# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2016--Wilson-S-R-Mendelev-M-I--fictional-W # implementation = 2016--Wilson-S-R--fictional-W--LAMMPS--ipr1 # composition = W # NOTE: These values are for static, unrelaxed structures and use the ideal # b/a and c/a ratios for the crystal structure, not the potential-specific # values. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-05-24 r A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan nan nan nan nan nan nan 0.74 nan nan nan nan nan nan nan nan nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan nan nan nan nan nan 0.80 nan nan nan nan nan nan nan nan -4.748071710e+02 nan 0.82 nan nan nan nan nan nan nan nan -5.151239105e+02 nan 0.84 nan nan nan nan nan nan nan nan -5.409543518e+02 nan 0.86 nan nan nan nan nan -3.185776965e+02 nan nan -5.552556951e+02 nan 0.88 nan nan nan nan nan -3.309431839e+02 nan nan -5.607324092e+02 nan 0.90 nan nan nan nan nan -3.365949161e+02 nan nan -5.593540063e+02 nan 0.92 nan nan nan nan nan -3.359059492e+02 nan nan -5.525011031e+02 nan 0.94 nan nan nan nan nan -3.305351941e+02 nan nan -5.411975459e+02 nan 0.96 nan nan nan nan nan -3.220714954e+02 nan nan -5.264745679e+02 nan 0.98 nan nan nan -7.581784625e+02 -7.588011006e+02 -3.117114289e+02 nan nan -5.090477928e+02 -6.456224516e+02 1.00 nan -7.369837331e+02 nan -7.773832175e+02 -7.775737195e+02 -3.006309260e+02 -6.831571964e+02 nan -4.892413587e+02 -6.363052289e+02 1.02 nan -7.167698791e+02 nan -7.881836060e+02 -7.879000234e+02 -2.885551163e+02 -6.666895120e+02 nan -4.673115142e+02 -6.230273841e+02 1.04 nan -6.930399675e+02 nan -7.917763039e+02 -7.911656090e+02 -2.746885855e+02 -6.472634335e+02 nan -4.436143263e+02 -6.068381404e+02 1.06 nan -6.674593415e+02 nan -7.891343247e+02 -7.882875499e+02 -2.588821648e+02 -6.262316748e+02 nan -4.189792162e+02 -5.881590130e+02 1.08 nan -6.403851250e+02 nan -7.811300727e+02 -7.802053282e+02 -2.417653707e+02 -6.039227392e+02 nan -3.939110504e+02 -5.675023001e+02 1.10 nan -6.120348411e+02 nan -7.687323548e+02 -7.680871419e+02 -2.232317484e+02 -5.805417658e+02 -7.508612225e+02 -3.689149564e+02 -5.446159345e+02 1.12 -7.526425606e+02 -5.832559697e+02 -7.223429745e+02 -7.529870365e+02 -7.529467471e+02 -2.036372572e+02 -5.557020984e+02 -7.307430694e+02 -3.440989151e+02 -5.201799414e+02 1.14 -7.336759841e+02 -5.539553351e+02 -6.981914510e+02 -7.346232570e+02 -7.350925467e+02 -1.833585859e+02 -5.293972867e+02 -7.088107575e+02 -3.192163227e+02 -4.949477783e+02 1.16 -7.123376429e+02 -5.239478762e+02 -6.729688894e+02 -7.138847808e+02 -7.147566601e+02 -1.629848435e+02 -5.022321820e+02 -6.852352806e+02 -2.945235426e+02 -4.697677567e+02 1.18 -6.890939827e+02 -4.938931810e+02 -6.466251229e+02 -6.909251395e+02 -6.919382719e+02 -1.428128654e+02 -4.748715086e+02 -6.606030567e+02 -2.702189215e+02 -4.453033174e+02 1.20 -6.649231092e+02 -4.644085639e+02 -6.194426155e+02 -6.664749031e+02 -6.673687812e+02 -1.229914369e+02 -4.476221780e+02 -6.353526647e+02 -2.462722073e+02 -4.208164422e+02 1.22 -6.407330448e+02 -4.354621480e+02 -5.919805482e+02 -6.411352795e+02 -6.416800653e+02 -1.036319320e+02 -4.206358301e+02 -6.097289592e+02 -2.227650371e+02 -3.961846215e+02 1.24 -6.161130471e+02 -4.066727367e+02 -5.642934062e+02 -6.152088223e+02 -6.152898536e+02 -8.439668891e+01 -3.941376617e+02 -5.834932043e+02 -2.000143629e+02 -3.714446421e+02 1.26 -5.904068613e+02 -3.784057200e+02 -5.370159337e+02 -5.888679795e+02 -5.885094437e+02 -6.551684202e+01 -3.681198529e+02 -5.566316294e+02 -1.779120951e+02 -3.465414149e+02 1.28 -5.641368067e+02 -3.509954656e+02 -5.106299684e+02 -5.624068606e+02 -5.616882669e+02 -4.723269949e+01 -3.427442723e+02 -5.293386023e+02 -1.564687151e+02 -3.218068775e+02 1.30 -5.371719762e+02 -3.245374636e+02 -4.845964114e+02 -5.358325693e+02 -5.349750859e+02 -2.963050962e+01 -3.176339334e+02 -5.019322822e+02 -1.357102014e+02 -2.973412749e+02 1.32 -5.099918635e+02 -2.989719234e+02 -4.581244136e+02 -5.091427237e+02 -5.082320138e+02 -1.230446307e+01 -2.926872788e+02 -4.745501218e+02 -1.153664347e+02 -2.734553656e+02 1.34 -4.829799987e+02 -2.738728903e+02 -4.315096145e+02 -4.825239877e+02 -4.816289725e+02 4.647571726e+00 -2.681761691e+02 -4.472654094e+02 -9.548338264e+01 -2.503515189e+02 1.36 -4.560084204e+02 -2.492473652e+02 -4.049716860e+02 -4.560186371e+02 -4.552666714e+02 2.115416706e+01 -2.443455079e+02 -4.202215151e+02 -7.620046454e+01 -2.277832763e+02 1.38 -4.293954726e+02 -2.253304608e+02 -3.785024176e+02 -4.298683924e+02 -4.293876231e+02 3.736546617e+01 -2.213778152e+02 -3.937344714e+02 -5.741707588e+01 -2.059470852e+02 1.40 -4.033935414e+02 -2.022562478e+02 -3.523852309e+02 -4.040942232e+02 -4.040104043e+02 5.313239136e+01 -1.992369025e+02 -3.679011743e+02 -3.900983859e+01 -1.849666693e+02 1.42 -3.777551887e+02 -1.801632102e+02 -3.268800466e+02 -3.786747667e+02 -3.791029967e+02 6.829654409e+01 -1.779655506e+02 -3.425823130e+02 -2.094206395e+01 -1.644796456e+02 1.44 -3.526329542e+02 -1.590892544e+02 -3.021889083e+02 -3.535881624e+02 -3.544076694e+02 8.108071402e+01 -1.575474197e+02 -3.178600483e+02 -3.250513202e+00 -1.445333968e+02 1.46 -3.282956550e+02 -1.387434446e+02 -2.784883700e+02 -3.290012238e+02 -3.299829575e+02 8.760924932e+01 -1.377770314e+02 -2.938211597e+02 1.396886700e+01 -1.253041483e+02 1.48 -3.047606904e+02 -1.190290377e+02 -2.557562718e+02 -3.050434650e+02 -3.059897090e+02 8.952576751e+01 -1.187291963e+02 -2.705593549e+02 3.062934274e+01 -1.067644811e+02 1.50 -2.815326340e+02 -9.989362924e+01 -2.335388623e+02 -2.815701397e+02 -2.824020590e+02 8.836026828e+01 -1.003179203e+02 -2.478844915e+02 4.660350282e+01 -8.846019074e+01 1.52 -2.588550018e+02 -8.143754335e+01 -2.120166896e+02 -2.588511928e+02 -2.595094582e+02 8.506739304e+01 -8.254845327e+01 -2.259283416e+02 5.763695857e+01 -7.050355973e+01 1.54 -2.369456162e+02 -6.375293950e+01 -1.913741363e+02 -2.370173761e+02 -2.374558581e+02 8.036509193e+01 -6.532746264e+01 -2.048023527e+02 6.330291172e+01 -5.300373149e+01 1.56 -2.158508218e+02 -4.689165929e+01 -1.716655553e+02 -2.159258906e+02 -2.161089462e+02 7.483458099e+01 -4.853076299e+01 -1.845653850e+02 6.511553806e+01 -3.598236010e+01 1.58 -1.955168022e+02 -3.071325194e+01 -1.525795370e+02 -1.955617535e+02 -1.955020120e+02 6.887533062e+01 -3.203098518e+01 -1.652193596e+02 6.421436102e+01 -1.926349275e+01 1.60 -1.759628560e+02 -1.517375970e+01 -1.340074185e+02 -1.759605262e+02 -1.756893753e+02 6.274130576e+01 -1.586613432e+01 -1.468113762e+02 6.148124879e+01 -2.813366298e+00 1.62 -1.572630501e+02 -2.576527802e-01 -1.160057973e+02 -1.571911713e+02 -1.567329130e+02 5.662867397e+01 -7.605516554e-02 -1.292428953e+02 5.759146360e+01 1.329412799e+01 1.64 -1.394883476e+02 1.419918144e+01 -9.862254650e+01 -1.392851433e+02 -1.386548818e+02 5.068683751e+01 1.535813261e+01 -1.123938398e+02 5.304892007e+01 2.898824800e+01 1.66 -1.227082649e+02 2.765504447e+01 -8.190703403e+01 -1.222198508e+02 -1.214252825e+02 4.501774293e+01 3.034359437e+01 -9.608580972e+01 4.820332900e+01 4.297772240e+01 1.68 -1.066427264e+02 3.682600833e+01 -6.591889052e+01 -1.058373798e+02 -1.049272576e+02 3.968127325e+01 4.154364466e+01 -8.007778152e+01 4.327705233e+01 5.172190370e+01 1.70 -9.074297757e+01 4.221455798e+01 -5.073201034e+01 -8.981637456e+01 -8.891929798e+01 3.470380341e+01 4.811651015e+01 -6.432811797e+01 3.842970315e+01 5.623128928e+01 1.72 -7.506239557e+01 4.470714236e+01 -3.626672549e+01 -7.417667109e+01 -7.338998691e+01 3.009983282e+01 5.122897752e+01 -4.888930444e+01 3.376488671e+01 5.763673503e+01 1.74 -5.965624116e+01 4.502396164e+01 -2.226902984e+01 -5.889861113e+01 -5.824471940e+01 2.587472054e+01 5.182107367e+01 -3.380433230e+01 2.934540935e+01 5.683755337e+01 1.76 -4.456932887e+01 4.375097693e+01 -8.706141143e+00 -4.401116853e+01 -4.351115884e+01 2.201769500e+01 5.061997678e+01 -1.910704984e+01 2.521415431e+01 5.453426186e+01 1.78 -2.983595078e+01 4.136318344e+01 4.705586212e+00 -2.947350551e+01 -2.914935891e+01 1.849723194e+01 4.817630897e+01 -4.753150284e+00 2.139304068e+01 5.126550015e+01 1.80 -1.547960127e+01 3.823680566e+01 1.796387269e+01 -1.530654770e+01 -1.518140877e+01 1.529726970e+01 4.491085313e+01 9.302121265e+00 1.789169569e+01 4.744086695e+01 1.82 -1.431478957e+00 3.467749059e+01 2.918749754e+01 -1.468441966e+00 -1.567061230e+00 1.240041725e+01 4.114715822e+01 2.284090532e+01 1.470834736e+01 4.333826156e+01 1.84 1.233624025e+01 3.091481682e+01 3.656533794e+01 1.205381129e+01 1.170471003e+01 9.789410625e+00 3.713369709e+01 3.288500370e+01 1.182650824e+01 3.913557457e+01 1.86 2.524314868e+01 2.711684906e+01 4.089673259e+01 2.476550320e+01 2.422575501e+01 7.448581371e+00 3.305755146e+01 3.919348364e+01 9.225850128e+00 3.496394860e+01 1.88 3.434449349e+01 2.340696665e+01 4.286996194e+01 3.385066820e+01 3.330869780e+01 5.364383211e+00 2.905614922e+01 4.264339612e+01 6.893764603e+00 3.091414049e+01 1.90 3.999902901e+01 1.986375547e+01 4.306190569e+01 3.956784204e+01 3.910960970e+01 3.525077259e+00 2.522550737e+01 4.395047009e+01 4.813002272e+00 2.704788840e+01 1.92 4.299812063e+01 1.654169097e+01 4.195382511e+01 4.266633009e+01 4.233195818e+01 1.918882828e+00 2.162715279e+01 4.365152133e+01 2.963277451e+00 2.340529396e+01 1.94 