965398 0.20855556 7.4074074e-05 2.3326658 4.3314109 94297.122 1 2 470 27056 491.56858 -3217.9192 0.10940684 12.669841 0.26515424 547 577 5.9965398 0.20812389 7.3920757e-05 2.3326658 4.3314109 94297.122 1 2 471Loop time of 0.0191085 on 4 procs for 56 steps with 577 atoms 472 473Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 474 27000 491.56858 -3198.0209 0.10940684 12.669841 0.26515424 547 577 5.9965398 0.20855556 7.4074074e-05 2.3326658 4.3314109 94297.122 1 2 475 28000 519.4954 -3196.0664 0.025007775 1.7867632 0.29240144 577 559 5.9965398 0.21421429 7.1428571e-05 2.3326658 4.3314109 94378.053 1 2 476Loop time of 0.146811 on 4 procs for 1000 steps with 577 atoms 477 478Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 479 28000 519.4954 -3196.0664 0.025007775 1.7867632 0.29240144 577 559 5.9965398 0.21421429 7.1428571e-05 2.3326658 4.3314109 94378.053 1 2 480 28060 519.4954 -3217.9192 0.025007775 1.7867632 0.29240144 577 559 5.9965398 0.21375624 7.1275837e-05 2.3326658 4.3314109 94378.053 1 2 481Loop time of 0.0211228 on 4 procs for 60 steps with 577 atoms 482 483Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 484 28000 519.4954 -3196.0664 0.025007775 1.7867632 0.29240144 577 559 5.9965398 0.21421429 7.1428571e-05 2.3326658 4.3314109 94378.053 1 2 485 29000 454.14475 -3200.2181 0.36135143 4387.9126 0.15797703 265 562 5.9965398 0.22003448 6.8965517e-05 2.3326658 4.3314109 95605.534 1 2 486Loop time of 0.149433 on 4 procs for 1000 steps with 577 atoms 487 488Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 489 29000 454.14475 -3200.2181 0.36135143 4387.9126 0.15797703 265 562 5.9965398 0.22003448 6.8965517e-05 2.3326658 4.3314109 95605.534 1 2 490 29053 454.14475 -3217.9192 0.36135143 4387.9126 0.15797703 265 562 5.9965398 0.21963308 6.8839707e-05 2.3326658 4.3314109 95605.534 1 2 491Loop time of 0.0191249 on 4 procs for 53 steps with 577 atoms 492 493Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 494 29000 454.14475 -3200.2181 0.36135143 4387.9126 0.15797703 265 562 5.9965398 0.22003448 6.8965517e-05 2.3326658 4.3314109 95605.534 1 2 495 30000 463.0948 -3197.3905 0.065836434 4.6089425 0.27955222 281 279 5.9965398 0.21493333 6.6666667e-05 2.3326658 4.3314109 104759.4 1 2 496Loop time of 0.145204 on 4 procs for 1000 steps with 577 atoms 497 498Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 499 30000 463.0948 -3197.3905 0.065836434 4.6089425 0.27955222 281 279 5.9965398 0.21493333 6.6666667e-05 2.3326658 4.3314109 104759.4 1 2 500 30057 463.0948 -3217.9192 0.065836434 4.6089425 0.27955222 281 279 5.9965398 0.21452573 6.654024e-05 2.3326658 4.3314109 104759.4 1 2 501Loop time of 0.0197849 on 4 procs for 57 steps with 577 atoms 502 503Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 504 30000 463.0948 -3197.3905 0.065836434 4.6089425 0.27955222 281 279 5.9965398 0.21493333 6.6666667e-05 2.3326658 4.3314109 104759.4 1 2 505 31000 470.20997 -3198.7725 0.30650691 1228.7122 0.18662464 116 123 5.9965398 0.21122581 0.00022580645 2.3326658 4.3314109 107768.77 1 2 506Loop time of 0.149046 on 4 procs for 1000 steps with 577 atoms 507 508Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 509 31000 470.20997 -3198.7725 0.30650691 1228.7122 0.18662464 116 123 5.9965398 0.21122581 0.00022580645 2.3326658 4.3314109 107768.77 1 2 510 31053 470.20997 -3217.9192 0.30650691 1228.7122 0.18662464 116 123 5.9965398 0.21086529 0.00022542105 2.3326658 4.3314109 107768.77 1 2 511Loop time of 0.0194628 on 4 procs for 53 steps with 577 atoms 512 513Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 514 31000 470.20997 -3198.7725 0.30650691 1228.7122 0.18662464 116 123 5.9965398 0.21122581 0.00022580645 2.3326658 4.3314109 107768.77 1 2 515 32000 467.3025 -3198.6724 0.20477341 115.88383 0.23052285 560 571 5.9965398 0.20815625 0.00021875 2.3326658 4.3314109 112711.61 1 2 516Loop time of 0.146647 on 4 procs for 1000 steps with 577 atoms 517 518Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 519 32000 467.3025 -3198.6724 0.20477341 115.88383 0.23052285 560 571 5.9965398 0.20815625 0.00021875 2.3326658 4.3314109 112711.61 1 2 520 32053 467.3025 -3217.9192 0.20477341 115.88383 0.23052285 560 571 5.9965398 0.20781206 0.00021838829 2.3326658 4.3314109 112711.61 1 2 521Loop time of 0.0189477 on 4 procs for 53 steps with 577 atoms 522 523Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 524 32000 467.3025 -3198.6724 0.20477341 115.88383 0.23052285 560 571 5.9965398 0.20815625 0.00021875 2.3326658 4.3314109 112711.61 1 2 525 33000 492.40434 -3197.9325 0.30066167 1072.8346 0.18942254 283 288 5.9965398 0.20536364 0.00021212121 2.3326658 4.3314109 118244.09 1 2 526Loop time of 0.14777 on 4 procs for 1000 steps with 577 atoms 527 528Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 529 33000 492.40434 -3197.9325 0.30066167 1072.8346 0.18942254 283 288 5.9965398 0.20536364 0.00021212121 2.3326658 4.3314109 118244.09 1 2 530 33052 492.40434 -3217.9192 0.30066167 1072.8346 0.18942254 283 288 5.9965398 0.20504054 0.00021178749 2.3326658 4.3314109 118244.09 1 2 531Loop time of 0.0184236 on 4 procs for 52 steps with 577 atoms 532 533Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 534 33000 492.40434 -3197.9325 0.30066167 1072.8346 0.18942254 283 288 5.9965398 0.20536364 0.00021212121 2.3326658 4.3314109 118244.09 1 2 535 34000 486.83952 -3198.5172 0.20144987 107.28106 0.23181679 264 275 5.9965398 0.20773529 0.00020588235 2.3326658 4.3314109 121750.06 1 2 536Loop time of 0.147566 on 4 procs for 1000 steps with 577 atoms 537 538Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 539 34000 486.83952 -3198.5172 0.20144987 107.28106 0.23181679 264 275 5.9965398 0.20773529 0.00020588235 2.3326658 4.3314109 121750.06 1 2 540 34053 486.83952 -3217.9192 0.20144987 107.28106 0.23181679 264 275 5.9965398 0.20741198 0.00020556192 2.3326658 4.3314109 121750.06 1 2 541Loop time of 0.0189959 on 4 procs for 53 steps with 577 atoms 542 543Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 544 34000 486.83952 -3198.5172 0.20144987 107.28106 0.23181679 264 275 5.9965398 0.20773529 0.00020588235 2.3326658 4.3314109 121750.06 1 2 545 35000 541.61221 -3198.9881 0.33208019 2224.4219 0.17385502 85 383 5.9965398 0.20451429 0.0002 2.3326658 4.3314109 125636.89 1 2 546Loop time of 0.150541 on 4 procs for 1000 steps with 577 atoms 547 548Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 549 35000 541.61221 -3198.9881 0.33208019 2224.4219 0.17385502 85 383 5.9965398 0.20451429 0.0002 2.3326658 4.3314109 125636.89 1 2 550 35053 541.61221 -3217.9192 0.33208019 2224.4219 0.17385502 85 383 5.9965398 0.20420506 0.0001996976 2.3326658 4.3314109 125636.89 1 2 551Loop time of 0.018761 on 4 procs for 53 steps with 577 atoms 552 553Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 554 35000 541.61221 -3198.9881 0.33208019 2224.4219 0.17385502 85 383 5.9965398 0.20451429 0.0002 2.3326658 4.3314109 125636.89 1 2 555 36000 495.57311 -3198.5397 0 1 0.35521767 279 284 5.9965398 0.20219444 0.00019444444 2.3326658 4.3314109 129998.42 1 2 556Loop time of 0.152818 on 4 procs for 1000 steps with 577 atoms 557 558Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 559 36000 495.57311 -3198.5397 0 1 0.35521767 279 284 5.9965398 0.20219444 0.00019444444 2.3326658 4.3314109 129998.42 1 2 560 36054 495.57311 -3217.9192 0 1 0.35521767 279 284 5.9965398 0.20189161 0.00019415321 2.3326658 4.3314109 129998.42 1 2 561Loop time of 0.0188267 on 4 procs for 54 steps with 577 atoms 562 563Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 564 36000 495.57311 -3198.5397 0 1 0.35521767 279 284 5.9965398 0.20219444 0.00019444444 2.3326658 4.3314109 129998.42 1 2 565 37000 526.07108 -3199.8791 0 1 0.31298637 415 420 5.9965398 0.19894595 0.00018918919 2.3326658 4.3314109 138599.17 1 2 566Loop time of 0.146616 on 4 procs for 1000 steps with 577 atoms 567 568Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 569 37000 526.07108 -3199.8791 0 1 0.31298637 415 420 5.9965398 0.19894595 0.00018918919 2.3326658 4.3314109 138599.17 1 2 570 37059 526.07108 -3217.9192 0 1 0.31298637 415 420 5.9965398 0.19862921 0.00018888799 2.3326658 4.3314109 138599.17 1 2 571Loop time of 0.020471 on 4 procs for 59 steps with 577 atoms 572 573Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 574 37000 526.07108 -3199.8791 0 1 0.31298637 415 420 5.9965398 0.19894595 0.00018918919 2.3326658 4.3314109 138599.17 1 2 575 38000 546.57696 -3198.709 0.29924515 1038.1377 0.19009438 570 576 5.9965398 0.196 0.00018421053 2.3326658 4.3314109 145249.68 1 2 576Loop time of 0.147942 on 4 procs for 1000 steps with 577 atoms 577 578Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 579 38000 546.57696 -3198.709 0.29924515 1038.1377 0.19009438 570 576 5.9965398 0.196 0.00018421053 2.3326658 4.3314109 145249.68 1 2 580 38054 546.57696 -3217.9192 0.29924515 1038.1377 0.19009438 570 576 5.9965398 0.19572187 0.00018394912 2.3326658 4.3314109 145249.68 1 2 581Loop time of 0.0191819 on 4 procs for 54 steps with 577 atoms 582 583Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 584 38000 546.57696 -3198.709 0.29924515 1038.1377 0.19009438 570 576 5.9965398 0.196 0.00018421053 2.3326658 4.3314109 145249.68 1 2 585 39000 499.91506 -3199.9649 0.19715714 97.107823 0.23347744 424 423 5.9965398 0.19302564 0.00017948718 2.3326658 4.3314109 147736.34 1 2 586Loop time of 0.147371 on 4 procs for 1000 steps with 577 atoms 587 588Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 589 39000 499.91506 -3199.9649 0.19715714 97.107823 0.23347744 424 423 5.9965398 0.19302564 0.00017948718 2.3326658 4.3314109 147736.34 1 2 590 39052 499.91506 -3217.9192 0.19715714 97.107823 0.23347744 424 423 5.9965398 0.19276862 0.00017924818 2.3326658 4.3314109 147736.34 1 2 591Loop time of 0.0177755 on 4 procs for 52 steps with 577 atoms 592 593Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 594 39000 499.91506 -3199.9649 0.19715714 97.107823 0.23347744 424 423 5.9965398 0.19302564 0.00017948718 2.3326658 4.3314109 147736.34 1 2 595 40000 474.08403 -3199.5942 0.16043015 41.405965 0.2472298 125 116 5.9965398 0.1896 0.000175 2.3326658 4.3314109 154329.28 1 2 596Loop time of 0.145757 on 4 procs for 1000 steps with 577 atoms 597 598Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 599 40000 474.08403 -3199.5942 0.16043015 41.405965 0.2472298 125 116 5.9965398 0.1896 0.000175 2.3326658 4.3314109 154329.28 1 2 600 40054 474.08403 -3217.9192 0.16043015 41.405965 0.2472298 125 116 5.9965398 0.18934439 0.00017476407 2.3326658 4.3314109 154329.28 1 2 601Loop time of 0.0190914 on 4 procs for 54 steps with 577 atoms 602 603Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 604 40000 474.08403 -3199.5942 0.16043015 41.405965 0.2472298 125 116 5.9965398 0.1896 0.000175 2.3326658 4.3314109 154329.28 1 2 605 41000 478.39587 -3197.4644 0.19799057 99.004491 0.23315595 123 128 5.9965398 0.18921951 0.00017073171 2.3326658 4.3314109 160000.98 1 2 606Loop time of 0.148949 on 4 procs for 1000 steps with 577 atoms 607 608Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 609 41000 478.39587 -3197.4644 0.19799057 99.004491 0.23315595 123 128 5.9965398 0.18921951 0.00017073171 2.3326658 4.3314109 160000.98 1 2 610 41061 478.39587 -3217.9192 0.19799057 99.004491 0.23315595 123 128 5.9965398 0.18893841 0.00017047807 2.3326658 4.3314109 160000.98 1 2 611Loop time of 0.0214614 on 4 procs for 61 steps with 577 atoms 612 613Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 614 41000 478.39587 -3197.4644 0.19799057 99.004491 0.23315595 123 128 5.9965398 0.18921951 0.00017073171 2.3326658 4.3314109 160000.98 1 2 615 42000 514.00749 -3200.9466 0.23889092 255.80664 0.21679399 577 559 5.9965398 0.18911905 0.00016666667 2.3326658 4.3314109 161054.99 1 2 616Loop time of 0.147446 on 4 procs for 1000 steps with 577 atoms 617 618Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 619 42000 514.00749 -3200.9466 0.23889092 255.80664 0.21679399 577 559 5.9965398 0.18911905 0.00016666667 2.3326658 4.3314109 161054.99 1 2 620 42059 514.00749 -3217.9192 0.23889092 255.80664 0.21679399 577 559 5.9965398 0.18885375 0.00016643287 2.3326658 4.3314109 161054.99 1 2 621Loop time of 0.020681 on 4 procs for 59 steps with 577 atoms 622 623Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 624 42000 514.00749 -3200.9466 0.23889092 255.80664 0.21679399 577 559 5.9965398 0.18911905 0.00016666667 2.3326658 4.3314109 161054.99 1 2 625 43000 539.25745 -3197.7124 0.2272214 195.11394 0.22158553 559 552 5.9965398 0.1902093 0.0001627907 2.3326658 4.3314109 165820.17 1 2 626Loop time of 0.145577 on 4 procs for 1000 steps with 577 atoms 627 628Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 629 43000 539.25745 -3197.7124 0.2272214 195.11394 0.22158553 559 552 5.9965398 0.1902093 0.0001627907 2.3326658 4.3314109 165820.17 1 2 630 43057 539.25745 -3217.9192 0.2272214 195.11394 0.22158553 559 552 5.9965398 0.1899575 0.00016257519 2.3326658 4.3314109 165820.17 1 2 631Loop time of 0.0196458 on 4 procs for 57 steps with 577 atoms 632 633Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 634 43000 539.25745 -3197.7124 0.2272214 195.11394 0.22158553 559 552 5.9965398 0.1902093 0.0001627907 2.3326658 4.3314109 165820.17 1 2 635 44000 490.05902 -3198.6993 0 1 0.92846783 546 552 5.9965398 0.20618182 0.00015909091 2.3326658 5.5445865 165830.19 1 2 636Loop time of 0.149024 on 4 procs for 1000 steps with 577 atoms 637 638Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 639 44000 490.05902 -3198.6993 0 1 0.92846783 546 552 5.9965398 0.20618182 0.00015909091 2.3326658 5.5445865 165830.19 1 2 640 44059 490.05902 -3217.9192 0 1 0.92846783 546 552 5.9965398 0.20590572 0.00015887787 2.3326658 5.5445865 165830.19 1 2 641Loop time of 0.0206496 on 4 procs for 59 steps with 577 atoms 642 643Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 644 44000 490.05902 -3198.6993 0.35638881 3910.5432 0.16077939 230 236 5.9965398 0.20618182 0.00015909091 2.332667 5.5445865 165830.19 2 4 645 45000 483.33637 -3198.8192 0.028253093 1.9265413 0.29140083 111 116 5.9965398 0.20375556 0.00015555556 2.332667 5.5445865 171051.31 2 4 646Loop time of 0.147292 on 4 procs for 1000 steps with 577 atoms 647 648Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 649 45000 483.33637 -3198.8192 0.028253093 1.9265413 0.29140083 111 116 5.9965398 0.20375556 0.00015555556 2.332667 5.5445865 171051.31 2 4 650 45054 483.33637 -3217.9192 0.028253093 1.9265413 0.29140083 111 116 5.9965398 0.20351134 0.00015536911 2.332667 5.5445865 171051.31 2 4 651Loop time of 0.0189967 on 4 procs for 54 steps with 577 atoms 652 653Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 654 45000 483.33637 -3198.8192 0.028253093 1.9265413 0.29140083 111 116 5.9965398 0.20375556 0.00015555556 2.332667 5.5445865 171051.31 2 4 655 46000 477.60275 -3197.5319 0.2869403 780.23907 0.19583346 257 140 5.9965398 0.20502174 0.00015217391 2.332667 5.5445865 173658.75 2 4 656Loop time of 0.146994 on 4 procs for 1000 steps with 577 atoms 657 658Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 659 46000 477.60275 -3197.5319 0.2869403 780.23907 0.19583346 257 140 5.9965398 0.20502174 0.00015217391 2.332667 5.5445865 173658.75 2 4 660 46054 477.60275 -3217.9192 0.2869403 780.23907 0.19583346 257 140 5.9965398 0.20478134 0.00015199548 2.332667 5.5445865 173658.75 2 4 661Loop time of 0.0192491 on 4 procs for 54 steps with 577 atoms 662 663Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 664 46000 477.60275 -3197.5319 0.2869403 780.23907 0.19583346 257 140 5.9965398 0.20502174 0.00015217391 2.332667 5.5445865 173658.75 2 4 665 47000 521.34153 -3198.5751 0 1 0.35188792 115 116 5.9965398 0.20693617 0.00014893617 2.332667 5.5445865 174765.77 2 4 666Loop time of 0.150082 on 4 procs for 1000 steps with 577 atoms 667 668Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 669 47000 521.34153 -3198.5751 0 1 0.35188792 115 116 5.9965398 0.20693617 0.00014893617 2.332667 5.5445865 174765.77 2 4 670 47053 521.34153 -3217.9192 0 1 0.35188792 115 116 5.9965398 0.20670308 0.00014876841 2.332667 5.5445865 174765.77 2 4 671Loop time of 0.0192085 on 4 procs for 53 steps with 577 atoms 672 673Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 674 47000 521.34153 -3198.5751 0 1 0.35188792 115 116 5.9965398 0.20693617 0.00014893617 2.332667 5.5445865 174765.77 2 4 675 48000 541.31479 -3198.7131 0 1 0.33712983 563 256 5.9965398 0.20533333 0.00014583333 2.332667 5.5445865 182326.46 2 4 676Loop time of 0.147438 on 4 procs for 1000 steps with 577 atoms 677 678Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 679 48000 541.31479 -3198.7131 0 1 0.33712983 563 256 5.9965398 0.20533333 0.00014583333 2.332667 5.5445865 182326.46 2 4 680 48060 541.31479 -3217.9192 0 1 0.33712983 563 256 5.9965398 0.20507699 0.00014565127 2.332667 5.5445865 182326.46 2 4 681Loop time of 0.0201835 on 4 procs for 60 steps with 577 atoms 682 683Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 684 48000 541.31479 -3198.7131 0 1 0.33712983 563 256 5.9965398 0.20533333 0.00014583333 2.332667 5.5445865 182326.46 2 4 685 49000 452.11261 -3198.407 0 1 0.31483556 548 563 5.9965398 0.20673469 0.00014285714 2.332667 5.5445865 185690.59 2 4 686Loop time of 0.151182 on 4 procs for 1000 steps with 577 atoms 687 688Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 689 49000 452.11261 -3198.407 0 1 0.31483556 548 563 5.9965398 0.20673469 0.00014285714 2.332667 5.5445865 185690.59 2 4 690 49054 452.11261 -3217.9192 0 1 0.31483556 548 563 5.9965398 0.20650711 0.00014269988 2.332667 5.5445865 185690.59 2 4 691Loop time of 0.0202584 on 4 procs for 54 steps with 577 atoms 692 693Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 694 49000 452.11261 -3198.407 0 1 0.31483556 548 563 5.9965398 0.20673469 0.00014285714 2.332667 5.5445865 185690.59 2 4 695 50000 467.29807 -3198.3148 0.06855095 4.9086536 0.27867693 548 563 5.9965398 0.20636 0.0003 2.332667 5.5445865 193139.54 2 4 696Loop time of 0.146241 on 4 procs for 1000 steps with 577 atoms 697 698Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 699 50000 467.29807 -3198.3148 0.06855095 4.9086536 0.27867693 548 563 5.9965398 0.20636 0.0003 2.332667 5.5445865 193139.54 2 4 700 50063 467.29807 -3217.9192 0.06855095 4.9086536 0.27867693 548 563 5.9965398 0.20610031 0.00029962248 2.332667 5.5445865 193139.54 2 4 701Loop time of 0.0221142 on 4 procs for 63 steps with 577 atoms 702 703Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 704 50000 467.29807 -3198.3148 0.06855095 4.9086536 0.27867693 548 563 5.9965398 0.20636 0.0003 2.332667 5.5445865 193139.54 2 4 705 51000 501.62342 -3201.5498 0.40026778 10827.223 0.13398433 406 112 5.9965398 0.20668627 0.00029411765 2.332667 5.5445865 196921.52 2 4 706Loop time of 0.14753 on 4 procs for 1000 steps with 577 atoms 707 708Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 709 51000 501.62342 -3201.5498 0.40026778 10827.223 0.13398433 406 112 5.9965398 0.20668627 0.00029411765 2.332667 5.5445865 196921.52 2 4 710 51051 501.62342 -3217.9192 0.40026778 10827.223 0.13398433 406 112 5.9965398 0.20647979 0.00029382382 2.332667 5.5445865 196921.52 2 4 711Loop time of 0.0181563 on 4 procs for 51 steps with 577 atoms 712 713Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 714 51000 501.62342 -3201.5498 0.40026778 10827.223 0.13398433 406 112 5.9965398 0.20668627 0.00029411765 2.332667 5.5445865 196921.52 2 4 715 52000 530.03691 -3199.0384 0.33213868 2227.444 0.17382473 128 127 5.9965398 0.20465385 0.00028846154 2.332667 5.5445865 201405.55 2 4 716Loop time of 0.146685 on 4 procs for 1000 steps with 577 atoms 717 718Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 719 52000 530.03691 -3199.0384 0.33213868 2227.444 0.17382473 128 127 5.9965398 0.20465385 0.00028846154 2.332667 5.5445865 201405.55 2 4 720 52052 530.03691 -3217.9192 0.33213868 2227.444 0.17382473 128 127 5.9965398 0.2044494 0.00028817337 2.332667 5.5445865 201405.55 2 4 721Loop time of 0.0245662 on 4 procs for 52 steps with 577 atoms 722 723Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 724 52000 530.03691 -3199.0384 0.33213868 2227.444 0.17382473 128 127 5.9965398 0.20465385 0.00028846154 2.332667 5.5445865 201405.55 2 4 725 53000 476.23675 -3197.8718 0.16551582 46.593376 0.24537146 285 276 5.9965398 0.20318868 0.00028301887 2.332667 5.5445865 206506.23 2 4 726Loop time of 0.168646 on 4 procs for 1000 steps with 577 atoms 727 728Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 729 53000 476.23675 -3197.8718 0.16551582 46.593376 0.24537146 285 276 5.9965398 0.20318868 0.00028301887 2.332667 5.5445865 206506.23 2 4 730 53053 476.23675 -3217.9192 0.16551582 46.593376 0.24537146 285 276 5.9965398 0.20298569 0.00028273613 2.332667 5.5445865 206506.23 2 4 731Loop time of 0.0190916 on 4 procs for 53 steps with 577 atoms 732 733Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 734 53000 476.23675 -3197.8718 0.16551582 46.593376 0.24537146 285 276 5.9965398 0.20318868 0.00028301887 2.332667 5.5445865 206506.23 2 4 735 54000 494.85478 -3197.5779 0.022382673 1.6811527 0.29320832 268 279 5.9965398 0.20059259 0.00027777778 2.332667 5.5445865 213644.3 2 4 736Loop time of 0.147166 on 4 procs for 1000 steps with 577 atoms 737 738Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 739 54000 494.85478 -3197.5779 0.022382673 1.6811527 0.29320832 268 279 5.9965398 0.20059259 0.00027777778 2.332667 5.5445865 213644.3 2 4 740 54053 494.85478 -3217.9192 0.022382673 1.6811527 0.29320832 268 279 5.9965398 0.20039591 0.00027750541 2.332667 5.5445865 213644.3 2 4 741Loop time of 0.0190244 on 4 procs for 53 steps with 577 atoms 742 743Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 744 54000 494.85478 -3197.5779 0.022382673 1.6811527 0.29320832 268 279 5.9965398 0.20059259 0.00027777778 2.332667 5.5445865 213644.3 2 4 745 55000 502.92342 -3199.4636 0.3276566 2007.3793 0.1761301 400 411 5.9965398 0.19972727 0.00027272727 2.332667 5.5445865 215172.4 2 4 746Loop time of 0.145777 on 4 procs for 1000 steps with 577 atoms 747 748Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 749 55000 502.92342 -3199.4636 0.3276566 2007.3793 0.1761301 400 411 5.9965398 0.19972727 0.00027272727 2.332667 5.5445865 215172.4 2 4 750 55061 502.92342 -3217.9192 0.3276566 2007.3793 0.1761301 400 411 5.9965398 0.199506 0.00027242513 2.332667 5.5445865 215172.4 2 4 751Loop time of 0.021274 on 4 procs for 61 steps with 577 atoms 752 753Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 754 55000 502.92342 -3199.4636 