lj_table.txt
c954b454bac9lammps-icms

lj_table.txt
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			# Pair potential lj/cut for atom types 1 1: i,r,energy,force

			lj_rsq
			N 1000 RSQ 0.1 2.5

			1 0.1 4e+12 4.8e+14
			2 0.127461 2.1754e+11 2.04807e+13
			3 0.149975 3.08908e+10 2.47169e+12
			4 0.169525 7.09976e+09 5.02569e+11
			5 0.187043 2.18148e+09 1.39959e+11
			6 0.203055 8.14089e+08 4.81122e+10
			7 0.217893 3.49211e+08 1.92331e+10
			8 0.231784 1.6634e+08 8.61247e+09
			9 0.244888 8.59732e+07 4.21332e+09
			10 0.257325 4.74403e+07 2.21264e+09
			11 0.269189 2.76195e+07 1.23147e+09
			12 0.280551 1.68156e+07 7.19428e+08
			13 0.29147 1.06331e+07 4.37907e+08
			14 0.301995 6.94588e+06 2.76104e+08
			15 0.312166 4.66697e+06 1.79487e+08
			16 0.322015 3.21412e+06 1.19842e+08
			17 0.331572 2.2623e+06 8.19298e+07
			18 0.340861 1.6235e+06 5.72e+07
			19 0.349903 1.18545e+06 4.06926e+07
			20 0.358718 879213 2.94432e+07
			21 0.367321 661361 2.16326e+07
			22 0.375728 503918 1.61169e+07
			23 0.38395 388484 1.21612e+07
			24 0.392 302729 9.2841e+06
			25 0.399887 238247 7.16411e+06
			26 0.407623 189219 5.58325e+06
			27 0.415214 151555 4.39132e+06
			28 0.422668 122343 3.4834e+06
			29 0.429994 99484.8 2.78519e+06
			30 0.437197 81450.1 2.24347e+06
			31 0.444283 67110.5 1.81967e+06
			32 0.451258 55626.3 1.48553e+06
			33 0.458126 46366.2 1.22017e+06
			34 0.464894 38851.7 1.00797e+06
			35 0.471564 32717 837185
			36 0.478141 27680.2 698897
			37 0.484629 23522.8 586275
			38 0.491031 20073.6 494054
			39 0.49735 17198.4 418149
			40 0.503591 14790.6 355365
			41 0.509755 12765.5 303192
			42 0.515845 11055.2 259645
			43 0.521864 9605.2 223143
			44 0.527815 8371.18 192424
			45 0.533699 7317.24 166471
			46 0.539519 6414.03 144465
			47 0.545277 5637.45 125739
			48 0.550975 4967.67 109751
			49 0.556615 4388.27 96056.2
			50 0.562198 3885.61 84289.6
			51 0.567726 3448.32 74149.6
			52 0.5732 3066.9 65386.4
			53 0.578623 2733.36 57792.1
			54 0.583996 2440.98 51193.5
			55 0.589319 2184.07 45445.3
			56 0.594595 1957.83 40425.8
			57 0.599825 1758.14 36032.2
			58 0.605009 1581.53 32177.6
			59 0.610149 1425.01 28788.6
			60 0.615247 1286.03 25802.4
			61 0.620302 1162.38 23165.9
			62 0.625317 1052.17 20833.4
			63 0.630291 953.769 18766
			64 0.635227 865.759 16930
			65 0.640125 786.914 15296.7
			66 0.644985 716.165 13841.1
			67 0.649809 652.583 12541.8
			68 0.654598 595.355 11380
			69 0.659352 543.772 10339.5
			70 0.664072 497.212 9406.2
			71 0.668758 455.127 8567.84
			72 0.673412 417.037 7813.64
			73 0.678034 382.519 7134.21
			74 0.682624 351.198 6521.27
			75 0.687184 322.744 5967.6
			76 0.691714 296.863 5466.8
			77 0.696215 273.296 5013.25
			78 0.700686 251.813 4602
			79 0.705129 232.207 4228.65
			80 0.709545 214.297 3889.31
			81 0.713933 197.918 3580.53
			82 0.718294 182.925 3299.26
			83 0.722629 169.186 3042.76
			84 0.726938 156.587 2808.6
			85 0.731221 145.02 2594.63
			86 0.73548 134.393 2398.91
			87 0.739714 124.62 2219.69
			88 0.743924 115.626 2055.45
			89 0.748111 107.34 1904.78
			90 0.752274 99.7022 1766.44
			91 0.756414 92.6554 1639.31
			92 0.760532 86.1492 1522.38
			93 0.764627 80.1376 1414.73
			94 0.768701 74.579 1315.56
			95 0.772753 69.4358 1224.12
			96 0.776784 64.6735 1139.74
			97 0.780794 60.2611 1061.81
			98 0.784784 56.1701 989.794
			99 0.788754 52.3749 923.189
			100 0.792703 48.8518 861.544
			101 0.796633 45.5794 804.45
			102 0.800544 42.538 751.534
			103 0.804436 39.7098 702.459
			104 0.808309 37.0784 656.914
			105 0.812164 34.6287 614.62
			106 0.816 32.347 575.319
			107 0.819818 30.2208 538.778
			108 0.823619 28.2384 504.781
			109 0.827402 26.3892 473.133
			110 0.831168 24.6634 443.655
			111 0.834917 23.0522 416.183
			112 0.83865 21.5472 390.565
			113 0.842365 20.1409 366.664
			114 0.846065 18.8261 344.353
			115 0.849748 17.5965 323.516
			116 0.853416 16.4461 304.044
			117 0.857067 15.3694 285.84
			118 0.860704 14.3613 268.813
			119 0.864325 13.4171 252.879
			120 0.86793 12.5325 237.961
			121 0.871521 11.7033 223.987
			122 0.875098 10.9259 210.893
			123 0.878659 10.1969 198.617
			124 0.882206 9.51296 187.104
			125 0.88574 8.87119 176.301
			126 0.889259 8.2688 166.16
			127 0.892764 7.70324 156.638
			128 0.896255 7.17212 147.692
			129 0.899733 6.67322 139.285
			130 0.903198 6.20449 131.381
			131 0.906649 5.76401 123.948
			132 0.910087 5.34999 116.955
			133 0.913512 4.96077 110.373
			134 0.916925 4.59481 104.176
			135 0.920324 4.25064 98.3402
			136 0.923712 3.92694 92.8421
			137 0.927087 3.62243 87.6606
			138 0.930449 3.33595 82.776
			139 0.9338 3.06639 78.1699
			140 0.937138 2.81273 73.825
			141 0.940465 2.57402 69.7254
			142 0.94378 2.34935 65.8561
			143 0.947083 2.13789 62.2032
			144 0.950375 1.93885 58.7536
			145 0.953656 1.7515 55.4951
			146 0.956925 1.57515 52.4163
			147 0.960183 1.40915 49.5067
			148 0.96343 1.2529 46.7562
			149 0.966667 1.10583 44.1556
			150 0.969892 0.967411 41.696
			151 0.973107 0.837141 39.3694
			152 0.976311 0.714552 37.168
			153 0.979505 0.599205 35.0847
			154 0.982688 0.490686 33.1127
			155 0.985861 0.388606 31.2457
			156 0.989024 0.2926 29.4779
			157 0.992177 0.202325 27.8035
			158 0.995319 0.117459 26.2174
			159 0.998452 0.0376966 24.7147
			160 1.00158 -0.037247 23.2907
			161 1.00469 -0.107641 21.9412
			162 1.00779 -0.17374 20.662
			163 1.01089 -0.23578 19.4493
			164 1.01397 -0.293989 18.2994
			165 1.01705 -0.348577 17.209
			166 1.02011 -0.399743 16.1749
			167 1.02317 -0.447678 15.194
			168 1.02622 -0.492557 14.2636
			169 1.02926 -0.53455 13.3808
			170 1.03229 -0.573813 12.5432
			171 1.03531 -0.610496 11.7485
			172 1.03832 -0.644739 10.9943
			173 1.04132 -0.676677 10.2785
			174 1.04432 -0.706434 9.59917
			175 1.0473 -0.73413 8.95437
			176 1.05028 -0.759876 8.34232
			177 1.05325 -0.783778 7.76133
			178 1.05621 -0.805936 7.2098
			179 1.05917 -0.826446 6.68623
			180 1.06211 -0.845396 6.1892
			181 1.06505 -0.862872 5.71734
			182 1.06797 -0.878953 5.26939
			183 1.0709 -0.893715 4.84415
			184 1.07381 -0.907231 4.44045
			185 1.07671 -0.919567 4.05724
			186 1.07961 -0.930789 3.69347
			187 1.0825 -0.940956 3.34818
			188 1.08538 -0.950127 3.02046
			189 1.08825 -0.958356 2.70943
			190 1.09112 -0.965695 2.41426
			191 1.09398 -0.972193 2.13418
			192 1.09683 -0.977896 1.86844
			193 1.09967 -0.982847 1.61634
			194 1.10251 -0.98709 1.37721
			195 1.10534 -0.990663 1.15041
			196 1.10816 -0.993603 0.935356
			197 1.11097 -0.995947 0.731467
			198 1.11378 -0.997727 0.538203
			199 1.11658 -0.998975 0.35505
			200 1.11938 -0.999723 0.181521
			201 1.12216 -0.999997 0.0171515
			202 1.12494 -0.999827 -0.138499
			203 1.12772 -0.999237 -0.285849
