# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr # implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1 # composition = Ni3Pb # 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 2024-04-11 r A15--Cr3Si D0_3--BiF3 L1_2--AuCu3 0.50 nan nan nan 0.52 nan nan nan 0.54 nan nan nan 0.56 nan nan nan 0.58 nan nan nan 0.60 nan nan nan 0.62 nan nan nan 0.64 nan nan nan 0.66 nan nan nan 0.68 nan nan nan 0.70 nan nan nan 0.72 nan nan nan 0.74 nan nan nan 0.76 nan nan nan 0.78 nan nan nan 0.80 nan nan nan 0.82 nan nan nan 0.84 nan nan nan 0.86 nan nan nan 0.88 nan nan nan 0.90 nan nan nan 0.92 nan nan nan 0.94 nan nan nan 0.96 nan nan nan 0.98 nan nan nan 1.00 nan nan nan 1.02 nan nan nan 1.04 nan nan nan 1.06 nan nan nan 1.08 nan nan nan 1.10 nan nan nan 1.12 nan nan nan 1.14 2.079859068e+02 nan nan 1.16 1.911191642e+02 nan nan 1.18 1.756388520e+02 nan nan 1.20 1.614231791e+02 nan nan 1.22 1.483610024e+02 nan nan 1.24 1.363500085e+02 nan nan 1.26 1.252978111e+02 nan nan 1.28 1.151225102e+02 1.797368595e+02 2.064273508e+02 1.30 1.057511225e+02 1.663000676e+02 1.913831547e+02 1.32 9.711750077e+01 1.538693495e+02 1.774478373e+02 1.34 8.916128346e+01 1.423623041e+02 1.645340132e+02 1.36 8.182754555e+01 1.317045996e+02 1.525633734e+02 1.38 7.506622017e+01 1.218294873e+02 1.414641981e+02 1.40 6.883121726e+01 1.126768413e+02 1.311693453e+02 1.42 6.307969577e+01 1.041922160e+02 1.216155200e+02 1.44 5.777166775e+01 9.632585323e+01 1.127437095e+02 1.46 5.286985989e+01 8.903160897e+01 1.045000423e+02 1.48 4.833996833e+01 8.226621388e+01 9.683600990e+01 1.50 4.415175683e+01 7.598912160e+01 8.970787270e+01 1.52 4.028554514e+01 7.016273558e+01 8.307589548e+01 1.54 3.671892617e+01 6.475252555e+01 7.690390153e+01 1.56 3.342946653e+01 5.972672992e+01 7.115895808e+01 1.58 3.039633459e+01 5.505583632e+01 6.581093024e+01 1.60 2.759977749e+01 5.071230608e+01 6.083201028e+01 1.62 2.502105733e+01 4.667078874e+01 5.619637362e+01 1.64 2.264268099e+01 4.290984739e+01 5.187992372e+01 1.66 2.044864823e+01 3.941583554e+01 4.786005305e+01 1.68 1.842453811e+01 3.617105857e+01 4.411574860e+01 1.70 1.655738182e+01 3.315854618e+01 4.063294964e+01 1.72 1.483540805e+01 3.036246162e+01 3.739458451e+01 1.74 1.324781583e+01 2.776775538e+01 3.438262027e+01 1.76 1.178463878e+01 2.536005470e+01 3.158073825e+01 1.78 1.043667641e+01 2.312574463e+01 2.897421440e+01 1.80 9.195436495e+00 2.105214529e+01 2.654959027e+01 1.82 8.053081687e+00 1.912768299e+01 2.429432943e+01 1.84 7.002384790e+00 1.734193567e+01 2.219663469e+01 1.86 6.036682418e+00 1.568551277e+01 2.024543411e+01 1.88 5.149818621e+00 1.414981880e+01 1.843047225e+01 1.90 4.336076000e+00 1.272679009e+01 1.674237228e+01 1.92 3.590108662e+00 1.140870955e+01 1.517260472e+01 1.94 2.906900983e+00 1.018814525e+01 1.371337657e+01 1.96 2.281730408e+00 9.057985976e+00 