0.3276566 2007.3793 0.1761301 400 411 5.9965398 0.19972727 0.00027272727 2.332667 5.5445865 215172.4 2 4 755 56000 521.1487 -3198.5105 0 1 0.31151142 428 547 5.9965398 0.19716071 0.00026785714 2.332667 5.5445865 220366.14 2 4 756Loop time of 0.149004 on 4 procs for 1000 steps with 577 atoms 757 758Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 759 56000 521.1487 -3198.5105 0 1 0.31151142 428 547 5.9965398 0.19716071 0.00026785714 2.332667 5.5445865 220366.14 2 4 760 56055 521.1487 -3217.9192 0 1 0.31151142 428 547 5.9965398 0.19696726 0.00026759433 2.332667 5.5445865 220366.14 2 4 761Loop time of 0.019273 on 4 procs for 55 steps with 577 atoms 762 763Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 764 56000 521.1487 -3198.5105 0 1 0.31151142 428 547 5.9965398 0.19716071 0.00026785714 2.332667 5.5445865 220366.14 2 4 765 57000 481.95031 -3199.5907 0.41736767 16101.867 0.12195827 412 411 5.9965398 0.19584211 0.00026315789 2.332667 5.5445865 229464.45 2 4 766Loop time of 0.146342 on 4 procs for 1000 steps with 577 atoms 767 768Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 769 57000 481.95031 -3199.5907 0.41736767 16101.867 0.12195827 412 411 5.9965398 0.19584211 0.00026315789 2.332667 5.5445865 229464.45 2 4 770 57056 481.95031 -3217.9192 0.41736767 16101.867 0.12195827 412 411 5.9965398 0.19564989 0.00026289961 2.332667 5.5445865 229464.45 2 4 771Loop time of 0.0195522 on 4 procs for 56 steps with 577 atoms 772 773Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 774 57000 481.95031 -3199.5907 0.41736767 16101.867 0.12195827 412 411 5.9965398 0.19584211 0.00026315789 2.332667 5.5445865 229464.45 2 4 775 58000 525.04435 -3200.0547 0.0014425542 1.034047 0.29956692 551 256 5.9965398 0.19605172 0.00025862069 2.332667 5.5445865 234898.73 2 4 776Loop time of 0.149326 on 4 procs for 1000 steps with 577 atoms 777 778Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 779 58000 525.04435 -3200.0547 0.0014425542 1.034047 0.29956692 551 256 5.9965398 0.19605172 0.00025862069 2.332667 5.5445865 234898.73 2 4 780 58058 525.04435 -3217.9192 0.0014425542 1.034047 0.29956692 551 256 5.9965398 0.19585587 0.00025836233 2.332667 5.5445865 234898.73 2 4 781Loop time of 0.0206398 on 4 procs for 58 steps with 577 atoms 782 783Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 784 58000 525.04435 -3200.0547 0.0014425542 1.034047 0.29956692 551 256 5.9965398 0.19605172 0.00025862069 2.332667 5.5445865 234898.73 2 4 785 59000 481.80944 -3197.6876 0.037642135 2.3956071 0.28848642 132 143 5.9965398 0.19559322 0.00025423729 2.332667 5.5445865 238986.94 2 4 786Loop time of 0.14619 on 4 procs for 1000 steps with 577 atoms 787 788Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 789 59000 481.80944 -3197.6876 0.037642135 2.3956071 0.28848642 132 143 5.9965398 0.19559322 0.00025423729 2.332667 5.5445865 238986.94 2 4 790 59052 481.80944 -3217.9192 0.037642135 2.3956071 0.28848642 132 143 5.9965398 0.19542098 0.00025401341 2.332667 5.5445865 238986.94 2 4 791Loop time of 0.0187398 on 4 procs for 52 steps with 577 atoms 792 793Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 794 59000 481.80944 -3197.6876 0.037642135 2.3956071 0.28848642 132 143 5.9965398 0.19559322 0.00025423729 2.332667 5.5445865 238986.94 2 4 795 60000 486.86094 -3197.1192 0.16900791 50.526918 0.24408723 283 284 5.9965398 0.19436667 0.00025 2.332667 5.5445865 242682.27 2 4 796Loop time of 0.148527 on 4 procs for 1000 steps with 577 atoms 797 798Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 799 60000 486.86094 -3197.1192 0.16900791 50.526918 0.24408723 283 284 5.9965398 0.19436667 0.00025 2.332667 5.5445865 242682.27 2 4 800 60053 486.86094 -3217.9192 0.16900791 50.526918 0.24408723 283 284 5.9965398 0.19419513 0.00024977936 2.332667 5.5445865 242682.27 2 4 801Loop time of 0.0185421 on 4 procs for 53 steps with 577 atoms 802 803Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 804 60000 486.86094 -3197.1192 0.16900791 50.526918 0.24408723 283 284 5.9965398 0.19436667 0.00025 2.332667 5.5445865 242682.27 2 4 805 61000 506.68298 -3198.7212 0.086903353 7.5152988 0.27268553 432 547 5.9965398 0.19522951 0.00024590164 2.332667 5.5445865 245274.71 2 4 806Loop time of 0.146228 on 4 procs for 1000 steps with 577 atoms 807 808Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 809 61000 506.68298 -3198.7212 0.086903353 7.5152988 0.27268553 432 547 5.9965398 0.19522951 0.00024590164 2.332667 5.5445865 245274.71 2 4 810 61053 506.68298 -3217.9192 0.086903353 7.5152988 0.27268553 432 547 5.9965398 0.19506003 0.00024568817 2.332667 5.5445865 245274.71 2 4 811Loop time of 0.0195987 on 4 procs for 53 steps with 577 atoms 812 813Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 814 61000 506.68298 -3198.7212 0.086903353 7.5152988 0.27268553 432 547 5.9965398 0.19522951 0.00024590164 2.332667 5.5445865 245274.71 2 4 815 62000 505.72288 -3199.108 0 1 0.31500636 551 548 5.9965398 0.1965 0.00024193548 2.332667 5.5445865 246486.72 2 4 816Loop time of 0.148492 on 4 procs for 1000 steps with 577 atoms 817 818Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 819 62000 505.72288 -3199.108 0 1 0.31500636 551 548 5.9965398 0.1965 0.00024193548 2.332667 5.5445865 246486.72 2 4 820 62055 505.72288 -3217.9192 0 1 0.31500636 551 548 5.9965398 0.19632584 0.00024172105 2.332667 5.5445865 246486.72 2 4 821Loop time of 0.020478 on 4 procs for 55 steps with 577 atoms 822 823Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 824 62000 505.72288 -3199.108 0 1 0.31500636 551 548 5.9965398 0.1965 0.00024193548 2.332667 5.5445865 246486.72 2 4 825 63000 512.7617 -3199.9408 0.11525868 14.512929 0.26316048 551 548 5.9965398 0.198 0.00023809524 2.332667 5.5445865 246977.1 2 4 826Loop time of 0.146232 on 4 procs for 1000 steps with 577 atoms 827 828Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 829 63000 512.7617 -3199.9408 0.11525868 14.512929 0.26316048 551 548 5.9965398 0.198 0.00023809524 2.332667 5.5445865 246977.1 2 4 830 63061 512.7617 -3217.9192 0.11525868 14.512929 0.26316048 551 548 5.9965398 0.19780847 0.00023786492 2.332667 5.5445865 246977.1 2 4 831Loop time of 0.0210125 on 4 procs for 61 steps with 577 atoms 832 833Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 834 63000 512.7617 -3199.9408 0.11525868 14.512929 0.26316048 551 548 5.9965398 0.198 0.00023809524 2.332667 5.5445865 246977.1 2 4 835 64000 486.25689 -3198.5189 0.35129177 3474.2507 0.16360771 544 555 5.9965398 0.1988125 0.001109375 2.332667 5.5445865 249201.34 2 4 836Loop time of 0.155832 on 4 procs for 1000 steps with 577 atoms 837 838Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 839 64000 486.25689 -3198.5189 0.35129177 3474.2507 0.16360771 544 555 5.9965398 0.1988125 0.001109375 2.332667 5.5445865 249201.34 2 4 840 64053 486.25689 -3217.9192 0.35129177 3474.2507 0.16360771 544 555 5.9965398 0.19864799 0.0011084571 2.332667 5.5445865 249201.34 2 4 841Loop time of 0.0204544 on 4 procs for 53 steps with 577 atoms 842 843Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 844 64000 486.25689 -3198.5189 0.35129177 3474.2507 0.16360771 544 555 5.9965398 0.1988125 0.001109375 2.332667 5.5445865 249201.34 2 4 845 65000 548.53783 -3200.1855 0.047969556 3.0444672 0.28524635 551 548 5.9965398 0.19770769 0.0010923077 2.332667 5.5445865 254327.62 2 4 846Loop time of 0.14987 on 4 procs for 1000 steps with 577 atoms 847 848Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 849 65000 548.53783 -3200.1855 0.047969556 3.0444672 