4.398978197e+01 1.346406863e+01 3.993696662e+01 4.376473824e+01 4.356089786e+01 5.333429924e-01 1.828403817e+01 4.218243175e+01 1.327712190e+00 2.001032392e+01 1.96 4.350045874e+01 1.063559703e+01 3.729961233e+01 4.336943924e+01 4.327947371e+01 -6.460373768e-01 1.520753225e+01 3.989504961e+01 -1.121030033e-01 1.687545300e+01 1.98 4.195783118e+01 8.064054093e+00 3.426386969e+01 4.189448857e+01 4.188555179e+01 -1.641859368e+00 1.239974257e+01 3.706460556e+01 -1.375568332e+00 1.399639500e+01 2.00 3.968856423e+01 5.749392616e+00 3.099920118e+01 3.966254102e+01 3.969597611e+01 -2.481317211e+00 9.854054727e+00 3.388968368e+01 -2.481225069e+00 1.133748434e+01 2.02 3.691230818e+01 3.682736722e+00 2.763558582e+01 3.690199295e+01 3.694749241e+01 -3.190719495e+00 7.551193784e+00 3.052398687e+01 -3.445984002e+00 8.894217318e+00 2.04 3.380725952e+01 1.851020437e+00 2.427172420e+01 3.379877190e+01 3.383520053e+01 -3.794025689e+00 5.468232015e+00 2.709128685e+01 -4.282492799e+00 6.661847013e+00 2.06 3.051788679e+01 2.392099690e-01 2.098159910e+01 3.050317420e+01 3.051788309e+01 -4.312144401e+00 3.583973683e+00 2.368926972e+01 -5.001933912e+00 4.631679371e+00 2.08 2.715827545e+01 -1.168362239e+00 1.781997074e+01 2.713395790e+01 2.712127513e+01 -4.762463555e+00 1.887251829e+00 2.039178736e+01 -5.613967840e+00 2.791182911e+00 2.10 2.381746305e+01 -2.387812732e+00 1.482708280e+01 2.378312410e+01 2.374247853e+01 -5.158376853e+00 3.696722540e-01 1.725225306e+01 -6.127797644e+00 1.126394386e+00 2.12 2.056475699e+01 -3.435236597e+00 1.203141344e+01 2.052056506e+01 2.045428655e+01 -5.510003043e+00 -9.832710959e-01 1.430747381e+01 -6.552724854e+00 -3.754215194e-01 2.14 1.745369545e+01 -4.328111744e+00 9.451385347e+00 1.739903371e+01 1.731084582e+01 -5.825206111e+00 -2.186264169e+00 1.158104273e+01 -6.898629241e+00 -1.724228408e+00 2.16 1.452559582e+01 -5.084676438e+00 7.096934439e+00 1.445846389e+01 1.435226131e+01 -6.110033556e+00 -3.246964804e+00 9.087575305e+00 -7.176759598e+00 -2.925873448e+00 2.18 1.181013655e+01 -5.722880345e+00 4.970121480e+00 1.172766630e+01 1.160677200e+01 -6.369902726e+00 -4.174238926e+00 6.830030334e+00 -7.398607610e+00 -3.983528142e+00 2.20 9.323124031e+00 -6.260393437e+00 3.066216155e+00 9.223429910e+00 9.090981092e+00 -6.611353372e+00 -4.978979854e+00 4.802661562e+00 -7.573827120e+00 -4.902083550e+00 2.22 7.071918716e+00 -6.712693311e+00 1.379743847e+00 6.957465723e+00 6.819130627e+00 -6.835788373e+00 -5.669623797e+00 2.995572702e+00 -7.707816577e+00 -5.682349538e+00 2.24 5.054125391e+00 -7.092782610e+00 -9.759469473e-02 4.931488753e+00 4.795080412e+00 -7.037509119e+00 -6.254969170e+00 1.394845593e+00 -7.805939727e+00 -6.326881852e+00 2.26 3.258306163e+00 -7.412436688e+00 -1.378981854e+00 3.134913874e+00 3.007478716e+00 -7.206856656e+00 -6.747973206e+00 -1.725418477e-02 -7.876333679e+00 -6.846226529e+00 2.28 1.667536873e+00 -7.681546475e+00 -2.479281706e+00 1.550783475e+00 1.438478036e+00 -7.333962126e+00 -7.160907816e+00 -1.260262095e+00 -7.926360906e+00 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