			204 1.13048 -0.998252 -0.425297
			205 1.13324 -0.996894 -0.557221
			206 1.13599 -0.995187 -0.681979
			207 1.13874 -0.993151 -0.799915
			208 1.14148 -0.990806 -0.911354
			209 1.14421 -0.98817 -1.0166
			210 1.14694 -0.985262 -1.11596
			211 1.14966 -0.982098 -1.2097
			212 1.15237 -0.978695 -1.2981
			213 1.15508 -0.975067 -1.3814
			214 1.15778 -0.97123 -1.45984
			215 1.16047 -0.967196 -1.53367
			216 1.16316 -0.962979 -1.60309
			217 1.16584 -0.958591 -1.66832
			218 1.16852 -0.954044 -1.72955
			219 1.17119 -0.94935 -1.78697
			220 1.17385 -0.944517 -1.84076
			221 1.17651 -0.939558 -1.8911
			222 1.17916 -0.93448 -1.93814
			223 1.18181 -0.929294 -1.98205
			224 1.18445 -0.924007 -2.02297
			225 1.18708 -0.918628 -2.06105
			226 1.18971 -0.913165 -2.09641
			227 1.19233 -0.907624 -2.12919
			228 1.19495 -0.902013 -2.15951
			229 1.19756 -0.896338 -2.18749
			230 1.20016 -0.890605 -2.21324
			231 1.20276 -0.884821 -2.23686
			232 1.20536 -0.878991 -2.25847
			233 1.20794 -0.873119 -2.27814
			234 1.21053 -0.867212 -2.29599
			235 1.2131 -0.861274 -2.31209
			236 1.21568 -0.855309 -2.32653
			237 1.21824 -0.849321 -2.33939
			238 1.2208 -0.843315 -2.35074
			239 1.22336 -0.837295 -2.36067
			240 1.22591 -0.831263 -2.36924
			241 1.22845 -0.825224 -2.37651
			242 1.23099 -0.819181 -2.38256
			243 1.23353 -0.813136 -2.38743
			244 1.23606 -0.807092 -2.3912
			245 1.23858 -0.801053 -2.39391
			246 1.2411 -0.79502 -2.39562
			247 1.24361 -0.788997 -2.39638
			248 1.24612 -0.782985 -2.39624
			249 1.24863 -0.776986 -2.39523
			250 1.25113 -0.771003 -2.39342
			251 1.25362 -0.765038 -2.39084
			252 1.25611 -0.759092 -2.38752
			253 1.25859 -0.753166 -2.38352
			254 1.26107 -0.747263 -2.37886
			255 1.26355 -0.741384 -2.37358
			256 1.26601 -0.73553 -2.36771
			257 1.26848 -0.729702 -2.36129
			258 1.27094 -0.723903 -2.35434
			259 1.27339 -0.718132 -2.3469
			260 1.27584 -0.712391 -2.339
			261 1.27829 -0.706681 -2.33065
			262 1.28073 -0.701003 -2.32189
			263 1.28317 -0.695357 -2.31273
			264 1.2856 -0.689745 -2.30321
			265 1.28803 -0.684167 -2.29335
			266 1.29045 -0.678624 -2.28315
			267 1.29287 -0.673116 -2.27266
			268 1.29528 -0.667644 -2.26188
			269 1.29769 -0.662208 -2.25084
			270 1.30009 -0.65681 -2.23954
			271 1.30249 -0.651449 -2.22801
			272 1.30489 -0.646125 -2.21627
			273 1.30728 -0.64084 -2.20433
			274 1.30967 -0.635593 -2.1922
			275 1.31205 -0.630385 -2.1799
			276 1.31443 -0.625215 -2.16744
			277 1.3168 -0.620085 -2.15484
			278 1.31917 -0.614994 -2.1421
			279 1.32154 -0.609942 -2.12923
			280 1.3239 -0.60493 -2.11626
			281 1.32625 -0.599958 -2.10319
			282 1.32861 -0.595025 -2.09002
			283 1.33096 -0.590132 -2.07678
			284 1.3333 -0.585278 -2.06346
			285 1.33564 -0.580465 -2.05008
			286 1.33798 -0.575691 -2.03664
			287 1.34031 -0.570957 -2.02315
			288 1.34264 -0.566262 -2.00963
			289 1.34496 -0.561608 -1.99607
			290 1.34728 -0.556992 -1.98249
			291 1.3496 -0.552416 -1.96888
			292 1.35191 -0.54788 -1.95527
			293 1.35422 -0.543382 -1.94164
			294 1.35652 -0.538924 -1.92802
			295 1.35882 -0.534505 -1.9144
			296 1.36112 -0.530124 -1.90078
			297 1.36341 -0.525782 -1.88718
			298 1.3657 -0.521478 -1.8736
			299 1.36798 -0.517212 -1.86004
			300 1.37027 -0.512985 -1.8465
			301 1.37254 -0.508795 -1.83299
			302 1.37482 -0.504643 -1.81952
			303 1.37709 -0.500529 -1.80609
			304 1.37935 -0.496451 -1.79269
			305 1.38161 -0.49241 -1.77934
			306 1.38387 -0.488407 -1.76604
			307 1.38613 -0.484439 -1.75278
			308 1.38838 -0.480508 -1.73958
			309 1.39063 -0.476613 -1.72643
			310 1.39287 -0.472753 -1.71333
			311 1.39511 -0.468929 -1.7003
			312 1.39735 -0.465141 -1.68732
			313 1.39958 -0.461387 -1.67441
			314 1.40181 -0.457668 -1.66156
			315 1.40404 -0.453983 -1.64878
			316 1.40626 -0.450333 -1.63607
			317 1.40848 -0.446716 -1.62342
			318 1.41069 -0.443133 -1.61085
			319 1.41291 -0.439583 -1.59835
			320 1.41512 -0.436067 -1.58592
			321 1.41732 -0.432583 -1.57357
			322 1.41952 -0.429132 -1.56129
			323 1.42172 -0.425713 -1.54908
			324 1.42392 -0.422326 -1.53696
			325 1.42611 -0.418971 -1.52491
			326 1.4283 -0.415647 -1.51294
			327 1.43048 -0.412354 -1.50105
			328 1.43266 -0.409093 -1.48923
			329 1.43484 -0.405861 -1.4775
			330 1.43702 -0.402661 -1.46585
			331 1.43919 -0.39949 -1.45428
			332 1.44136 -0.396349 -1.4428
			333 1.44352 -0.393237 -1.43139
			334 1.44568 -0.390155 -1.42007
			335 1.44784 -0.387101 -1.40883
			336 1.45 -0.384077 -1.39767
			337 1.45215 -0.381081 -1.38659
			338 1.4543 -0.378112 -1.3756
			339 1.45644 -0.375172 -1.36469
			340 1.45859 -0.37226 -1.35386
			341 1.46073 -0.369374 -1.34312
			342 1.46286 -0.366516 -1.33245
			343 1.465 -0.363685 -1.32187
			344 1.46713 -0.36088 -1.31138
			345 1.46925 -0.358102 -1.30096
			346 1.47138 -0.355349 -1.29063
			347 1.4735 -0.352623 -1.28038
			348 1.47562 -0.349922 -1.27022
			349 1.47773 -0.347246 -1.26013
			350 1.47984 -0.344595 -1.25012
			351 1.48195 -0.341969 -1.2402
			352 1.48406 -0.339368 -1.23036
			353 1.48616 -0.336791 -1.2206
			354 1.48826 -0.334237 -1.21092
			355 1.49036 -0.331708 -1.20132
			356 1.49245 -0.329203 -1.19179
			357 1.49454 -0.32672 -1.18235
			358 1.49663 -0.324261 -1.17299
			359 1.49872 -0.321825 -1.1637
			360 1.5008 -0.319411 -1.1545
			361 1.50288 -0.31702 -1.14537
			362 1.50496 -0.31465 -1.13632
			363 1.50703 -0.312303 -1.12734
			364 1.5091 -0.309978 -1.11844
			365 1.51117 -0.307674 -1.10962
			366 1.51323 -0.305391 -1.10087
			367 1.5153 -0.30313 -1.0922
			368 1.51736 -0.300889 -1.0836
			369 1.51941 -0.298669 -1.07508
			370 1.52147 -0.296469 -1.06663
			371 1.52352 -0.29429 -1.05825
			372 1.52557 -0.292131 -1.04995
			373 1.52761 -0.289991 -1.04171
			374 1.52966 -0.287871 -1.03355
			375 1.5317 -0.285771 -1.02546
			376 1.53373 -0.283689 -1.01744
			377 1.53577 -0.281627 -1.00949
			378 1.5378 -0.279583 -1.00161
			379 1.53983 -0.277558 -0.993803
			380 1.54186 -0.275552 -0.98606
			381 1.54388 -0.273564 -0.978386
			382 1.5459 -0.271594 -0.970778
			383 1.54792 -0.269641 -0.963238
			384 1.54994 -0.267707 -0.955764
			385 1.55195 -0.265789 -0.948356
			386 1.55396 -0.26389 -0.941013
			387 1.55597 -0.262007 -0.933735
			388 1.55798 -0.260141 -0.926521
			389 1.55998 -0.258292 -0.919371
			390 1.56198 -0.25646 -0.912284
			391 1.56398 -0.254644 -0.90526
			392 1.56598 -0.252844 -0.898297
			393 1.56797 -0.251061 -0.891397
			394 1.56996 -0.249293 -0.884557
			395 1.57195 -0.247542 -0.877779
			396 1.57393 -0.245805 -0.87106
			397 1.57592 -0.244085 -0.8644
			398 1.5779 -0.242379 -0.8578
			399 1.57988 -0.240689 -0.851258
			400 1.58185 -0.239014 -0.844775
			401 1.58382 -0.237353 -0.838348
			402 1.58579 -0.235707 -0.831979
