# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2021--Ko-W-S-Lee-J-S-Kim-D-H--Ag-Cu-Sn # implementation = 2021--Ko-W-S--Ag-Cu-Sn--LAMMPS--ipr1 # composition = AgSn3 # 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 2026-06-16 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 6.312868668e+02 nan nan 0.92 5.956800136e+02 nan nan 0.94 5.619579683e+02 nan nan 0.96 5.300270698e+02 nan nan 0.98 4.997979441e+02 5.793261950e+02 nan 1.00 4.711853321e+02 5.496543868e+02 nan 1.02 4.441079221e+02 5.214048382e+02 6.675394699e+02 1.04 4.184881887e+02 4.945135006e+02 6.340185223e+02 1.06 3.942522360e+02 4.689189906e+02 6.020741548e+02 1.08 3.713296458e+02 4.445624918e+02 5.716368353e+02 1.10 3.496533319e+02 4.213876597e+02 5.426398529e+02 1.12 3.291593978e+02 3.993405296e+02 5.150192185e+02 1.14 3.097870012e+02 3.783694271e+02 4.887135666e+02 1.16 2.914782216e+02 3.584248808e+02 4.636640610e+02 1.18 2.741779333e+02 3.394595386e+02 4.398143022e+02 1.20 2.578336834e+02 3.214280854e+02 4.171102376e+02 1.22 2.423955738e+02 3.042871643e+02 3.955000751e+02 1.24 2.278161477e+02 2.879953002e+02 3.749341981e+02 1.26 2.140502803e+02 2.725128257e+02 3.553650839e+02 1.28 2.010550742e+02 2.578018089e+02 3.367472239e+02 1.30 1.887897581e+02 2.438259851e+02 3.190370473e+02 1.32 1.772155903e+02 2.305506891e+02 3.021928460e+02 1.34 1.662957653e+02 2.179427909e+02 2.861747029e+02 1.36 1.559953246e+02 2.059706337e+02 2.709444216e+02 1.38 1.462810712e+02 1.946039728e+02 2.564654594e+02 1.40 1.371214868e+02 1.838139184e+02 2.427028618e+02 1.42 1.284866539e+02 1.735728795e+02 2.296231994e+02 1.44 1.203481795e+02 1.638545095e+02 2.171945073e+02 1.46 1.126791232e+02 1.546336545e+02 2.053862256e+02 1.48 1.054539280e+02 1.458863036e+02 1.941691435e+02 1.50 9.864835377e+01 1.375895399e+02 1.835153437e+02 1.52 9.223941400e+01 1.297214950e+02 1.733981501e+02 1.54 8.620531520e+01 1.222613036e+02 1.637920766e+02 1.56 8.052539883e+01 1.151890610e+02 1.546727783e+02 1.58 7.518008591e+01 1.084857818e+02 1.460170036e+02 1.60 7.015082408e+01 1.021333602e+02 1.378025492e+02 1.62 6.542003698e+01 9.611453154e+01 1.300082160e+02 1.64 6.097107600e+01 9.041283616e+01 1.226137668e+02 1.66 5.678817416e+01 8.501258390e+01 1.155998857e+02 1.68 5.285640210e+01 7.989882039e+01 1.089481388e+02 1.70 4.916162615e+01 7.505729466e+01 1.026409372e+02 1.72 4.569046823e+01 7.047442794e+01 9.666149997e+01 1.74 4.243026777e+01 6.613728387e+01 9.099382006e+01 1.76 3.936904527e+01 6.203353984e+01 8.562263057e+01 1.78 3.649546764e+01 5.815145948e+01 8.053337273e+01 1.80 3.379881521e+01 5.447986640e+01 7.571216510e+01 1.82 3.126895023e+01 5.100811889e+01 7.114577392e+01 1.84 2.889628693e+01 4.772608576e+01 6.682158474e+01 1.86 2.667176305e+01 4.462412321e+01 6.272757513e+01 1.88 2.458681262e+01 4.169305254e+01 5.885228849e+01 1.90 2.263334024e+01 3.892413899e+01 5.518480896e+01 1.92 2.080369645e+01 3.630907135e+01 5.171473739e+01 1.94 1.909065440e+01 3.383994246e+01 4.843216817e+01 1.96 1.748738765e+01 3.150923065e+01 4.532766717e+01 1.98 1.598744905e+01 2.930978179e+01 4.239225050e+01 2.00 1.458475067e+01 2.723479231e+01 3.961736418e+01 2.02 1.327354477e+01 2.527779288e+01 3.699486468e+01 2.04 1.204840566e+01 2.343263272e+01 3.451700029e+01 2.06 1.090421252e+01 2.169346478e+01 3.217639318e+01 2.08 9.836133075e+00 2.005473143e+01 2.996602242e+01 2.10 8.839608085e+00 1.851115080e+01 