0.28524635 551 548 5.9965398 0.19770769 0.0010923077 2.332667 5.5445865 254327.62 2 4 850 65061 548.53783 -3217.9192 0.047969556 3.0444672 0.28524635 551 548 5.9965398 0.19752233 0.0010912836 2.332667 5.5445865 254327.62 2 4 851Loop time of 0.0217812 on 4 procs for 61 steps with 577 atoms 852 853Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 854 65000 548.53783 -3200.1855 0.047969556 3.0444672 0.28524635 551 548 5.9965398 0.19770769 0.0010923077 2.332667 5.5445865 254327.62 2 4 855 66000 530.28774 -3198.7237 0.35744103 4007.2176 0.16018931 402 403 5.9965398 0.20060606 0.0010757576 2.332667 5.5445865 255407.47 2 4 856Loop time of 0.147202 on 4 procs for 1000 steps with 577 atoms 857 858Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 859 66000 530.28774 -3198.7237 0.35744103 4007.2176 0.16018931 402 403 5.9965398 0.20060606 0.0010757576 2.332667 5.5445865 255407.47 2 4 860 66058 530.28774 -3217.9192 0.35744103 4007.2176 0.16018931 402 403 5.9965398 0.20042993 0.001074813 2.332667 5.5445865 255407.47 2 4 861Loop time of 0.0205493 on 4 procs for 58 steps with 577 atoms 862 863Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 864 66000 530.28774 -3198.7237 0.35744103 4007.2176 0.16018931 402 403 5.9965398 0.20060606 0.0010757576 2.332667 5.5445865 255407.47 2 4 865 67000 514.44507 -3197.2465 0.33994158 2669.6633 0.1697366 79 117 5.9965398 0.19949254 0.0010597015 2.332667 5.5445865 258118.06 2 4 866Loop time of 0.146892 on 4 procs for 1000 steps with 577 atoms 867 868Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 869 67000 514.44507 -3197.2465 0.33994158 2669.6633 0.1697366 79 117 5.9965398 0.19949254 0.0010597015 2.332667 5.5445865 258118.06 2 4 870 67053 514.44507 -3217.9192 0.33994158 2669.6633 0.1697366 79 117 5.9965398 0.19933485 0.0010588639 2.332667 5.5445865 258118.06 2 4 871Loop time of 0.0191221 on 4 procs for 53 steps with 577 atoms 872 873Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 874 67000 514.44507 -3197.2465 0.33994158 2669.6633 0.1697366 79 117 5.9965398 0.19949254 0.0010597015 2.332667 5.5445865 258118.06 2 4 875 68000 494.25025 -3198.3063 0.3603828 4290.3691 0.1585279 73 76 5.9965398 0.198 0.0010441176 2.332667 5.5445865 261601.61 2 4 876Loop time of 0.146714 on 4 procs for 1000 steps with 577 atoms 877 878Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 879 68000 494.25025 -3198.3063 0.3603828 4290.3691 0.1585279 73 76 5.9965398 0.198 0.0010441176 2.332667 5.5445865 261601.61 2 4 880 68051 494.25025 -3217.9192 0.3603828 4290.3691 0.1585279 73 76 5.9965398 0.19785161 0.0010433351 2.332667 5.5445865 261601.61 2 4 881Loop time of 0.0185863 on 4 procs for 51 steps with 577 atoms 882 883Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 884 68000 494.25025 -3198.3063 0.3603828 4290.3691 0.1585279 73 76 5.9965398 0.198 0.0010441176 2.332667 5.5445865 261601.61 2 4 885 69000 477.30539 -3197.981 0.24885139 322.336 0.21261879 570 572 5.9965398 0.1974058 0.0011449275 2.332667 5.5445865 269691.31 2 4 886Loop time of 0.146795 on 4 procs for 1000 steps with 577 atoms 887 888Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 889 69000 477.30539 -3197.981 0.24885139 322.336 0.21261879 570 572 5.9965398 0.1974058 0.0011449275 2.332667 5.5445865 269691.31 2 4 890 69054 477.30539 -3217.9192 0.24885139 322.336 0.21261879 570 572 5.9965398 0.19725143 0.0011440322 2.332667 5.5445865 269691.31 2 4 891Loop time of 0.0192543 on 4 procs for 54 steps with 577 atoms 892 893Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 894 69000 477.30539 -3197.981 0.24885139 322.336 0.21261879 570 572 5.9965398 0.1974058 0.0011449275 2.332667 5.5445865 269691.31 2 4 895 70000 494.06575 -3200.0312 0.16385959 44.836337 0.2459782 563 256 5.9965398 0.19577143 0.0011285714 2.332667 5.5445865 277199.96 2 4 896Loop time of 0.147705 on 4 procs for 1000 steps with 577 atoms 897 898Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 899 70000 494.06575 -3200.0312 0.16385959 44.836337 0.2459782 563 256 5.9965398 0.19577143 0.0011285714 2.332667 5.5445865 277199.96 2 4 900 70054 494.06575 -3217.9192 0.16385959 44.836337 0.2459782 563 256 5.9965398 0.19562052 0.0011277015 2.332667 5.5445865 277199.96 2 4 901Loop time of 0.0190155 on 4 procs for 54 steps with 577 atoms 902 903Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 904 70000 494.06575 -3200.0312 0.16385959 44.836337 0.2459782 563 256 5.9965398 0.19577143 0.0011285714 2.332667 5.5445865 277199.96 2 4 905 71000 521.52358 -3198.0632 0.14648679 29.958507 0.25225459 563 256 5.9965398 0.19690141 0.0011126761 2.332667 5.5445865 277540.94 2 4 906Loop time of 0.146516 on 4 procs for 1000 steps with 577 atoms 907 908Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 909 71000 521.52358 -3198.0632 0.14648679 29.958507 0.25225459 563 256 5.9965398 0.19690141 0.0011126761 2.332667 5.5445865 277540.94 2 4 910 71054 521.52358 -3217.9192 0.14648679 29.958507 0.25225459 563 256 5.9965398 0.19675177 0.0011118304 2.332667 5.5445865 277540.94 2 4 911Loop time of 0.0187534 on 4 procs for 54 steps with 577 atoms 912 913Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 914 71000 521.52358 -3198.0632 0.14648679 29.958507 0.25225459 563 256 5.9965398 0.19690141 0.0011126761 2.332667 5.5445865 277540.94 2 4 915 72000 477.57283 -3199.7245 0 1 0.30404328 563 256 5.9965398 0.19827778 0.0013333333 2.332667 5.5445865 280791.76 2 4 916Loop time of 0.146056 on 4 procs for 1000 steps with 577 atoms 917 918Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 919 72000 477.57283 -3199.7245 0 1 0.30404328 563 256 5.9965398 0.19827778 0.0013333333 2.332667 5.5445865 280791.76 2 4 920 72053 477.57283 -3217.9192 0 1 0.30404328 563 256 5.9965398 0.19813193 0.0013323526 2.332667 5.5445865 280791.76 2 4 921Loop time of 0.0185455 on 4 procs for 53 steps with 577 atoms 922 923Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 924 72000 477.57283 -3199.7245 0 1 0.30404328 563 256 5.9965398 0.19827778 0.0013333333 2.332667 5.5445865 280791.76 2 4 925 73000 491.49087 -3198.3904 0.19822154 99.536632 0.23306678 89 87 5.9965398 0.19736986 0.0013150685 2.332667 5.5445865 287754.81 2 4 926Loop time of 0.147198 on 4 procs for 1000 steps with 577 atoms 927 928Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 929 73000 491.49087 -3198.3904 0.19822154 99.536632 0.23306678 89 87 5.9965398 0.19736986 0.0013150685 2.332667 5.5445865 287754.81 2 4 930 73053 491.49087 -3217.9192 0.19822154 99.536632 0.23306678 89 87 5.9965398 0.19722667 0.0013141144 2.332667 5.5445865 287754.81 2 4 931Loop time of 0.0186561 on 4 procs for 53 steps with 577 atoms 932 933Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 934 73000 491.49087 -3198.3904 0.19822154 99.536632 0.23306678 89 87 5.9965398 0.19736986 0.0013150685 2.332667 5.5445865 287754.81 2 4 935 74000 492.96166 -3196.9654 0.18723782 77.138643 0.2372703 548 563 5.9965398 0.19921622 0.0012972973 2.332667 5.5445865 289420.74 2 4 936Loop time of 0.147452 on 4 procs for 1000 steps with 577 atoms 937 938Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 939 74000 492.96166 -3196.9654 0.18723782 77.138643 0.2372703 548 563 5.9965398 0.19921622 0.0012972973 2.332667 5.5445865 289420.74 2 4 940 74061 492.96166 -3217.9192 0.18723782 77.138643 0.2372703 548 563 5.9965398 0.19905213 0.0012962288 2.332667 5.5445865 289420.74 2 4 941Loop time of 0.0211116 on 4 procs for 61 steps with 577 atoms 942 943Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 944 74000 492.96166 -3196.9654 0.18723782 77.138643 