			403 1.58776 -0.234076 -0.825666
			404 1.58973 -0.232459 -0.819409
			405 1.59169 -0.230856 -0.813208
			406 1.59365 -0.229268 -0.807062
			407 1.59561 -0.227693 -0.80097
			408 1.59757 -0.226132 -0.794932
			409 1.59952 -0.224585 -0.788947
			410 1.60147 -0.223051 -0.783016
			411 1.60342 -0.221531 -0.777137
			412 1.60537 -0.220024 -0.77131
			413 1.60731 -0.21853 -0.765535
			414 1.60925 -0.217049 -0.759811
			415 1.61119 -0.215581 -0.754138
			416 1.61313 -0.214125 -0.748514
			417 1.61507 -0.212682 -0.742941
			418 1.617 -0.211252 -0.737416
			419 1.61893 -0.209834 -0.731941
			420 1.62086 -0.208428 -0.726514
			421 1.62278 -0.207034 -0.721134
			422 1.62471 -0.205652 -0.715802
			423 1.62663 -0.204282 -0.710517
			424 1.62855 -0.202924 -0.705279
			425 1.63046 -0.201577 -0.700087
			426 1.63238 -0.200242 -0.69494
			427 1.63429 -0.198918 -0.689839
			428 1.6362 -0.197605 -0.684782
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			822 2.26675 -0.0292699 -0.0769009
			823 2.26813 -0.0291642 -0.0765788
			824 2.26951 -0.029059 -0.0762583
			825 2.27088 -0.0289543 -0.0759396
			826 2.27226 -0.0288502 -0.0756226
			827 2.27363 -0.0287465 -0.0753073
			828 2.275 -0.0286433 -0.0749937
			829 2.27638 -0.0285406 -0.0746817
			830 2.27775 -0.0284383 -0.0743714
			831 2.27912 -0.0283366 -0.0740628
			832 2.28049 -0.0282354 -0.0737557
			833 2.28186 -0.0281346 -0.0734503
			834 2.28323 -0.0280343 -0.0731465
			835 2.28459 -0.0279345 -0.0728444
			836 2.28596 -0.0278351 -0.0725438
			837 2.28733 -0.0277363 -0.0722448
			838 2.28869 -0.0276379 -0.0719473
			839 2.29006 -0.0275399 -0.0716515
			840 2.29142 -0.0274424 -0.0713571
			841 2.29278 -0.0273454 -0.0710644
			842 2.29414 -0.0272488 -0.0707731
			843 2.2955 -0.0271527 -0.0704834
			844 2.29686 -0.027057 -0.0701952
			845 2.29822 -0.0269618 -0.0699085
			846 2.29958 -0.026867 -0.0696233
			847 2.30094 -0.0267727 -0.0693396
			848 2.3023 -0.0266788 -0.0690574
			849 2.30365 -0.0265853 -0.0687766
			850 2.30501 -0.0264923 -0.0684973
			851 2.30636 -0.0263997 -0.0682195
			852 2.30772 -0.0263075 -0.067943
			853 2.30907 -0.0262158 -0.067668
			854 2.31042 -0.0261245 -0.0673945
			855 2.31177 -0.0260336 -0.0671223
			856 2.31312 -0.0259431 -0.0668516
			857 2.31447 -0.0258531 -0.0665822
			858 2.31582 -0.0257634 -0.0663142
			859 2.31717 -0.0256742 -0.0660476
			860 2.31852 -0.0255854 -0.0657824
			861 2.31986 -0.025497 -0.0655186
			862 2.32121 -0.025409 -0.0652561
			863 2.32256 -0.0253214 -0.0649949
			864 2.3239 -0.0252342 -0.0647351
			865 2.32524 -0.0251474 -0.0644766
			866 2.32659 -0.025061 -0.0642194
			867 2.32793 -0.024975 -0.0639635
			868 2.32927 -0.0248894 -0.0637089
			869 2.33061 -0.0248041 -0.0634556
			870 2.33195 -0.0247193 -0.0632037
			871 2.33329 -0.0246348 -0.0629529
			872 2.33463 -0.0245508 -0.0627035
			873 2.33596 -0.0244671 -0.0624553
			874 2.3373 -0.0243838 -0.0622084
			875 2.33864 -0.0243008 -0.0619627
			876 2.33997 -0.0242183 -0.0617183
			877 2.34131 -0.0241361 -0.0614751
			878 2.34264 -0.0240543 -0.0612331
			879 2.34397 -0.0239728 -0.0609924
			880 2.3453 -0.0238917 -0.0607528
			881 2.34664 -0.023811 -0.0605145
			882 2.34797 -0.0237307 -0.0602773
			883 2.3493 -0.0236507 -0.0600413
			884 2.35062 -0.023571 -0.0598066
			885 2.35195 -0.0234917 -0.0595729
			886 2.35328 -0.0234128 -0.0593405
			887 2.35461 -0.0233342 -0.0591092
			888 2.35593 -0.023256 -0.0588791
			889 2.35726 -0.0231781 -0.0586501
			890 2.35858 -0.0231006 -0.0584222
			891 2.35991 -0.0230234 -0.0581955
			892 2.36123 -0.0229466 -0.0579699
			893 2.36255 -0.0228701 -0.0577455
			894 2.36387 -0.0227939 -0.0575221
			895 2.36519 -0.0227181 -0.0572998
			896 2.36651 -0.0226426 -0.0570787
			897 2.36783 -0.0225674 -0.0568586
			898 2.36915 -0.0224926 -0.0566396
			899 2.37047 -0.0224181 -0.0564217
			900 2.37179 -0.0223439 -0.0562049
			901 2.3731 -0.0222701 -0.0559891
			902 2.37442 -0.0221965 -0.0557744
			903 2.37573 -0.0221233 -0.0555607
			904 2.37705 -0.0220504 -0.0553481
			905 2.37836 -0.0219779 -0.0551366
			906 2.37967 -0.0219056 -0.054926
			907 2.38099 -0.0218337 -0.0547165
			908 2.3823 -0.0217621 -0.054508
			909 2.38361 -0.0216908 -0.0543006
			910 2.38492 -0.0216198 -0.0540941
			911 2.38623 -0.0215491 -0.0538886
			912 2.38754 -0.0214787 -0.0536842
			913 2.38884 -0.0214087 -0.0534807
			914 2.39015 -0.0213389 -0.0532782
			915 2.39146 -0.0212694 -0.0530767
			916 2.39276 -0.0212003 -0.0528762
			917 2.39407 -0.0211314 -0.0526766
			918 2.39537 -0.0210628 -0.052478
			919 2.39668 -0.0209946 -0.0522804
			920 2.39798 -0.0209266 -0.0520837
			921 2.39928 -0.0208589 -0.051888
			922 2.40058 -0.0207915 -0.0516932
			923 2.40188 -0.0207244 -0.0514993
			924 2.40318 -0.0206576 -0.0513064
			925 2.40448 -0.020591 -0.0511144
			926 2.40578 -0.0205248 -0.0509233
			927 2.40708 -0.0204588 -0.0507331
			928 2.40838 -0.0203931 -0.0505439
			929 2.40967 -0.0203277 -0.0503555
			930 2.41097 -0.0202626 -0.050168
			931 2.41226 -0.0201978 -0.0499815
			932 2.41356 -0.0201332 -0.0497958
			933 2.41485 -0.0200689 -0.049611
			934 2.41614 -0.0200049 -0.049427
			935 2.41744 -0.0199411 -0.049244
			936 2.41873 -0.0198776 -0.0490618
			937 2.42002 -0.0198144 -0.0488805
			938 2.42131 -0.0197515 -0.0487
			939 2.4226 -0.0196888 -0.0485204
			940 2.42389 -0.0196264 -0.0483416
			941 2.42517 -0.0195642 -0.0481637
			942 2.42646 -0.0195023 -0.0479866
			943 2.42775 -0.0194407 -0.0478104
			944 2.42903 -0.0193793 -0.0476349
			945 2.43032 -0.0193182 -0.0474603
			946 2.4316 -0.0192573 -0.0472866
			947 2.43289 -0.0191967 -0.0471136
			948 2.43417 -0.0191364 -0.0469414
			949 2.43546 -0.0190763 -0.0467701
			950 2.43674 -0.0190164 -0.0465995
			951 2.43802 -0.0189568 -0.0464298
			952 2.4393 -0.0188974 -0.0462608
			953 2.44058 -0.0188383 -0.0460926
			954 2.44186 -0.0187795 -0.0459252
			955 2.44314 -0.0187209 -0.0457586
			956 2.44442 -0.0186625 -0.0455927
			957 2.44569 -0.0186044 -0.0454277
			958 2.44697 -0.0185465 -0.0452634
			959 2.44825 -0.0184888 -0.0450998
			960 2.44952 -0.0184314 -0.044937
			961 2.4508 -0.0183742 -0.044775
			962 2.45207 -0.0183173 -0.0446137
			963 2.45334 -0.0182606 -0.0444531
			964 2.45462 -0.0182041 -0.0442933
			965 2.45589 -0.0181479 -0.0441342
			966 2.45716 -0.0180919 -0.0439759
			967 2.45843 -0.0180361 -0.0438183
			968 2.4597 -0.0179805 -0.0436614
			969 2.46097 -0.0179252 -0.0435052
			970 2.46224 -0.0178701 -0.0433497
			971 2.46351 -0.0178152 -0.043195
			972 2.46477 -0.0177606 -0.0430409
			973 2.46604 -0.0177062 -0.0428876
			974 2.46731 -0.017652 -0.0427349
			975 2.46857 -0.017598 -0.042583
			976 2.46984 -0.0175442 -0.0424317
			977 2.4711 -0.0174907 -0.0422812
			978 2.47236 -0.0174373 -0.0421313
			979 2.47363 -0.0173842 -0.0419821