1.235747527e+01 1.98 1.710130565e+00 8.011532569e+00 1.109813356e+01 2.00 1.187857934e+00 7.042577278e+00 9.928941431e+00 2.02 7.108940119e-01 6.145437833e+00 8.843825141e+00 2.04 2.754907616e-01 5.314944142e+00 7.837079029e+00 2.06 -1.217617650e-01 4.546401305e+00 6.903409639e+00 2.08 -4.839009225e-01 3.835547977e+00 6.037956793e+00 2.10 -8.136039393e-01 3.178518981e+00 5.236259135e+00 2.12 -1.113240705e+00 2.571806435e+00 4.494188260e+00 2.14 -1.384941601e+00 2.012212755e+00 3.807875155e+00 2.16 -1.630660729e+00 1.496798342e+00 3.173649183e+00 2.18 -1.852229628e+00 1.022825962e+00 2.587995109e+00 2.20 -2.051390799e+00 5.877063058e-01 2.047519787e+00 2.22 -2.229821775e+00 1.889543589e-01 1.548946560e+00 2.24 -2.389138229e+00 -1.758406210e-01 1.089118835e+00 2.26 -2.530881248e+00 -5.090296713e-01 6.650344188e-01 2.28 -2.656487511e+00 -8.129116054e-01 2.738950141e-01 2.30 -2.767283790e+00 -1.089730742e+00 -8.684827843e-02 2.32 -2.864488568e+00 -1.341682443e+00 -4.194685465e-01 2.34 -2.949233494e+00 -1.570897967e+00 -7.259655945e-01 2.36 -3.022600829e+00 -1.779419786e+00 -1.008090532e+00 2.38 -3.085645699e+00 -1.969153326e+00 -1.267384188e+00 2.40 -3.139151977e+00 -2.141815231e+00 -1.505212996e+00 2.42 -3.183525143e+00 -2.298898152e+00 -1.722806772e+00 2.44 -3.219229728e+00 -2.441665907e+00 -1.921289419e+00 2.46 -3.246775486e+00 -2.571176065e+00 -2.101707037e+00 2.48 -3.266669868e+00 -2.688314790e+00 -2.265055059e+00 2.50 -3.279393590e+00 -2.793848006e+00 -2.412306187e+00 2.52 -3.285395609e+00 -2.888456965e+00 -2.544439925e+00 2.54 -3.285098656e+00 -2.972764079e+00 -2.662462829e+00 2.56 -3.278907679e+00 -3.047350811e+00 -2.767426262e+00 2.58 -3.267217275e+00 -3.112769939e+00 -2.860429674e+00 2.60 -3.250418766e+00 -3.169532881e+00 -2.942595591e+00 2.62 -3.228902632e+00 -3.217896407e+00 -3.015025885e+00 2.64 -3.203061482e+00 -3.257960599e+00 -3.078754021e+00 2.66 -3.173288403e+00 -3.289906522e+00 -3.134699518e+00 2.68 -3.139972440e+00 -3.314007745e+00 -3.183565863e+00 2.70 -3.103491632e+00 -3.330626744e+00 -3.225627705e+00 2.72 -3.064205239e+00 -3.340209222e+00 -3.261069044e+00 2.74 -3.022450405e+00 -3.343271347e+00 -3.290083720e+00 2.76 -2.978571962e+00 -3.340377473e+00 -3.312878978e+00 2.78 -2.932811597e+00 -3.332109358e+00 -3.329677287e+00 2.80 -2.885369813e+00 -3.319033618e+00 -3.340715802e+00 2.82 -2.836432389e+00 -3.301670939e+00 -3.346243337e+00 2.84 -2.786172790e+00 -3.280478481e+00 -3.346517038e+00 2.86 -2.734754083e+00 -3.255843624e+00 -3.341798786e+00 2.88 -2.682331269e+00 -3.228088915e+00 -3.332352095e+00 2.90 -2.629049897e+00 -3.197483576e+00 -3.318439530e+00 2.92 -2.575038869e+00 -3.164257044e+00 -3.300320640e+00 2.94 -2.520429493e+00 -3.128611301e+00 -3.278250439e+00 2.96 -2.465351510e+00 -3.090730512e+00 -3.252477331e+00 2.98 -2.409937160e+00 -3.050787780e+00 -3.223247969e+00 3.00 -2.354318105e+00 -3.008964598e+00 -3.190800005e+00 3.02 -2.298623061e+00 -2.965446177e+00 -3.155369387e+00 3.04 -2.242975061e+00 -2.920355139e+00 -3.117191303e+00 3.06 -2.187488634e+00 -2.873822096e+00 -3.076503315e+00 3.08 -2.132267276e+00 -2.825984558e+00 -3.033561031e+00 3.10 -2.077401524e+00 -2.776989511e+00 -2.988642110e+00 3.12 -2.022967930e+00 -2.726991100e+00 -2.941974885e+00 3.14 -1.969029077e+00 -2.676152402e+00 -2.893802325e+00 3.16 -1.915634616e+00 -2.624637330e+00 -2.844382482e+00 3.18 -1.862823131e+00 -2.572603768e+00 -2.793980171e+00 3.20 -1.810624475e+00 -2.520206372e+00 -2.742855962e+00 3.22 -1.759062187e+00 -2.467597015e+00 -2.691255198e+00 3.24 -1.708155644e+00 -2.414919945e+00 -2.639395927e+00 3.26 -1.657921703e+00 -2.362307638e+00 -2.587456245e+00 3.28 -1.608375713e+00 -2.309877793e+00 -2.535573548e+00 3.30 -1.559531917e+00 -2.257731724e+00 -2.483852670e+00 3.32 -1.511403314e+00 -2.205954084e+00 -2.432369885e+00 3.34 -1.464001093e+00 -2.154613598e+00 -2.381178533e+00 3.36 -1.417333792e+00 -2.103764391e+00 -2.330315095e+00 3.38 -1.371406340e+00 -2.053447530e+00 -2.279804766e+00 3.40 -1.326219200e+00 -2.003692321e+00 -2.229666084e+00 3.42 -1.281766815e+00 -1.954518440e+00 -2.179914479e+00 3.44 -1.238042214e+00 -1.905935831e+00 -2.130564852e+00 3.46 -1.195031009e+00 -1.857946667e+00 -2.081633315e+00 3.48 -1.152718503e+00 -1.810546198e+00 -2.033138240e+00 3.50 -1.111091487e+00 -1.763723909e+00 -1.985099715e+00 3.52 -1.070142193e+00 -1.717464822e+00 -1.937543586e+00 3.54 -1.029872649e+00 -1.671750921e+00 -1.890494375e+00 3.56 -9.902988643e-01 -1.626562665e+00 -1.843979087e+00 3.58 -9.514541277e-01 -1.581880521e+00 -1.798025030e+00 3.60 -9.133906166e-01 -1.537686433e+00 -1.752658961e+00 3.62 -8.761786077e-01 -1.493965180e+00 -1.707906434e+00 3.64 -8.399028038e-01 -1.450705580e+00 -1.663791431e+00 3.66 -8.046557807e-01 -1.407901560e+00 -1.620336214e+00 3.68 -7.705291836e-01 -1.365553113e+00 -1.577561330e+00 3.70 -7.376039234e-01 -1.323667204e+00 -1.535485635e+00 3.72 -7.059409985e-01 -1.282258654e+00 -1.494126278e+00 3.74 -6.755745465e-01 -1.241351021e+00 -1.453498592e+00 3.76 -6.465082777e-01 -1.200977440e+00 -1.413615888e+00 3.78 -6.187157188e-01 -1.161181285e+00 -1.374489204e+00 3.80 -5.921439423e-01 -1.122016453e+00 -1.336127027e+00 3.82 -5.667198972e-01 -1.083546971e+00 -1.298535039e+00 3.84 -5.423582033e-01 -1.045845607e+00 -1.261715906e+00 3.86 -5.189693002e-01 -1.008991243e+00 -1.225669127e+00 3.88 -4.964670470e-01 -9.730649548e-01 -1.190390934e+00 3.90 -4.747751311e-01 -9.381450167e-01 -1.155874245e+00 3.92 -4.538315113e-01 -9.043009901e-01 -1.122108068e+00 3.94 -4.335928907e-01 -8.715899096e-01 -1.089079977e+00 3.96 -4.140333198e-01 -8.400494835e-01 -1.056772270e+00 3.98 -3.951449004e-01 -8.096970175e-01 -1.025164729e+00 4.00 -3.769345509e-01 -7.805280912e-01 -9.942339506e-01 4.02 -3.594197394e-01 -7.525175474e-01 -9.639533989e-01 4.04 -3.426232724e-01 -7.256219800e-01 -9.342934802e-01 4.06 -3.265678193e-01 -6.997831841e-01 -9.052216416e-01 4.08 -3.112708921e-01 -6.749320033e-01 -8.767025141e-01 4.10 -2.967409087e-01 -6.509910259e-01 -8.486981210e-01 4.12 -2.829747450e-01 -6.278824143e-01 -8.211681760e-01 4.14 -2.699569048e-01 -6.055236607e-01 -7.940705021e-01 4.16 -2.576601629e-01 -5.838347298e-01 -7.673616034e-01 4.18 -2.460473251e-01 -5.627384411e-01 -7.409974248e-01 4.20 -2.350737105e-01 -5.421617800e-01 -7.149343338e-01 4.22 -2.246899048e-01 -5.220369800e-01 -6.891303554e-01 4.24 -2.148444340e-01 -5.023025150e-01 -6.635466819e-01 4.26 -2.054861660e-01 -4.829041185e-01 -6.381494646e-01 4.28 -1.965657637e-01 -4.637958992e-01 -6.129118699e-01 4.30 -1.880380174e-01 -4.449415792e-01 -5.878163467e-01 4.32 -1.798639660e-01 -4.263158177e-01 -5.628570039e-01 4.34 -1.720099244e-01 -4.079055254e-01 -5.380419376e-01 4.36 -1.644476308e-01 -3.897110142e-01 -5.133952817e-01 4.38 -1.571568080e-01 -3.717467776e-01 -4.889586960e-01 4.40 -1.501215624e-01 -3.540416694e-01 -4.647919697e-01 4.42 -1.433324887e-01 -3.366382627e-01 -4.409724259e-01 4.44 -1.367853463e-01 -3.195912223e-01 -4.175928889e-01 4.46 -1.304801338e-01 -3.029646362e-01 -3.947581164e-01 4.48 -1.244199567e-01 -2.868283947e-01 -3.725798123e-01 4.50 -1.186097656e-01 -2.712538699e-01 -3.511705672e-01 4.52 -1.130545057e-01 -2.563092861e-01 -3.306360345e-01 4.54 -1.077602347e-01 -2.420552599e-01 -3.110737716e-01 4.56 -1.027294498e-01 -2.285409837e-01 -2.925595513e-01 4.58 -9.796288848e-02 -2.158014455e-01 -2.751490668e-01 4.60 -9.345841802e-02 -2.038559094e-01 -2.588742413e-01 4.62 -8.921091596e-02 -1.927077108e-01 -2.437429662e-01 4.64 -8.521242970e-02 -1.823452394e-01 -2.297405837e-01 4.66 -8.145255120e-02 -1.727438338e-01 -2.168327274e-01 4.68 -7.791892836e-02 -1.638682543e-01 -2.049690406e-01 4.70 -7.459783600e-02 -1.556754195e-01 -1.940872959e-01 4.72 -7.147474090e-02 -1.481170909e-01 -1.841174613e-01 4.74 -6.853481327e-02 -1.411416263e-01 -1.749853933e-01 4.76 -6.576335517e-02 -1.346978292e-01 -1.666159787e-01 4.78 -6.314613360e-02 -1.287358040e-01 -1.589354464e-01 4.80 -6.066961879e-02 -1.232068199e-01 -1.518728435e-01 4.82 -5.832113652e-02 -1.180675799e-01 -1.453631793e-01 4.84 -5.608894835e-02 -1.132756096e-01 -1.393465765e-01 4.86 -5.396227497e-02 -1.087931349e-01 -1.337685349e-01 4.88 -5.193127756e-02 -1.045861771e-01 -1.285800932e-01 4.90 -4.998701038e-02 -1.006244415e-01 -1.237377140e-01 4.92 -4.812135556e-02 -9.688110680e-02 -1.192029916e-01 4.94 -4.632694872e-02 -9.333255950e-02 -1.149422541e-01 4.96 -4.459710218e-02 -8.995810361e-02 -1.109261157e-01 4.98 -4.292573022e-02 -8.673966889e-02 -1.071290146e-01 5.00 -4.130728015e-02 -8.366153220e-02 -1.035287626e-01 5.02 -3.973667107e-02 -8.071006092e-02 -1.001061211e-01 5.04 -3.820924200e-02 -7.787348299e-02 -9.684441185e-02 5.06 -3.672070983e-02 -7.514168503e-02 -9.372916648e-02 5.08 -3.526713845e-02 -7.250603700e-02 -9.074781567e-02 5.10 -3.384491858e-02 -6.995924088e-02 -8.788941594e-02 5.12 -3.245075845e-02 -6.749519917e-02 -8.514441202e-02 5.14 -3.108168519e-02 -6.510889825e-02 -8.250443142e-02 5.16 -2.973505630e-02 -6.279630125e-02 -7.996210773e-02 5.18 -2.840858061e-02 -6.055424516e-02 -7.751092933e-02 5.20 -2.710034729e-02 -5.838033759e-02 -7.514511025e-02 5.22 -2.580886122e-02 -5.627284939e-02 -7.285948010e-02 5.24 -2.453308223e-02 -5.423060095e-02 -7.064939056e-02 5.26 -2.327246521e-02 -5.225283485e-02 -6.851063588e-02 5.28 -2.202699687e-02 -5.033901901e-02 -6.643938535e-02 5.30 -2.079722496e-02 -4.848889235e-02 -6.443212605e-02 5.32 -1.958421307e-02 -4.670227558e-02 -6.248561410e-02 5.34 -1.838954268e-02 -4.497891969e-02 -6.059683325e-02 5.36 -1.721550818e-02 -4.331840618e-02 -5.876295967e-02 5.38 -1.606491083e-02 -4.172006748e-02 -5.698133198e-02 5.40 -1.494097462e-02 -4.018293105e-02 -5.524942565e-02 5.42 -1.384724104e-02 -3.870568860e-02 -5.356483127e-02 5.44 -1.278743988e-02 -3.728668958e-02 -5.192523606e-02 5.46 -1.176534176e-02 -3.592395633e-02 -5.032840827e-02 5.48 -1.078460107e-02 -3.461521685e-02 -4.877218398e-02 5.50 -9.848599423e-03 -3.335795016e-02 -4.725445631e-02 5.52 -8.960300485e-03 -3.214943941e-02 -4.577316661e-02 5.54 -8.122126170e-03 -3.098682791e-02 -4.432589219e-02 5.56 -7.335862609e-03 -2.986717426e-02 -4.291152065e-02 5.58 -6.602601253e-03 -2.878750378e-02 -4.152763457e-02 5.60 -5.922717254e-03 -2.774485417e-02 -4.017232147e-02 5.62 -5.295883860e-03 -2.673631482e-02 -3.884370310e-02 5.64 -4.721118607e-03 -2.575905912e-02 -3.753993874e-02 5.66 -4.196854932e-03 -2.481037095e-02 -3.625923149e-02 5.68 -3.721031660e-03 -2.388766576e-02 -3.499983692e-02 5.70 -3.291192510e-03 -2.298850749e-02 -3.376007467e-02 5.72 -2.904588343e-03 -2.211062246e-02 -3.253834292e-02 5.74 -2.558276025e-03 -2.125191138e-02 -3.133313598e-02 5.76 -2.249209206e-03 -2.041046042e-02 -3.014306493e-02 5.78 -1.974317871e-03 -1.958455211e-02 -2.896688130e-02 5.80 -1.730574967e-03 -1.877267661e-02 -2.780350334e-02 5.82 -1.515049615e-03 -1.797354353e-02 -2.665204447e-02 5.84 -1.324947362e-03 -1.718609429e-02 -2.551184313e-02 5.86 -1.157638584e-03 -1.640951458e-02 -2.438249289e-02 5.88 -1.010676538e-03 -1.564324624e-02 -2.326387141e-02 5.90 -8.818067242e-04 -1.488699756e-02 -2.215616656e-02 5.92 -7.689692549e-04 -1.414075088e-02 -2.105989771e-02 5.94 -6.702958118e-04 -1.340475198e-02 -1.997590917e-02 5.96 -5.841025957e-04 -1.267945770e-02 -1.890529977e-02 5.98 -5.088804906e-04 -1.196567500e-02 -1.784963913e-02 6.00 -4.432834457e-04 -1.126447391e-02 -1.681084396e-02