0.2372703 548 563 5.9965398 0.19921622 0.0012972973 2.332667 5.5445865 289420.74 2 4 945 75000 529.20732 -3198.9061 0.05344088 3.4566846 0.2835148 116 123 5.9965398 0.19838667 0.00128 2.332667 5.5445865 293504.18 2 4 946Loop time of 0.147695 on 4 procs for 1000 steps with 577 atoms 947 948Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 949 75000 529.20732 -3198.9061 0.05344088 3.4566846 0.2835148 116 123 5.9965398 0.19838667 0.00128 2.332667 5.5445865 293504.18 2 4 950 75063 529.20732 -3217.9192 0.05344088 3.4566846 0.2835148 116 123 5.9965398 0.19822016 0.0012789257 2.332667 5.5445865 293504.18 2 4 951Loop time of 0.0224035 on 4 procs for 63 steps with 577 atoms 952 953Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 954 75000 529.20732 -3198.9061 0.05344088 3.4566846 0.2835148 116 123 5.9965398 0.19838667 0.00128 2.332667 5.5445865 293504.18 2 4 955 76000 498.66616 -3197.8484 0.083711316 6.978659 0.27373703 548 563 5.9965398 0.19861842 0.0012631579 2.332667 5.5445865 297498.83 2 4 956Loop time of 0.151858 on 4 procs for 1000 steps with 577 atoms 957 958Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 959 76000 498.66616 -3197.8484 0.083711316 6.978659 0.27373703 548 563 5.9965398 0.19861842 0.0012631579 2.332667 5.5445865 297498.83 2 4 960 76054 498.66616 -3217.9192 0.083711316 6.978659 0.27373703 548 563 5.9965398 0.1984774 0.001262261 2.332667 5.5445865 297498.83 2 4 961Loop time of 0.0206581 on 4 procs for 54 steps with 577 atoms 962 963Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 964 76000 498.66616 -3197.8484 0.083711316 6.978659 0.27373703 548 563 5.9965398 0.19861842 0.0012631579 2.332667 5.5445865 297498.83 2 4 965 77000 486.32916 -3197.1136 0.058197108 3.8601161 0.28200092 277 280 5.9965398 0.19701299 0.0012467532 2.332667 5.5445865 302372 2 4 966Loop time of 0.178096 on 4 procs for 1000 steps with 577 atoms 967 968Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 969 77000 486.32916 -3197.1136 0.058197108 3.8601161 0.28200092 277 280 5.9965398 0.19701299 0.0012467532 2.332667 5.5445865 302372 2 4 970 77055 486.32916 -3217.9192 0.058197108 3.8601161 0.28200092 277 280 5.9965398 0.19687236 0.0012458633 2.332667 5.5445865 302372 2 4 971Loop time of 0.0196412 on 4 procs for 55 steps with 577 atoms 972 973Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 974 77000 486.32916 -3197.1136 0.058197108 3.8601161 0.28200092 277 280 5.9965398 0.19701299 0.0012467532 2.332667 5.5445865 302372 2 4 975 78000 505.40944 -3199.8936 0.093303231 8.7187478 0.270565 88 121 5.9965398 0.19614103 0.0012307692 2.332667 5.5445865 305826.62 2 4 976Loop time of 0.15925 on 4 procs for 1000 steps with 577 atoms 977 978Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 979 78000 505.40944 -3199.8936 0.093303231 8.7187478 0.270565 88 121 5.9965398 0.19614103 0.0012307692 2.332667 5.5445865 305826.62 2 4 980 78057 505.40944 -3217.9192 0.093303231 8.7187478 0.270565 88 121 5.9965398 0.1959978 0.0012298705 2.332667 5.5445865 305826.62 2 4 981Loop time of 0.0351628 on 4 procs for 57 steps with 577 atoms 982 983Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 984 78000 505.40944 -3199.8936 0.093303231 8.7187478 0.270565 88 121 5.9965398 0.19614103 0.0012307692 2.332667 5.5445865 305826.62 2 4 985 79000 526.28218 -3198.7939 0.010254625 1.2687088 0.29690768 543 544 5.9965398 0.19472152 0.0012151899 2.332667 5.5445865 309786.25 2 4 986Loop time of 0.248652 on 4 procs for 1000 steps with 577 atoms 987 988Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 989 79000 526.28218 -3198.7939 0.010254625 1.2687088 0.29690768 543 544 5.9965398 0.19472152 0.0012151899 2.332667 5.5445865 309786.25 2 4 990 79061 526.28218 -3217.9192 0.010254625 1.2687088 0.29690768 543 544 5.9965398 0.19457128 0.0012142523 2.332667 5.5445865 309786.25 2 4 991Loop time of 0.0293576 on 4 procs for 61 steps with 577 atoms 992 993Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 994 79000 526.28218 -3198.7939 0.010254625 1.2687088 0.29690768 543 544 5.9965398 0.19472152 0.0012151899 2.332667 5.5445865 309786.25 2 4 995 80000 513.93228 -3198.9101 0.28635286 769.67342 0.19610325 120 127 5.9965398 0.1928875 0.0012 2.332667 5.5445865 318100.87 2 4 996Loop time of 0.188747 on 4 procs for 1000 steps with 577 atoms 997 998Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 999 80000 513.93228 -3198.9101 0.28635286 769.67342 0.19610325 120 127 5.9965398 0.1928875 0.0012 2.332667 5.5445865 318100.87 2 4 1000 80051 513.93228 -3217.9192 0.28635286 769.67342 0.19610325 120 127 5.9965398 0.19276461 0.0011992355 2.332667 5.5445865 318100.87 2 4 1001Loop time of 0.0326888 on 4 procs for 51 steps with 577 atoms 1002 1003Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1004 80000 513.93228 -3198.9101 0.28635286 769.67342 0.19610325 120 127 5.9965398 0.1928875 0.0012 2.332667 5.5445865 318100.87 2 4 1005 81000 472.77787 -3200.6856 0 1 0.30460187 563 256 5.9965398 0.19223457 0.0011851852 2.332667 5.5445865 322608.51 2 4 1006Loop time of 0.276107 on 4 procs for 1000 steps with 577 atoms 1007 1008Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1009 81000 472.77787 -3200.6856 0 1 0.30460187 563 256 5.9965398 0.19223457 0.0011851852 2.332667 5.5445865 322608.51 2 4 1010 81055 472.77787 -3217.9192 0 1 0.30460187 563 256 5.9965398 0.19210413 0.001184381 2.332667 5.5445865 322608.51 2 4 1011Loop time of 0.0217792 on 4 procs for 55 steps with 577 atoms 1012 1013Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1014 81000 472.77787 -3200.6856 0 1 0.30460187 563 256 5.9965398 0.19223457 0.0011851852 2.332667 5.5445865 322608.51 2 4 1015 82000 487.68015 -3197.7729 0.1267439 18.946144 0.25920281 562 575 5.9965398 0.19207317 0.0011707317 2.332667 5.5445865 328159.62 2 4 1016Loop time of 0.192733 on 4 procs for 1000 steps with 577 atoms 1017 1018Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1019 82000 487.68015 -3197.7729 0.1267439 18.946144 0.25920281 562 575 5.9965398 0.19207317 0.0011707317 2.332667 5.5445865 328159.62 2 4 1020 82066 487.68015 -3217.9192 0.1267439 18.946144 0.25920281 562 575 5.9965398 0.1919187 0.0011697902 2.332667 5.5445865 328159.62 2 4 1021Loop time of 0.0283784 on 4 procs for 66 steps with 577 atoms 1022 1023Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1024 82000 487.68015 -3197.7729 0.1267439 18.946144 0.25920281 562 575 5.9965398 0.19207317 0.0011707317 2.332667 5.5445865 328159.62 2 4 1025 83000 475.5591 -3197.0536 0.050428691 3.2232817 0.28446939 410 416 5.9965398 0.1906988 0.001253012 2.332667 5.5445865 333013.8 2 4 1026Loop time of 0.168478 on 4 procs for 1000 steps with 577 atoms 1027 1028Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1029 83000 475.5591 -3197.0536 0.050428691 3.2232817 0.28446939 410 416 5.9965398 0.1906988 0.001253012 2.332667 5.5445865 333013.8 2 4 1030 83053 475.5591 -3217.9192 0.050428691 3.2232817 0.28446939 410 416 5.9965398 0.1905771 0.0012522124 2.332667 5.5445865 333013.8 2 4 1031Loop time of 0.0209876 on 4 procs for 53 steps with 577 atoms 1032 1033Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1034 83000 475.5591 -3197.0536 0.050428691 3.2232817 0.28446939 410 416 5.9965398 0.1906988 0.001253012 2.332667 5.5445865 333013.8 2 4 1035 84000 521.96002 -3198.5655 0.30743246 1255.3918 0.18617776 274 276 5.9965398 0.18882143 0.0012380952 2.332667 5.5445865 339522.55 2 4 1036Loop time of 0.196029 on 4 procs for 1000 steps with 577 atoms 1037 1038Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1039 84000 521.96002 -3198.5655 0.30743246 1255.3918 0.18617776 274 276 5.9965398 0.18882143 0.0012380952 2.332667 5.5445865 339522.55 2 4 1040 84055 521.96002 -3217.9192 0.30743246 1255.3918 0.18617776 274 276 5.9965398 0.18869788 0.0012372851 2.332667 5.5445865 339522.55 2 4 1041Loop time of 0.0294663 on 4 procs for 55 steps with 577 atoms 1042 1043Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1044 84000 521.96002 -3198.5655 0.30743246 1255.3918 0.18617776 274 276 5.9965398 0.18882143 0.0012380952 2.332667 5.5445865 339522.55 2 4 1045 85000 512.56855 -3199.3238 0.31996602 1679.2366 0.18001699 110 116 5.9965398 0.18802353 0.0012470588 2.332667 5.5445865 343955.55 2 4 1046Loop time of 0.253235 on 4 procs for 1000 steps with 577 atoms 1047 1048Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1049 85000 512.56855 -3199.3238 0.31996602 1679.2366 0.18001699 110 116 5.9965398 0.18802353 0.0012470588 2.332667 5.5445865 343955.55 2 4 1050 85058 512.56855 -3217.9192 0.31996602 1679.2366 0.18001699 110 116 5.9965398 0.18789532 0.0012462085 2.332667 5.5445865 343955.55 2 4 1051Loop time of 0.0273268 on 4 procs for 58 steps with 577 atoms 1052 1053Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1054 85000 512.56855 -3199.3238 0.31996602 1679.2366 0.18001699 110 116 5.9965398 0.18802353 0.0012470588 2.332667 5.5445865 343955.55 2 4 1055 86000 502.24946 -3198.3217 0.28404879 729.59623 0.19715785 569 560 5.9965398 0.18894186 0.0012325581 2.332667 5.5445865 345831.54 2 4 1056Loop time of 0.227089 on 4 procs for 1000 steps with 577 atoms 1057 1058Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1059 86000 502.24946 -3198.3217 0.28404879 729.59623 0.19715785 569 560 5.9965398 0.18894186 0.0012325581 2.332667 5.5445865 345831.54 2 4 1060 86064 502.24946 -3217.9192 0.28404879 729.59623 0.19715785 569 560 5.9965398 0.18880136 0.0012316416 2.332667 5.5445865 345831.54 2 4 1061Loop time of 0.0555945 on 4 procs for 64 steps with 577 atoms 1062 1063Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1064 86000 502.24946 -3198.3217 0.28404879 729.59623 0.19715785 569 560 5.9965398 0.18894186 0.0012325581 2.332667 5.5445865 345831.54 2 4 1065 87000 533.23227 -3199.0076 0.38185976 7062.731 0.14582607 266 268 5.9965398 0.18741379 0.0012183908 2.332667 5.5445865 352138.83 2 4 1066Loop time of 0.200219 on 4 procs for 1000 steps with 577 atoms 1067 1068Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1069 87000 533.23227 -3199.0076 0.38185976 7062.731 0.14582607 266 268 5.9965398 0.18741379 0.0012183908 2.332667 5.5445865 352138.83 2 4 1070 87051 533.23227 -3217.9192 0.38185976 7062.731 0.14582607 266 268 5.9965398 0.18730399 0.001217677 2.332667 5.5445865 352138.83 2 4 1071Loop time of 0.0225247 on 4 procs for 51 steps with 577 atoms 1072 1073Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1074 87000 533.23227 -3199.0076 0.38185976 7062.731 0.14582607 266 268 5.9965398 0.18741379 0.0012183908 2.332667 5.5445865 352138.83 2 4 1075 88000 500.37277 -3198.2649 0.11994657 16.181057 0.26155232 121 419 5.9965398 0.18643182 0.0012045455 2.332667 5.5445865 360427.01 2 4 1076Loop time of 0.160607 on 4 procs for 1000 steps with 577 atoms 1077 1078Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1079 88000 500.37277 -3198.2649 0.11994657 16.181057 0.26155232 121 419 5.9965398 0.18643182 0.0012045455 2.332667 5.5445865 360427.01 2 4 1080 88052 500.37277 -3217.9192 0.11994657 16.181057 0.26155232 121 419 5.9965398 0.18632172 0.0012038341 2.332667 5.5445865 360427.01 2 4 1081Loop time of 0.0185262 on 4 procs for 52 steps with 577 atoms 1082 1083Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1084 88000 500.37277 -3198.2649 0.11994657 16.181057 0.26155232 121 419 5.9965398 0.18643182 0.0012045455 2.332667 5.5445865 360427.01 2 4 1085 89000 510.3713 -3198.1715 0.079294834 6.2987714 0.27518526 124 135 5.9965398 0.1861236 0.0011910112 2.332667 5.5445865 368061.42 2 4 1086Loop time of 0.157259 on 4 procs for 1000 steps with 577 atoms 1087 1088Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1089 89000 510.3713 -3198.1715 0.079294834 6.2987714 0.27518526 124 135 5.9965398 0.1861236 0.0011910112 2.332667 5.5445865 368061.42 2 4 1090 89059 510.3713 -3217.9192 0.079294834 6.2987714 0.27518526 124 135 5.9965398 0.18600029 0.0011902222 2.332667 5.5445865 368061.42 2 4 1091Loop time of 0.0206097 on 4 procs for 59 steps with 577 atoms 1092 1093Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1094 89000 510.3713 -3198.1715 0.079294834 6.2987714 0.27518526 124 135 5.9965398 0.1861236 0.0011910112 2.332667 5.5445865 368061.42 2 4 1095 90000 445.05079 -3197.1115 0.03145569 2.0751956 0.29041001 287 288 5.9965398 0.18517778 0.0011777778 2.332667 5.5445865 374425.2 2 4 1096Loop time of 0.149199 on 4 procs for 1000 steps with 577 atoms 1097 1098Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1099 90000 445.05079 -3197.1115 0.03145569 2.0751956 0.29041001 287 288 5.9965398 0.18517778 0.0011777778 2.332667 5.5445865 374425.2 2 4 1100 90054 445.05079 -3217.9192 0.03145569 2.0751956 0.29041001 287 288 5.9965398 0.18506674 0.0011770715 2.332667 5.5445865 374425.2 2 4 1101Loop time of 0.0193175 on 4 procs for 54 steps with 577 atoms 1102 1103Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1104 90000 445.05079 -3197.1115 0.03145569 2.0751956 0.29041001 287 288 5.9965398 0.18517778 0.0011777778 2.332667 5.5445865 374425.2 2 4 1105 91000 471.80198 -3197.5975 0.18766746 77.911686 0.23710727 551 256 5.9965398 0.18674725 0.0011648352 2.332667 5.5445865 374977.4 2 4 1106Loop time of 0.147735 on 4 procs for 1000 steps with 577 atoms 1107 1108Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1109 91000 471.80198 -3197.5975 0.18766746 77.911686 0.23710727 551 256 5.9965398 0.18674725 0.0011648352 2.332667 5.5445865 374977.4 2 4 1110 91054 471.80198 -3217.9192 0.18766746 77.911686 0.23710727 551 256 5.9965398 0.1866365 0.0011641444 2.332667 5.5445865 374977.4 2 4 1111Loop time of 0.0194244 on 4 procs for 54 steps with 577 atoms 1112 1113Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1114 91000 471.80198 -3197.5975 0.18766746 77.911686 0.23710727 551 256 5.9965398 0.18674725 0.0011648352 2.332667 5.5445865 374977.4 2 4 1115 92000 482.89055 -3197.7684 0 1 0.90550005 550 256 5.9965398 0.19525 0.0011521739 2.332667 5.5445865 374983.58 2 4 1116Loop time of 0.16266 on 4 procs for 1000 steps with 577 atoms 1117 1118Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1119 92000 482.89055 -3197.7684 0 1 0.90550005 550 256 5.9965398 0.19525 0.0011521739 2.332667 5.5445865 374983.58 2 4 1120 92053 482.89055 -3217.9192 0 1 0.90550005 550 256 5.9965398 0.19513758 0.0011515105 2.332667 5.5445865 374983.58 2 4 1121Loop time of 0.0194454 on 4 procs for 53 steps with 577 atoms 1122 1123Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1124 92000 482.89055 -3197.7684 0.37282949 5727.3228 0.1512967 126 128 5.9965398 0.19525 0.0011521739 2.332667 5.5445865 374983.58 3 6 1125 93000 518.34364 -3197.7169 0.33208414 2224.6263 0.17385297 404 415 5.9965398 0.19386022 0.0011397849 2.332667 5.5445865 379383.21 3 6 1126Loop time of 0.14771 on 4 procs for 1000 steps with 577 atoms 1127 1128Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1129 93000 518.34364 -3197.7169 0.33208414 2224.6263 0.17385297 404 415 5.9965398 0.19386022 0.0011397849 2.332667 5.5445865 379383.21 3 6 1130 93052 518.34364 -3217.9192 0.33208414 2224.6263 0.17385297 404 415 5.9965398 0.19375188 0.001139148 2.332667 5.5445865 379383.21 3 6 1131Loop time of 