			980 2.47489 -0.0173313 -0.0418336
			981 2.47615 -0.0172786 -0.0416857
			982 2.47741 -0.0172262 -0.0415385
			983 2.47867 -0.0171739 -0.041392
			984 2.47993 -0.0171219 -0.0412461
			985 2.48119 -0.01707 -0.0411009
			986 2.48245 -0.0170184 -0.0409564
			987 2.48371 -0.016967 -0.0408125
			988 2.48496 -0.0169157 -0.0406692
			989 2.48622 -0.0168647 -0.0405266
			990 2.48748 -0.0168139 -0.0403847
			991 2.48873 -0.0167633 -0.0402434
			992 2.48999 -0.0167129 -0.0401027
			993 2.49124 -0.0166627 -0.0399626
			994 2.49249 -0.0166127 -0.0398232
			995 2.49375 -0.0165629 -0.0396843
			996 2.495 -0.0165133 -0.0395461
			997 2.49625 -0.0164639 -0.0394086
			998 2.4975 -0.0164147 -0.0392716
			999 2.49875 -0.0163657 -0.0391352
			1000 2.5 0 0

			# Pair potential lj/cut for atom types 1 1: i,r,energy,force

			lj_r
			N 1000 R 0.1 2.5

			1 0.1 4e+12 4.8e+14
			2 0.102402 3.00841e+12 3.52541e+14
			3 0.104805 2.27764e+12 2.60787e+14
			4 0.107207 1.73529e+12 1.94236e+14
			5 0.10961 1.33007e+12 1.45616e+14
			6 0.112012 1.02538e+12 1.0985e+14
			7 0.114414 7.94859e+11 8.33664e+13
			8 0.116817 6.19433e+11 6.36313e+13
			9 0.119219 4.85181e+11 4.88359e+13
			10 0.121622 3.81882e+11 3.76791e+13
			11 0.124024 3.01987e+11 2.9219e+13
			12 0.126426 2.39885e+11 2.27692e+13
			13 0.128829 1.91382e+11 1.78267e+13
			14 0.131231 1.53324e+11 1.40203e+13
			15 0.133634 1.2333e+11 1.10748e+13
			16 0.136036 9.95886e+10 8.78493e+12
			17 0.138438 8.07192e+10 6.99685e+12
			18 0.140841 6.56619e+10 5.59458e+12
			19 0.143243 5.36002e+10 4.4903e+12
			20 0.145646 4.39021e+10 3.61719e+12
			21 0.148048 3.60764e+10 2.92418e+12
			22 0.15045 2.97395e+10 2.37205e+12
			23 0.152853 2.45908e+10 1.93056e+12
			24 0.155255 2.03938e+10 1.57629e+12
			25 0.157658 1.69618e+10 1.29105e+12
			26 0.16006 1.41468e+10 1.06062e+12
			27 0.162462 1.18308e+10 8.73872e+11
			28 0.164865 9.92005e+09 7.22057e+11
			29 0.167267 8.3391e+09 5.98266e+11
			30 0.16967 7.02747e+09 4.97028e+11
			31 0.172072 5.93641e+09 4.14e+11
			32 0.174474 5.02649e+09 3.45717e+11
			33 0.176877 4.26574e+09 2.89408e+11
			34 0.179279 3.62814e+09 2.42853e+11
			35 0.181682 3.09251e+09 2.04262e+11
			36 0.184084 2.64149e+09 1.72195e+11
			37 0.186486 2.26086e+09 1.45484e+11
			38 0.188889 1.93894e+09 1.23182e+11
			39 0.191291 1.66608e+09 1.04518e+11
			40 0.193694 1.43434e+09 8.88645e+10
			41 0.196096 1.23711e+09 7.57064e+10
			42 0.198498 1.06892e+09 6.46225e+10
			43 0.200901 9.25228e+08 5.52666e+10
			44 0.203303 8.02225e+08 4.73531e+10
			45 0.205706 6.9674e+08 4.06464e+10
			46 0.208108 6.06117e+08 3.49516e+10
			47 0.210511 5.28125e+08 3.01067e+10
			48 0.212913 4.60888e+08 2.59774e+10
			49 0.215315 4.02826e+08 2.24515e+10
			50 0.217718 3.52605e+08 1.94356e+10
			51 0.22012 3.09096e+08 1.68516e+10
			52 0.222523 2.71344e+08 1.46337e+10
			53 0.224925 2.38535e+08 1.2727e+10
			54 0.227327 2.09981e+08 1.10851e+10
			55 0.22973 1.85093e+08 9.66909e+09
			56 0.232132 1.63369e+08 8.44596e+09
			57 0.234535 1.4438e+08 7.38783e+09
			58 0.236937 1.27759e+08 6.47108e+09
			59 0.239339 1.1319e+08 5.67567e+09
			60 0.241742 1.00405e+08 4.98456e+09
			61 0.244144 8.91687e+07 4.38322e+09
			62 0.246547 7.92821e+07 3.85928e+09
			63 0.248949 7.05721e+07 3.40217e+09
			64 0.251351 6.28892e+07 3.00283e+09
			65 0.253754 5.61041e+07 2.65351e+09
			66 0.256156 5.01048e+07 2.34756e+09
			67 0.258559 4.47943e+07 2.07927e+09
			68 0.260961 4.00882e+07 1.8437e+09
			69 0.263363 3.59129e+07 1.63662e+09
			70 0.265766 3.22046e+07 1.45438e+09
			71 0.268168 2.89076e+07 1.2938e+09
			72 0.270571 2.5973e+07 1.15215e+09
			73 0.272973 2.33585e+07 1.02706e+09
			74 0.275375 2.10266e+07 9.16474e+08
			75 0.277778 1.89448e+07 8.18604e+08
			76 0.28018 1.70844e+07 7.31897e+08
			77 0.282583 1.54203e+07 6.54999e+08
			78 0.284985 1.39304e+07 5.86731e+08
			79 0.287387 1.25951e+07 5.26064e+08
			80 0.28979 1.13974e+07 4.72098e+08
			81 0.292192 1.03221e+07 4.24047e+08
			82 0.294595 9.35575e+06 3.81221e+08
			83 0.296997 8.48667e+06 3.43017e+08
			84 0.299399 7.70435e+06 3.08903e+08
			85 0.301802 6.99954e+06 2.78415e+08
			86 0.304204 6.36404e+06 2.51143e+08
			87 0.306607 5.79056e+06 2.26726e+08
			88 0.309009 5.27264e+06 2.04846e+08
			89 0.311411 4.80451e+06 1.85223e+08
			90 0.313814 4.38107e+06 1.67609e+08
			91 0.316216 3.99775e+06 1.51786e+08
			92 0.318619 3.65049e+06 1.37559e+08
			93 0.321021 3.33567e+06 1.24758e+08
			94 0.323423 3.05004e+06 1.13231e+08
			95 0.325826 2.79071e+06 1.02842e+08
			96 0.328228 2.55509e+06 9.34722e+07
			97 0.330631 2.34086e+06 8.50154e+07
			98 0.333033 2.14595e+06 7.73766e+07
			99 0.335435 1.96849e+06 7.04718e+07
			100 0.337838 1.80682e+06 6.42259e+07
			101 0.34024 1.65942e+06 5.85721e+07
			102 0.342643 1.52496e+06 5.34504e+07
			103 0.345045 1.40222e+06 4.88078e+07
			104 0.347447 1.29011e+06 4.45965e+07
			105 0.34985 1.18763e+06 4.07738e+07
			106 0.352252 1.09392e+06 3.73016e+07
			107 0.354655 1.00815e+06 3.41456e+07
			108 0.357057 929625 3.12753e+07
			109 0.359459 857676 2.86631e+07
			110 0.361862 791717 2.62843e+07
			111 0.364264 731216 2.41167e+07
			112 0.366667 675688 2.21404e+07
			113 0.369069 624697 2.03373e+07
			114 0.371471 577846 1.86913e+07
			115 0.373874 534775 1.71878e+07
			116 0.376276 495158 1.58138e+07
			117 0.378679 458698 1.45573e+07
			118 0.381081 425127 1.34076e+07
			119 0.383483 394200 1.2355e+07
			120 0.385886 365693 1.13909e+07
			121 0.388288 339404 1.05073e+07
			122 0.390691 315149 9.69702e+06
			123 0.393093 292759 8.95363e+06
			124 0.395495 272080 8.27122e+06
			125 0.397898 252973 7.64447e+06
			126 0.4003 235309 7.06854e+06
			127 0.402703 218972 6.53906e+06
			128 0.405105 203856 6.05202e+06
			129 0.407508 189863 5.6038e+06
			130 0.40991 176902 5.19111e+06
			131 0.412312 164894 4.81095e+06
			132 0.414715 153763 4.46059e+06
			133 0.417117 143440 4.13754e+06
			134 0.41952 133863 3.83953e+06
			135 0.421922 124973 3.56449e+06
			136 0.424324 116719 3.31054e+06
			137 0.426727 109051 3.07596e+06
			138 0.429129 101926 2.85916e+06
			139 0.431532 95300.7 2.65873e+06
			140 0.433934 89138.9 2.47333e+06
			141 0.436336 83405.7 2.30177e+06
			142 0.438739 78069.2 2.14295e+06
			143 0.441141 73099.9 1.99586e+06
			144 0.443544 68470.8 1.85957e+06
			145 0.445946 64157 1.73325e+06
			146 0.448348 60135.5 1.61611e+06
			147 0.450751 56385.1 1.50745e+06
			148 0.453153 52886.3 1.4066e+06
			149 0.455556 49620.9 1.31298e+06
			150 0.457958 46572.3 1.22603e+06
			151 0.46036 43725.1 1.14524e+06
			152 0.462763 41065.1 1.07015e+06
			153 0.465165 38579.1 1.00033e+06
			154 0.467568 36254.8 935383
			155 0.46997 34081.1 874951
			156 0.472372 32047.5 818698
			157 0.474775 30144.3 766316
			158 0.477177 28362.6 717521
			159 0.47958 26694.1 672051
			160 0.481982 25131.1 629666
			161 0.484384 23666.4 590141
			162 0.486787 22293.5 553271
			163 0.489189 21006.1 518867
			164 0.491592 19798.6 486752
			165 0.493994 18665.6 456765
			166 0.496396 17602.3 428754
			167 0.498799 16604.1 402581
			168 0.501201 15666.6 378119
			169 0.503604 14786 355246
			170 0.506006 13958.5 333854
			171 0.508408 13180.8 313841
			172 0.510811 12449.6 295111
			173 0.513213 11761.9 277577
			174 0.515616 11115 261158
			175 0.518018 10506.2 245777
			176 0.52042 9933.29 231366
			177 0.522823 9393.86 217859
			178 0.525225 8885.85 205195
			179 0.527628 8407.31 193318
			180 0.53003 7956.4 182177
			181 0.532432 7531.43 171723
			182 0.534835 7130.8 161910
			183 0.537237 6753.01 152697
			184 0.53964 6396.67 144044
			185 0.542042 6060.48 135916
			186 0.544444 5743.23 128278
			187 0.546847 5443.77 121099
			188 0.549249 5161.03 114350
			189 0.551652 4894.02 108003
			190 0.554054 4641.79 102032
			191 0.556456 4403.49 96414.1
			192 0.558859 4178.28 91127
			193 0.561261 3965.39 86149.7
			194 0.563664 3764.11 81462.9
			195 0.566066 3573.76 77048.6
			196 0.568468 3393.71 72889.9
			197 0.570871 3223.35 68971.1
			198 0.573273 3062.13 65277.3
			199 0.575676 2909.53 61794.9
			200 0.578078 2765.06 58510.9
			201 0.58048 2628.25 55413.3
			202 0.582883 2498.67 52490.8
			203 0.585285 2375.91 49733
			204 0.587688 2259.59 47129.8
			205 0.59009 2149.35 44672.2
			206 0.592492 2044.84 42351.3
			207 0.594895 1945.75 40159.2
			208 0.597297 1851.79 38088.2
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			645 1.64715 -0.190264 -0.656533
			646 1.64955 -0.188694 -0.650498
			647 1.65195 -0.187138 -0.644522
			648 1.65435 -0.185597 -0.638603
			649 1.65676 -0.18407 -0.632742
			650 1.65916 -0.182557 -0.626937
			651 1.66156 -0.181057 -0.621188
			652 1.66396 -0.179572 -0.615494
			653 1.66637 -0.1781 -0.609856
			654 1.66877 -0.176642 -0.604272
			655 1.67117 -0.175196 -0.598742
			656 1.67357 -0.173765 -0.593266
			657 1.67598 -0.172346 -0.587843
			658 1.67838 -0.17094 -0.582472
			659 1.68078 -0.169547 -0.577153
			660 1.68318 -0.168167 -0.571886
			661 1.68559 -0.166799 -0.56667
			662 1.68799 -0.165444 -0.561505
			663 1.69039 -0.164101 -0.55639
			664 1.69279 -0.162771 -0.551324
			665 1.6952 -0.161452 -0.546307
			666 1.6976 -0.160146 -0.54134
			667 1.7 -0.158851 -0.53642
			668 1.7024 -0.157568 -0.531549
			669 1.7048 -0.156297 -0.526724
			670 1.70721 -0.155038 -0.521947
			671 1.70961 -0.153789 -0.517216
			672 1.71201 -0.152552 -0.512531
			673 1.71441 -0.151327 -0.507891
			674 1.71682 -0.150112 -0.503297
			675 1.71922 -0.148908 -0.498747
			676 1.72162 -0.147716 -0.494242
			677 1.72402 -0.146534 -0.48978
			678 1.72643 -0.145362 -0.485362
			679 1.72883 -0.144202 -0.480987
			680 1.73123 -0.143051 -0.476654
			681 1.73363 -0.141911 -0.472363
			682 1.73604 -0.140782 -0.468114
			683 1.73844 -0.139662 -0.463907
			684 1.74084 -0.138553 -0.45974
			685 1.74324 -0.137453 -0.455614
			686 1.74565 -0.136363 -0.451527
			687 1.74805 -0.135284 -0.447481
			688 1.75045 -0.134213 -0.443474
			689 1.75285 -0.133153 -0.439506
			690 1.75526 -0.132102 -0.435576
			691 1.75766 -0.13106 -0.431684
			692 1.76006 -0.130027 -0.42783
			693 1.76246 -0.129004 -0.424014
			694 1.76486 -0.12799 -0.420235
			695 1.76727 -0.126985 -0.416492
			696 1.76967 -0.125989 -0.412785
			697 1.77207 -0.125002 -0.409115
			698 1.77447 -0.124023 -0.40548
			699 1.77688 -0.123053 -0.40188
			700 1.77928 -0.122092 -0.398315
			701 1.78168 -0.121139 -0.394785
			702 1.78408 -0.120195 -0.391289
			703 1.78649 -0.119259 -0.387826
			704 1.78889 -0.118332 -0.384397
			705 1.79129 -0.117412 -0.381001
			706 1.79369 -0.116501 -0.377639
			707 1.7961 -0.115598 -0.374308
			708 1.7985 -0.114703 -0.37101
			709 1.8009 -0.113815 -0.367743
			710 1.8033 -0.112936 -0.364508
			711 1.80571 -0.112064 -0.361304
			712 1.80811 -0.1112 -0.358132
			713 1.81051 -0.110343 -0.354989
			714 1.81291 -0.109494 -0.351877
			715 1.81532 -0.108652 -0.348795
			716 1.81772 -0.107818 -0.345743
			717 1.82012 -0.106991 -0.342719
			718 1.82252 -0.106171 -0.339725
			719 1.82492 -0.105359 -0.33676
			720 1.82733 -0.104553 -0.333823
			721 1.82973 -0.103755 -0.330915
			722 1.83213 -0.102963 -0.328034
			723 1.83453 -0.102179 -0.325181
			724 1.83694 -0.101401 -0.322355
			725 1.83934 -0.10063 -0.319556
			726 1.84174 -0.0998653 -0.316784
			727 1.84414 -0.0991076 -0.314039
			728 1.84655 -0.0983564 -0.31132
			729 1.84895 -0.0976117 -0.308627
			730 1.85135 -0.0968735 -0.305959
			731 1.85375 -0.0961416 -0.303317
			732 1.85616 -0.0954161 -0.3007
			733 1.85856 -0.0946968 -0.298109
			734 1.86096 -0.0939837 -0.295541
			735 1.86336 -0.0932768 -0.292999
			736 1.86577 -0.0925759 -0.29048
			737 1.86817 -0.091881 -0.287986
			738 1.87057 -0.0911922 -0.285515
			739 1.87297 -0.0905092 -0.283067
			740 1.87538 -0.0898321 -0.280643
			741 1.87778 -0.0891607 -0.278242
			742 1.88018 -0.0884951 -0.275864
			743 1.88258 -0.0878352 -0.273508
			744 1.88498 -0.087181 -0.271174
			745 1.88739 -0.0865323 -0.268863
			746 1.88979 -0.0858891 -0.266573
			747 1.89219 -0.0852514 -0.264305
			748 1.89459 -0.0846192 -0.262058
			749 1.897 -0.0839923 -0.259833
			750 1.8994 -0.0833707 -0.257629
			751 1.9018 -0.0827544 -0.255445
			752 1.9042 -0.0821433 -0.253282
			753 1.90661 -0.0815374 -0.251139
			754 1.90901 -0.0809366 -0.249016
			755 1.91141 -0.0803409 -0.246914
			756 1.91381 -0.0797502 -0.244831
			757 1.91622 -0.0791645 -0.242768
			758 1.91862 -0.0785838 -0.240724
			759 1.92102 -0.0780079 -0.238699
			760 1.92342 -0.0774369 -0.236693
			761 1.92583 -0.0768706 -0.234706
			762 1.92823 -0.0763091 -0.232737
			763 1.93063 -0.0757524 -0.230787
			764 1.93303 -0.0752002 -0.228855
			765 1.93544 -0.0746527 -0.226941
			766 1.93784 -0.0741098 -0.225045
			767 1.94024 -0.0735714 -0.223166
			768 1.94264 -0.0730375 -0.221305
			769 1.94505 -0.0725081 -0.219462
			770 1.94745 -0.071983 -0.217635
			771 1.94985 -0.0714624 -0.215826
			772 1.95225 -0.070946 -0.214033
			773 1.95465 -0.070434 -0.212257
			774 1.95706 -0.0699262 -0.210497
			775 1.95946 -0.0694226 -0.208753
			776 1.96186 -0.0689231 -0.207026
			777 1.96426 -0.0684278 -0.205315
			778 1.96667 -0.0679366 -0.203619
			779 1.96907 -0.0674495 -0.201939
			780 1.97147 -0.0669663 -0.200275
			781 1.97387 -0.0664872 -0.198626
			782 1.97628 -0.066012 -0.196992
			783 1.97868 -0.0655407 -0.195373
			784 1.98108 -0.0650732 -0.193769
			785 1.98348 -0.0646096 -0.19218
			786 1.98589 -0.0641498 -0.190605
			787 1.98829 -0.0636938 -0.189045
			788 1.99069 -0.0632415 -0.187499
			789 1.99309 -0.0627929 -0.185967