0.0189104 on 4 procs for 52 steps with 577 atoms 1132 1133Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1134 93000 518.34364 -3197.7169 0.33208414 2224.6263 0.17385297 404 415 5.9965398 0.19386022 0.0011397849 2.332667 5.5445865 379383.21 3 6 1135 94000 485.54152 -3199.6114 0.33161662 2200.6179 0.17409483 254 255 5.9965398 0.19275532 0.0011276596 2.332667 5.5445865 386607.7 3 6 1136Loop time of 0.152505 on 4 procs for 1000 steps with 577 atoms 1137 1138Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1139 94000 485.54152 -3199.6114 0.33161662 2200.6179 0.17409483 254 255 5.9965398 0.19275532 0.0011276596 2.332667 5.5445865 386607.7 3 6 1140 94054 485.54152 -3217.9192 0.33161662 2200.6179 0.17409483 254 255 5.9965398 0.19264465 0.0011270121 2.332667 5.5445865 386607.7 3 6 1141Loop time of 0.0200894 on 4 procs for 54 steps with 577 atoms 1142 1143Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1144 94000 485.54152 -3199.6114 0.33161662 2200.6179 0.17409483 254 255 5.9965398 0.19275532 0.0011276596 2.332667 5.5445865 386607.7 3 6 1145 95000 468.35272 -3199.3653 0.12708244 19.095595 0.25908524 255 260 5.9965398 0.19384211 0.0011157895 2.332667 5.5445865 388255.15 3 6 1146Loop time of 0.170403 on 4 procs for 1000 steps with 577 atoms 1147 1148Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1149 95000 468.35272 -3199.3653 0.12708244 19.095595 0.25908524 255 260 5.9965398 0.19384211 0.0011157895 2.332667 5.5445865 388255.15 3 6 1150 95058 468.35272 -3217.9192 0.12708244 19.095595 0.25908524 255 260 5.9965398 0.19372383 0.0011151087 2.332667 5.5445865 388255.15 3 6 1151Loop time of 0.0303804 on 4 procs for 58 steps with 577 atoms 1152 1153Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1154 95000 468.35272 -3199.3653 0.12708244 19.095595 0.25908524 255 260 5.9965398 0.19384211 0.0011157895 2.332667 5.5445865 388255.15 3 6 1155 96000 489.04774 -3198.5653 0.20052634 105.00604 0.23217506 132 143 5.9965398 0.19276042 0.0012291667 2.332667 5.5445865 394084.75 3 6 1156Loop time of 0.243084 on 4 procs for 1000 steps with 577 atoms 1157 1158Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1159 96000 489.04774 -3198.5653 0.20052634 105.00604 0.23217506 132 143 5.9965398 0.19276042 0.0012291667 2.332667 5.5445865 394084.75 3 6 1160 96055 489.04774 -3217.9192 0.20052634 105.00604 0.23217506 132 143 5.9965398 0.19265004 0.0012284629 2.332667 5.5445865 394084.75 3 6 1161Loop time of 0.0209683 on 4 procs for 55 steps with 577 atoms 1162 1163Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1164 96000 489.04774 -3198.5653 0.20052634 105.00604 0.23217506 132 143 5.9965398 0.19276042 0.0012291667 2.332667 5.5445865 394084.75 3 6 1165 97000 468.88641 -3198.7099 0.24800267 316.04874 0.21297774 138 139 5.9965398 0.19249485 0.0012268041 2.332667 5.5445865 399765.39 3 6 1166Loop time of 0.159347 on 4 procs for 1000 steps with 577 atoms 1167 1168Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1169 97000 468.88641 -3198.7099 0.24800267 316.04874 0.21297774 138 139 5.9965398 0.19249485 0.0012268041 2.332667 5.5445865 399765.39 3 6 1170 97061 468.88641 -3217.9192 0.24800267 316.04874 0.21297774 138 139 5.9965398 0.19237387 0.0012260331 2.332667 5.5445865 399765.39 3 6 1171Loop time of 0.0222729 on 4 procs for 61 steps with 577 atoms 1172 1173Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1174 97000 468.88641 -3198.7099 0.24800267 316.04874 0.21297774 138 139 5.9965398 0.19249485 0.0012268041 2.332667 5.5445865 399765.39 3 6 1175 98000 511.90651 -3198.375 0.28991077 835.9276 0.19446352 575 280 5.9965398 0.19118367 0.0012142857 2.332667 5.5445865 405890.91 3 6 1176Loop time of 0.179737 on 4 procs for 1000 steps with 577 atoms 1177 1178Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1179 98000 511.90651 -3198.375 0.28991077 835.9276 0.19446352 575 280 5.9965398 0.19118367 0.0012142857 2.332667 5.5445865 405890.91 3 6 1180 98057 511.90651 -3217.9192 0.28991077 835.9276 0.19446352 575 280 5.9965398 0.19107254 0.0012135799 2.332667 5.5445865 405890.91 3 6 1181Loop time of 0.0226798 on 4 procs for 57 steps with 577 atoms 1182 1183Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1184 98000 511.90651 -3198.375 0.28991077 835.9276 0.19446352 575 280 5.9965398 0.19118367 0.0012142857 2.332667 5.5445865 405890.91 3 6 1185 99000 515.7066 -3198.7898 0.029498662 1.9830474 0.29101588 267 260 5.9965398 0.19046465 0.0012020202 2.332667 5.5445865 410566.28 3 6 1186Loop time of 0.162221 on 4 procs for 1000 steps with 577 atoms 1187 1188Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1189 99000 515.7066 -3198.7898 0.029498662 1.9830474 0.29101588 267 260 5.9965398 0.19046465 0.0012020202 2.332667 5.5445865 410566.28 3 6 1190 99056 515.7066 -3217.9192 0.029498662 1.9830474 0.29101588 267 260 5.9965398 0.19035697 0.0012013407 2.332667 5.5445865 410566.28 3 6 1191Loop time of 0.029222 on 4 procs for 56 steps with 577 atoms 1192 1193Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1194 99000 515.7066 -3198.7898 0.029498662 1.9830474 0.29101588 267 260 5.9965398 0.19046465 0.0012020202 2.332667 5.5445865 410566.28 3 6 1195 100000 470.91344 -3199.3671 0.38510929 7615.9914 0.14380656 217 515 5.9965398 0.19106 0.00119 2.332667 5.5445865 413625.31 3 6 1196Loop time of 0.200459 on 4 procs for 1000 steps with 577 atoms 1197 1198Step Temp PotEng f_HG f_HG[1] f_HG[2] f_HG[3] f_HG[4] f_HG[5] f_HG[6] f_HG[7] f_HG[8] f_HG[9] f_HG[10] f_HG[11] f_HG[12] 1199 100000 470.91344 -3199.3671 0.38510929 7615.9914 0.14380656 217 515 5.9965398 0.19106 0.00119 2.332667 5.5445865 413625.31 3 6 1200 100051 470.91344 -3217.9192 0.38510929 7615.9914 0.14380656 217 515 5.9965398 0.19096261 0.0011893934 2.332667 5.5445865 413625.31 3 6 1201Loop time of 0.0181701 on 4 procs for 51 steps with 577 atoms 1202 1203Final hyper stats ... 1204 1205Cummulative quantities for fix hyper: 1206 hyper time = 413625 1207 time boost factor = 827.251 1208 event timesteps = 3 1209 # of atoms in events = 6 1210Quantities for this hyper run: 1211 event timesteps = 3 1212 # of atoms in events = 6 1213 max length of any bond = 5.54459 1214 max drift distance of any atom = 2.33267 1215 fraction of biased bonds with zero bias = 0.19106 1216 fraction of biased bonds with negative strain = 0.00119 1217Current quantities: 1218 ave bonds/atom = 5.99654 1219 1220Loop time of 18.1545 on 4 procs for 100000 steps with 577 atoms 1221 1222Performance: 2379.577 ns/day, 0.010 hours/ns, 5508.280 timesteps/s 122397.2% CPU use with 4 MPI tasks x 1 OpenMP threads 1224 1225Hyper stats: 1226 Dynamics time (%) = 15.7932 (86.9934) 1227 Quench time (%) = 2.11457 (11.6476) 1228 Other time (%) = 0.613371 (3.37862) 1229 1230MPI task timing breakdown: 1231Section | min time | avg time | max time |%varavg| %total 1232--------------------------------------------------------------- 1233Pair | 12.753 | 12.889 | 13.038 | 3.0 | 71.00 1234Neigh | 1.1332 | 1.1557 | 1.1781 | 1.5 | 6.37 1235Comm | 1.4019 | 1.4415 | 1.5107 | 3.5 | 7.94 1236Output | 0.0022557 | 0.0055519 | 0.015418 | 7.6 | 0.03 1237Modify | 1.9349 | 2.049 | 2.182 | 6.2 | 11.29 1238Other | | 0.6134 | | | 3.38 1239 1240Nlocal: 144.25 ave 149 max 141 min 1241Histogram: 1 1 0 0 0 1 0 0 0 1 1242Nghost: 532.75 ave 536 max 528 min 1243Histogram: 1 0 0 0 0 1 0 0 1 1 1244Neighs: 3377.5 ave 3479 max 3296 min 1245Histogram: 1 0 0 1 1 0 0 0 0 1 1246 1247Total # of neighbors = 13510 1248Ave neighs/atom = 23.4142 1249Neighbor list builds = 10038 1250Dangerous builds = 0 1251Total wall time: 0:00:18 1252