			790 1.9955 -0.0623479 -0.184449
			791 1.9979 -0.0619066 -0.182945
			792 2.0003 -0.0614689 -0.181455
			793 2.0027 -0.0610348 -0.179978
			794 2.00511 -0.0606041 -0.178515
			795 2.00751 -0.060177 -0.177066
			796 2.00991 -0.0597534 -0.175629
			797 2.01231 -0.0593332 -0.174205
			798 2.01471 -0.0589163 -0.172795
			799 2.01712 -0.0585029 -0.171397
			800 2.01952 -0.0580928 -0.170012
			801 2.02192 -0.057686 -0.168639
			802 2.02432 -0.0572825 -0.167279
			803 2.02673 -0.0568823 -0.165931
			804 2.02913 -0.0564852 -0.164595
			805 2.03153 -0.0560914 -0.163272
			806 2.03393 -0.0557007 -0.16196
			807 2.03634 -0.0553132 -0.16066
			808 2.03874 -0.0549288 -0.159372
			809 2.04114 -0.0545474 -0.158096
			810 2.04354 -0.0541692 -0.156831
			811 2.04595 -0.0537939 -0.155577
			812 2.04835 -0.0534216 -0.154334
			813 2.05075 -0.0530523 -0.153103
			814 2.05315 -0.052686 -0.151883
			815 2.05556 -0.0523226 -0.150674
			816 2.05796 -0.051962 -0.149475
			817 2.06036 -0.0516044 -0.148287
			818 2.06276 -0.0512495 -0.14711
			819 2.06517 -0.0508975 -0.145943
			820 2.06757 -0.0505483 -0.144787
			821 2.06997 -0.0502018 -0.143641
			822 2.07237 -0.0498581 -0.142505
			823 2.07477 -0.0495171 -0.14138
			824 2.07718 -0.0491788 -0.140264
			825 2.07958 -0.0488432 -0.139158
			826 2.08198 -0.0485102 -0.138062
			827 2.08438 -0.0481798 -0.136976
			828 2.08679 -0.047852 -0.135899
			829 2.08919 -0.0475268 -0.134832
			830 2.09159 -0.0472042 -0.133774
			831 2.09399 -0.0468841 -0.132726
			832 2.0964 -0.0465664 -0.131687
			833 2.0988 -0.0462513 -0.130657
			834 2.1012 -0.0459387 -0.129636
			835 2.1036 -0.0456284 -0.128624
			836 2.10601 -0.0453206 -0.127621
			837 2.10841 -0.0450152 -0.126627
			838 2.11081 -0.0447122 -0.125642
			839 2.11321 -0.0444115 -0.124665
			840 2.11562 -0.0441132 -0.123696
			841 2.11802 -0.0438172 -0.122737
			842 2.12042 -0.0435235 -0.121785
			843 2.12282 -0.043232 -0.120842
			844 2.12523 -0.0429428 -0.119907
			845 2.12763 -0.0426559 -0.118981
			846 2.13003 -0.0423712 -0.118062
			847 2.13243 -0.0420886 -0.117151
			848 2.13483 -0.0418083 -0.116249
			849 2.13724 -0.0415301 -0.115354
			850 2.13964 -0.041254 -0.114467
			851 2.14204 -0.0409801 -0.113587
			852 2.14444 -0.0407082 -0.112715
			853 2.14685 -0.0404385 -0.111851
			854 2.14925 -0.0401708 -0.110994
			855 2.15165 -0.0399052 -0.110145
			856 2.15405 -0.0396416 -0.109303
			857 2.15646 -0.03938 -0.108468
			858 2.15886 -0.0391204 -0.107641
			859 2.16126 -0.0388628 -0.10682
			860 2.16366 -0.0386071 -0.106007
			861 2.16607 -0.0383534 -0.1052
			862 2.16847 -0.0381017 -0.104401
			863 2.17087 -0.0378518 -0.103608
			864 2.17327 -0.0376039 -0.102822
			865 2.17568 -0.0373578 -0.102043
			866 2.17808 -0.0371136 -0.101271
			867 2.18048 -0.0368712 -0.100505
			868 2.18288 -0.0366306 -0.0997458
			869 2.18529 -0.0363919 -0.098993
			870 2.18769 -0.036155 -0.0982466
			871 2.19009 -0.0359199 -0.0975066
			872 2.19249 -0.0356865 -0.0967729
			873 2.19489 -0.0354549 -0.0960454
			874 2.1973 -0.035225 -0.0953241
			875 2.1997 -0.0349969 -0.0946089
			876 2.2021 -0.0347704 -0.0938997
			877 2.2045 -0.0345457 -0.0931966
			878 2.20691 -0.0343226 -0.0924995
			879 2.20931 -0.0341012 -0.0918082
			880 2.21171 -0.0338815 -0.0911227
			881 2.21411 -0.0336634 -0.0904431
			882 2.21652 -0.0334469 -0.0897692
			883 2.21892 -0.0332321 -0.0891009
			884 2.22132 -0.0330188 -0.0884383
			885 2.22372 -0.0328071 -0.0877813
			886 2.22613 -0.032597 -0.0871298
			887 2.22853 -0.0323885 -0.0864837
			888 2.23093 -0.0321815 -0.0858431
			889 2.23333 -0.031976 -0.0852078
			890 2.23574 -0.0317721 -0.0845779
			891 2.23814 -0.0315696 -0.0839532
			892 2.24054 -0.0313687 -0.0833337
			893 2.24294 -0.0311692 -0.0827194
			894 2.24535 -0.0309712 -0.0821103
			895 2.24775 -0.0307747 -0.0815062
			896 2.25015 -0.0305796 -0.0809071
			897 2.25255 -0.030386 -0.0803131
			898 2.25495 -0.0301937 -0.0797239
			899 2.25736 -0.0300029 -0.0791397
			900 2.25976 -0.0298135 -0.0785603
			901 2.26216 -0.0296254 -0.0779857
			902 2.26456 -0.0294388 -0.0774158
			903 2.26697 -0.0292535 -0.0768507
			904 2.26937 -0.0290695 -0.0762902
			905 2.27177 -0.0288869 -0.0757344
			906 2.27417 -0.0287056 -0.0751832
			907 2.27658 -0.0285257 -0.0746365
			908 2.27898 -0.028347 -0.0740943
			909 2.28138 -0.0281696 -0.0735565
			910 2.28378 -0.0279936 -0.0730232
			911 2.28619 -0.0278188 -0.0724943
			912 2.28859 -0.0276452 -0.0719697
			913 2.29099 -0.027473 -0.0714494
			914 2.29339 -0.0273019 -0.0709333
			915 2.2958 -0.0271321 -0.0704215
			916 2.2982 -0.0269636 -0.0699139
			917 2.3006 -0.0267962 -0.0694104
			918 2.303 -0.0266301 -0.068911
			919 2.30541 -0.0264651 -0.0684157
			920 2.30781 -0.0263013 -0.0679244
			921 2.31021 -0.0261387 -0.0674372
			922 2.31261 -0.0259773 -0.0669538
			923 2.31502 -0.025817 -0.0664745
			924 2.31742 -0.0256579 -0.065999
			925 2.31982 -0.0254999 -0.0655273
			926 2.32222 -0.0253431 -0.0650595
			927 2.32462 -0.0251873 -0.0645955
			928 2.32703 -0.0250327 -0.0641352
			929 2.32943 -0.0248792 -0.0636786
			930 2.33183 -0.0247267 -0.0632257
			931 2.33423 -0.0245754 -0.0627765
			932 2.33664 -0.0244251 -0.0623309
			933 2.33904 -0.0242759 -0.0618889
			934 2.34144 -0.0241277 -0.0614504
			935 2.34384 -0.0239806 -0.0610154
			936 2.34625 -0.0238346 -0.060584
			937 2.34865 -0.0236895 -0.060156
			938 2.35105 -0.0235455 -0.0597314
			939 2.35345 -0.0234025 -0.0593102
			940 2.35586 -0.0232605 -0.0588924
			941 2.35826 -0.0231196 -0.058478
			942 2.36066 -0.0229796 -0.0580668
			943 2.36306 -0.0228406 -0.057659
			944 2.36547 -0.0227025 -0.0572543
			945 2.36787 -0.0225655 -0.0568529
			946 2.37027 -0.0224294 -0.0564547
			947 2.37267 -0.0222942 -0.0560597
			948 2.37508 -0.02216 -0.0556678
			949 2.37748 -0.0220267 -0.055279
			950 2.37988 -0.0218944 -0.0548932
			951 2.38228 -0.021763 -0.0545106
			952 2.38468 -0.0216325 -0.0541309
			953 2.38709 -0.0215029 -0.0537543
			954 2.38949 -0.0213742 -0.0533806
			955 2.39189 -0.0212464 -0.0530099
			956 2.39429 -0.0211195 -0.0526421
			957 2.3967 -0.0209935 -0.0522772
			958 2.3991 -0.0208683 -0.0519152
			959 2.4015 -0.020744 -0.051556
			960 2.4039 -0.0206206 -0.0511997
			961 2.40631 -0.020498 -0.0508461
			962 2.40871 -0.0203763 -0.0504953
			963 2.41111 -0.0202554 -0.0501472
			964 2.41351 -0.0201353 -0.0498019
			965 2.41592 -0.0200161 -0.0494593
			966 2.41832 -0.0198977 -0.0491194
			967 2.42072 -0.0197801 -0.0487821
			968 2.42312 -0.0196633 -0.0484474
			969 2.42553 -0.0195473 -0.0481153
			970 2.42793 -0.0194321 -0.0477859
			971 2.43033 -0.0193177 -0.047459
			972 2.43273 -0.0192041 -0.0471346
			973 2.43514 -0.0190912 -0.0468127
			974 2.43754 -0.0189791 -0.0464934
			975 2.43994 -0.0188678 -0.0461765
			976 2.44234 -0.0187573 -0.0458621
			977 2.44474 -0.0186475 -0.0455501
			978 2.44715 -0.0185384 -0.0452405
			979 2.44955 -0.0184301 -0.0449333
			980 2.45195 -0.0183225 -0.0446285
			981 2.45435 -0.0182157 -0.044326
			982 2.45676 -0.0181095 -0.0440258
			983 2.45916 -0.0180041 -0.043728
			984 2.46156 -0.0178994 -0.0434324
			985 2.46396 -0.0177954 -0.0431392
			986 2.46637 -0.0176922 -0.0428481
			987 2.46877 -0.0175896 -0.0425593
			988 2.47117 -0.0174877 -0.0422727
			989 2.47357 -0.0173864 -0.0419883
			990 2.47598 -0.0172859 -0.0417061
			991 2.47838 -0.0171861 -0.0414261
			992 2.48078 -0.0170869 -0.0411481
			993 2.48318 -0.0169883 -0.0408723
			994 2.48559 -0.0168905 -0.0405986
			995 2.48799 -0.0167933 -0.040327
			996 2.49039 -0.0166967 -0.0400574
			997 2.49279 -0.0166008 -0.0397899
			998 2.4952 -0.0165055 -0.0395244
			999 2.4976 -0.0164109 -0.039261
			1000 2.5 0 0

			# Pair potential lj/cut for atom types 1 1: i,r,energy,force

			lj_bitmap
			N 4096 BITMAP 0.1 2.5

			1 1.41421 -0.4375 -1.59099
			2 1.41697 -0.433131 -1.57551
			3 1.41973 -0.428813 -1.56015
			4 1.42248 -0.424546 -1.54491
			5 1.42522 -0.420328 -1.52979
			6 1.42796 -0.41616 -1.51479
			7 1.43069 -0.41204 -1.49991
			8 1.43342 -0.407969 -1.48516
			9 1.43614 -0.403946 -1.47053
			10 1.43886 -0.399969 -1.45604
			11 1.44157 -0.39604 -1.44167
			12 1.44428 -0.392156 -1.42742
			13 1.44698 -0.388318 -1.41331
			14 1.44968 -0.384525 -1.39932
			15 1.45237 -0.380777 -1.38547
			16 1.45506 -0.377073 -1.37174
			17 1.45774 -0.373412 -1.35815
			18 1.46042 -0.369794 -1.34468
			19 1.46309 -0.366218 -1.33134
			20 1.46575 -0.362684 -1.31813
			21 1.46842 -0.359192 -1.30505
			22 1.47108 -0.355741 -1.2921
			23 1.47373 -0.35233 -1.27928
			24 1.47638 -0.348959 -1.26659
			25 1.47902 -0.345627 -1.25402
			26 1.48166 -0.342335 -1.24158
			27 1.48429 -0.339081 -1.22927
			28 1.48692 -0.335864 -1.21709
			29 1.48955 -0.332686 -1.20503
			30 1.49217 -0.329544 -1.19309
			31 1.49478 -0.326439 -1.18128
			32 1.49739 -0.32337 -1.16959
			33 1.5 -0.320337 -1.15803
			34 1.5026 -0.317338 -1.14659
			35 1.5052 -0.314375 -1.13526
			36 1.50779 -0.311446 -1.12406
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			1898 19 0 0
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			1910 19.3132 0 0
			1911 19.3391 0 0
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			1914 19.4165 0 0
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			1918 19.5192 0 0
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			1930 19.8242 0 0
			1931 19.8494 0 0
			1932 19.8746 0 0
			1933 19.8997 0 0
			1934 19.9249 0 0
			1935 19.9499 0 0
			1936 19.975 0 0
			1937 20 0 0
			1938 20.025 0 0
			1939 20.0499 0 0
			1940 20.0749 0 0
			1941 20.0998 0 0
			1942 20.1246 0 0
			1943 20.1494 0 0
			1944 20.1742 0 0
			1945 20.199 0 0
			1946 20.2237 0 0
			1947 20.2485 0 0
			1948 20.2731 0 0
			1949 20.2978 0 0
			1950 20.3224 0 0
			1951 20.347 0 0
			1952 20.3715 0 0
			1953 20.3961 0 0
			1954 20.4206 0 0
			1955 20.445 0 0
			1956 20.4695 0 0
			1957 20.4939 0 0
			1958 20.5183 0 0
			1959 20.5426 0 0
			1960 20.567 0 0
			1961 20.5913 0 0
			1962 20.6155 0 0
			1963 20.6398 0 0
			1964 20.664 0 0
			1965 20.6882 0 0
			1966 20.7123 0 0
			1967 20.7364 0 0
			1968 20.7605 0 0
			1969 20.7846 0 0
			1970 20.8087 0 0
			1971 20.8327 0 0
			1972 20.8567 0 0
			1973 20.8806 0 0
			1974 20.9045 0 0
			1975 20.9284 0 0
			1976 20.9523 0 0
			1977 20.9762 0 0
			1978 21 0 0
			1979 21.0238 0 0
			1980 21.0476 0 0
			1981 21.0713 0 0
			1982 21.095 0 0
			1983 21.1187 0 0
			1984 21.1424 0 0
			1985 21.166 0 0
			1986 21.1896 0 0
			1987 21.2132 0 0
			1988 21.2368 0 0
			1989 21.2603 0 0
			1990 21.2838 0 0
			1991 21.3073 0 0
			1992 21.3307 0 0
			1993 21.3542 0 0
			1994 21.3776 0 0
			1995 21.4009 0 0
			1996 21.4243 0 0
			1997 21.4476 0 0
			1998 21.4709 0 0
			1999 21.4942 0 0
			2000 21.5174 0 0
			2001 21.5407 0 0
			2002 21.5639 0 0
			2003 21.587 0 0
			2004 21.6102 0 0
			2005 21.6333 0 0
			2006 21.6564 0 0
			2007 21.6795 0 0
			2008 21.7025 0 0
			2009 21.7256 0 0
			2010 21.7486 0 0
			2011 21.7715 0 0
			2012 21.7945 0 0
			2013 21.8174 0 0
			2014 21.8403 0 0
			2015 21.8632 0 0
			2016 21.8861 0 0
			2017 21.9089 0 0
			2018 21.9317 0 0
			2019 21.9545 0 0
			2020 21.9773 0 0
			2021 22 0 0
			2022 22.0227 0 0
			2023 22.0454 0 0
			2024 22.0681 0 0
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			3840 0.999023 0.0236678 24.4491
			3841 1 0 24
			3842 1.00195 -0.0459703 23.1242
			3843 1.0039 -0.090174 22.2772
			3844 1.00584 -0.132673 21.4582
			3845 1.00778 -0.173528 20.6661
			3846 1.00972 -0.212796 19.9
			3847 1.01165 -0.250532 19.159
			3848 1.01358 -0.286791 18.4423
			3849 1.0155 -0.321624 17.7489
			3850 1.01743 -0.355081 17.0782
			3851 1.01934 -0.387209 16.4294
			3852 1.02126 -0.418055 15.8017
			3853 1.02317 -0.447664 15.1943
			3854 1.02508 -0.476078 14.6067
			3855 1.02698 -0.503339 14.0381
			3856 1.02888 -0.529487 13.4879
			3857 1.03078 -0.55456 12.9555
			3858 1.03267 -0.578595 12.4403
			3859 1.03456 -0.601629 11.9417
			3860 1.03645 -0.623696 11.4592
			3861 1.03833 -0.644829 10.9923
			3862 1.04021 -0.66506 10.5404
			3863 1.04208 -0.684421 10.103
			3864 1.04396 -0.702941 9.67961
			3865 1.04583 -0.720649 9.26986
			3866 1.04769 -0.737574 8.87325
			3867 1.04955 -0.753741 8.48936
			3868 1.05141 -0.769178 8.11778
			3869 1.05327 -0.783909 7.7581
			3870 1.05512 -0.797958 7.40994
			3871 1.05697 -0.81135 7.07292
			3872 1.05882 -0.824105 6.74669
			3873 1.06066 -0.836247 6.4309
			3874 1.0625 -0.847796 6.12522
			3875 1.06434 -0.858773 5.82931
			3876 1.06617 -0.869197 5.54287
			3877 1.068 -0.879087 5.26559
			3878 1.06983 -0.888462 4.99719
			3879 1.07165 -0.897339 4.73738
			3880 1.07347 -0.905736 4.48588
			3881 1.07529 -0.913668 4.24244
			3882 1.07711 -0.921153 4.00679
			3883 1.07892 -0.928204 3.77871
			3884 1.08073 -0.934838 3.55793
			3885 1.08253 -0.941069 3.34424
			3886 1.08433 -0.946911 3.13742
			3887 1.08613 -0.952376 2.93724
			3888 1.08793 -0.957478 2.74351
			3889 1.08972 -0.962231 2.55601
			3890 1.09152 -0.966645 2.37456
			3891 1.0933 -0.970733 2.19897
			3892 1.09509 -0.974505 2.02905
			3893 1.09687 -0.977974 1.86463
			3894 1.09865 -0.981149 1.70554
			3895 1.10043 -0.984041 1.55162
			3896 1.1022 -0.98666 1.4027
			3897 1.10397 -0.989016 1.25863
			3898 1.10574 -0.991117 1.11926
			3899 1.1075 -0.992973 0.984451
			3900 1.10926 -0.994592 0.854059
			3901 1.11102 -0.995983 0.727949
			3902 1.11278 -0.997154 0.605991
			3903 1.11453 -0.998113 0.488058
			3904 1.11629 -0.998867 0.374026
			3905 1.11803 -0.999424 0.263777
			3906 1.11978 -0.999791 0.157196
			3907 1.12152 -0.999975 0.0541717
			3908 1.12326 -0.999982 -0.0454045
			3909 1.125 -0.999819 -0.141637
			3910 1.12673 -0.999492 -0.234627
			3911 1.12847 -0.999007 -0.324473
			3912 1.1302 -0.998371 -0.411269
			3913 1.13192 -0.997588 -0.495108
			3914 1.13365 -0.996664 -0.576079
			3915 1.13537 -0.995605 -0.654268
			3916 1.13709 -0.994415 -0.72976
			3917 1.1388 -0.993099 -0.802635
			3918 1.14052 -0.991663 -0.872972
			3919 1.14223 -0.990111 -0.940847
			3920 1.14394 -0.988447 -1.00634
			3921 1.14564 -0.986676 -1.06951
			3922 1.14735 -0.984802 -1.13043
			3923 1.14905 -0.982829 -1.18918
			3924 1.15075 -0.98076 -1.24581
			3925 1.15244 -0.978601 -1.30039
			3926 1.15414 -0.976354 -1.35298
			3927 1.15583 -0.974023 -1.40364
			3928 1.15752 -0.971611 -1.45243
			3929 1.1592 -0.969122 -1.4994
			3930 1.16089 -0.96656 -1.54462
			3931 1.16257 -0.963926 -1.58812
			3932 1.16425 -0.961224 -1.62996
			3933 1.16592 -0.958458 -1.67019
			3934 1.1676 -0.95563 -1.70887
			3935 1.16927 -0.952742 -1.74603
			3936 1.17094 -0.949797 -1.78172
			3937 1.1726 -0.946799 -1.81598
			3938 1.17427 -0.943749 -1.84887
			3939 1.17593 -0.940649 -1.88041
			3940 1.17759 -0.937503 -1.91065
			3941 1.17925 -0.934312 -1.93963
			3942 1.1809 -0.931079 -1.96738
			3943 1.18256 -0.927805 -1.99395
			3944 1.18421 -0.924493 -2.01936
			3945 1.18585 -0.921145 -2.04366
			3946 1.1875 -0.917762 -2.06687
			3947 1.18914 -0.914346 -2.08903
			3948 1.19078 -0.9109 -2.11017
			3949 1.19242 -0.907425 -2.13032
			3950 1.19406 -0.903922 -2.1495
			3951 1.1957 -0.900393 -2.16776
			3952 1.19733 -0.89684 -2.18512
			3953 1.19896 -0.893265 -2.20159
			3954 1.20059 -0.889668 -2.21722
			3955 1.20221 -0.886051 -2.23203
			3956 1.20384 -0.882416 -2.24603
			3957 1.20546 -0.878764 -2.25926
			3958 1.20708 -0.875095 -2.27174
			3959 1.20869 -0.871413 -2.28349
			3960 1.21031 -0.867716 -2.29454
			3961 1.21192 -0.864007 -2.3049
			3962 1.21353 -0.860287 -2.31459
			3963 1.21514 -0.856557 -2.32364
			3964 1.21675 -0.852818 -2.33207
			3965 1.21835 -0.849071 -2.33989
			3966 1.21995 -0.845316 -2.34712
			3967 1.22155 -0.841556 -2.35379
			3968 1.22315 -0.83779 -2.35991
			3969 1.22474 -0.834019 -2.36549
			3970 1.22634 -0.830245 -2.37055
			3971 1.22793 -0.826469 -2.37511
			3972 1.22952 -0.82269 -2.37919
			3973 1.23111 -0.81891 -2.3828
			3974 1.23269 -0.81513 -2.38595
			3975 1.23428 -0.811349 -2.38866
			3976 1.23586 -0.80757 -2.39094
			3977 1.23744 -0.803792 -2.39281
			3978 1.23901 -0.800017 -2.39427
			3979 1.24059 -0.796244 -2.39535
			3980 1.24216 -0.792475 -2.39605
			3981 1.24373 -0.788709 -2.39639
			3982 1.2453 -0.784949 -2.39638
			3983 1.24687 -0.781193 -2.39602
			3984 1.24844 -0.777442 -2.39534
			3985 1.25 -0.773698 -2.39434
			3986 1.25156 -0.76996 -2.39303
			3987 1.25312 -0.766229 -2.39141
			3988 1.25468 -0.762506 -2.38952
			3989 1.25623 -0.75879 -2.38734
			3990 1.25779 -0.755083 -2.38489
			3991 1.25934 -0.751384 -2.38218
			3992 1.26089 -0.747694 -2.37922
			3993 1.26244 -0.744013 -2.37602
			3994 1.26398 -0.740342 -2.37258
			3995 1.26553 -0.736681 -2.36891
			3996 1.26707 -0.73303 -2.36503
			3997 1.26861 -0.72939 -2.36093
			3998 1.27015 -0.72576 -2.35663
			3999 1.27169 -0.722142 -2.35213
			4000 1.27322 -0.718535 -2.34744
			4001 1.27475 -0.71494 -2.34257
			4002 1.27629 -0.711357 -2.33752
			4003 1.27782 -0.707786 -2.3323
			4004 1.27934 -0.704227 -2.32692
			4005 1.28087 -0.700681 -2.32138
			4006 1.28239 -0.697148 -2.31568
			4007 1.28391 -0.693628 -2.30984
			4008 1.28544 -0.69012 -2.30386
			4009 1.28695 -0.686627 -2.29774
			4010 1.28847 -0.683146 -2.2915
			4011 1.28999 -0.679679 -2.28512
			4012 1.2915 -0.676227 -2.27863
			4013 1.29301 -0.672788 -2.27202
			4014 1.29452 -0.669363 -2.2653
			4015 1.29603 -0.665952 -2.25848
			4016 1.29753 -0.662556 -2.25155
			4017 1.29904 -0.659174 -2.24453
			4018 1.30054 -0.655806 -2.23741
			4019 1.30204 -0.652454 -2.2302
			4020 1.30354 -0.649116 -2.2229
			4021 1.30504 -0.645792 -2.21553
			4022 1.30653 -0.642484 -2.20807
			4023 1.30803 -0.639191 -2.20055
			4024 1.30952 -0.635912 -2.19295
			4025 1.31101 -0.632649 -2.18528
			4026 1.3125 -0.629401 -2.17755
			4027 1.31399 -0.626168 -2.16976
			4028 1.31547 -0.622951 -2.16191
			4029 1.31696 -0.619749 -2.154
			4030 1.31844 -0.616562 -2.14604
			4031 1.31992 -0.613391 -2.13804
			4032 1.3214 -0.610235 -2.12998
			4033 1.32288 -0.607094 -2.12189
			4034 1.32435 -0.603969 -2.11375
			4035 1.32583 -0.600859 -2.10557
			4036 1.3273 -0.597765 -2.09736
			4037 1.32877 -0.594687 -2.08911
			4038 1.33024 -0.591624 -2.08083
			4039 1.3317 -0.588576 -2.07253
			4040 1.33317 -0.585545 -2.06419
			4041 1.33463 -0.582528 -2.05583
			4042 1.3361 -0.579527 -2.04745
			4043 1.33756 -0.576542 -2.03905
			4044 1.33902 -0.573573 -2.03062
			4045 1.34048 -0.570618 -2.02218
			4046 1.34193 -0.56768 -2.01373
			4047 1.34339 -0.564757 -2.00526
			4048 1.34484 -0.561849 -1.99678
			4049 1.34629 -0.558957 -1.98829
			4050 1.34774 -0.55608 -1.97979
			4051 1.34919 -0.553219 -1.97128
			4052 1.35064 -0.550373 -1.96277
			4053 1.35208 -0.547542 -1.95425
			4054 1.35353 -0.544727 -1.94573
			4055 1.35497 -0.541927 -1.93721
			4056 1.35641 -0.539142 -1.92869
			4057 1.35785 -0.536372 -1.92017
			4058 1.35929 -0.533618 -1.91165
			4059 1.36072 -0.530879 -1.90313
			4060 1.36216 -0.528155 -1.89463
			4061 1.36359 -0.525445 -1.88612
			4062 1.36502 -0.522751 -1.87763
			4063 1.36645 -0.520072 -1.86914
			4064 1.36788 -0.517408 -1.86066
			4065 1.36931 -0.514759 -1.85219
			4066 1.37073 -0.512124 -1.84373
			4067 1.37216 -0.509505 -1.83529
			4068 1.37358 -0.5069 -1.82685
			4069 1.375 -0.504309 -1.81843
			4070 1.37642 -0.501734 -1.81003
			4071 1.37784 -0.499172 -1.80164
			4072 1.37925 -0.496626 -1.79327
			4073 1.38067 -0.494094 -1.78491
			4074 1.38208 -0.491576 -1.77657
			4075 1.3835 -0.489072 -1.76825
			4076 1.38491 -0.486583 -1.75995
			4077 1.38632 -0.484108 -1.75167
			4078 1.38773 -0.481647 -1.74341
			4079 1.38913 -0.479201 -1.73517
			4080 1.39054 -0.476768 -1.72695
			4081 1.39194 -0.474349 -1.71875
			4082 1.39334 -0.471945 -1.71058
			4083 1.39474 -0.469554 -1.70243
			4084 1.39614 -0.467177 -1.6943
			4085 1.39754 -0.464813 -1.6862
			4086 1.39894 -0.462464 -1.67812
			4087 1.40033 -0.460127 -1.67007
			4088 1.40173 -0.457805 -1.66204
			4089 1.40312 -0.455496 -1.65404
			4090 1.40451 -0.4532 -1.64606
			4091 1.4059 -0.450918 -1.63811
			4092 1.40729 -0.448649 -1.63019
			4093 1.40868 -0.446393 -1.62229
			4094 1.41006 -0.44415 -1.61442
			4095 1.41145 -0.44192 -1.60658
			4096 1.41283 -0.439704 -1.59877

lammps/test/01_run_std/lj_table.txtc954b454bac9lammps-icms

lj_table.txtView Options

lammps/test/01_run_std/lj_table.txt
c954b454bac9lammps-icms

lj_table.txt
View Options