2.787920750e+01 2.12 7.910336630e+00 1.705770379e+01 2.590959272e+01 2.14 7.044262154e+00 1.568962163e+01 2.405113218e+01 2.16 6.237559218e+00 1.440237396e+01 2.229807547e+01 2.18 5.486620932e+00 1.319165748e+01 2.064495388e+01 2.20 4.788047042e+00 1.205338511e+01 1.908656736e+01 2.22 4.138632626e+00 1.098367565e+01 1.761797191e+01 2.24 3.535357391e+00 9.978843882e+00 1.623446764e+01 2.26 2.975375508e+00 9.035391128e+00 1.493158723e+01 2.28 2.456006002e+00 8.149996260e+00 1.370508508e+01 2.30 1.974723627e+00 7.319507110e+00 1.255092672e+01 2.32 1.529150237e+00 6.540932263e+00 1.146527892e+01 2.34 1.117046600e+00 5.811433248e+00 1.044450003e+01 2.36 7.363046606e-01 5.128317084e+00 9.485130950e+00 2.38 3.849401970e-01 4.489029161e+00 8.583886348e+00 2.40 6.108588666e-02 3.891146467e+00 7.737646373e+00 2.42 -2.370152679e-01 3.332371127e+00 6.943448702e+00 2.44 -5.110161565e-01 2.810524234e+00 6.198480960e+00 2.46 -7.624714429e-01 2.323539989e+00 5.500073491e+00 2.48 -9.928431310e-01 1.869460098e+00 4.845692448e+00 2.50 -1.203505828e+00 1.446428445e+00 4.232933212e+00 2.52 -1.395751722e+00 1.052686016e+00 3.659514112e+00 2.54 -1.570795288e+00 6.865660556e-01 3.123270426e+00 2.56 -1.729777737e+00 3.464894645e-01 2.622148674e+00 2.58 -1.873771223e+00 3.096041347e-02 2.154201170e+00 2.60 -2.003782813e+00 -2.614378385e-01 1.717580824e+00 2.62 -2.120758248e+00 -5.320469162e-01 1.310536196e+00 2.64 -2.225585486e+00 -7.821371165e-01 9.314067764e-01 2.66 -2.319098054e+00 -1.012911012e+00 5.786184874e-01 2.68 -2.402078216e+00 -1.225506877e+00 2.506794029e-01 2.70 -2.475259956e+00 -1.421001955e+00 -5.382433693e-02 2.72 -2.539331806e+00 -1.600415557e+00 -3.362324120e-01 2.74 -2.594939503e+00 -1.764712020e+00 -5.978140235e-01 2.76 -2.642688510e+00 -1.914803514e+00 -8.397714240e-01 2.78 -2.683146383e+00 -2.051552716e+00 -1.063243272e+00 2.80 -2.716845012e+00 -2.175775344e+00 -1.269307830e+00 2.82 -2.744282733e+00 -2.288242581e+00 -1.458986010e+00 2.84 -2.765926319e+00 -2.389683368e+00 -1.633244264e+00 2.86 -2.782212860e+00 -2.480786587e+00 -1.792997348e+00 2.88 -2.793551534e+00 -2.562203139e+00 -1.939110941e+00 2.90 -2.800325277e+00 -2.634547911e+00 -2.072404140e+00 2.92 -2.802892358e+00 -2.698401658e+00 -2.193651839e+00 2.94 -2.801587866e+00 -2.754312778e+00 -2.303586983e+00 2.96 -2.796725103e+00 -2.802799006e+00 -2.402902718e+00 2.98 -2.788596905e+00 -2.844349024e+00 -2.492254437e+00 3.00 -2.777476887e+00 -2.879423982e+00 -2.572261715e+00 3.02 -2.763620604e+00 -2.908458954e+00 -2.643510164e+00 3.04 -2.747266663e+00 -2.931864312e+00 -2.706553184e+00 3.06 -2.728637751e+00 -2.950027034e+00 -2.761913633e+00 3.08 -2.707941619e+00 -2.963311944e+00 -2.810085415e+00 3.10 -2.685371997e+00 -2.972062894e+00 -2.851534984e+00 3.12 -2.661109461e+00 -2.976603878e+00 -2.886702778e+00 3.14 -2.635322246e+00 -2.977240097e+00 -2.916004581e+00 3.16 -2.608167016e+00 -2.974258966e+00 -2.939832814e+00 3.18 -2.579789581e+00 -2.967931068e+00 -2.958557762e+00 3.20 -2.550325578e+00 -2.958511063e+00 -2.972528743e+00 3.22 -2.519901107e+00 -2.946238545e+00 -2.982075213e+00 3.24 -2.488633333e+00 -2.931338864e+00 -2.987507817e+00 3.26 -2.456631049e+00 -2.914023894e+00 -2.989119391e+00 3.28 -2.423995206e+00 -2.894492769e+00 -2.987185904e+00 3.30 -2.390819410e+00 -2.872932580e+00 -2.981967364e+00 3.32 -2.357190397e+00 -2.849519034e+00 -2.973708666e+00 3.34 -2.323188462e+00 -2.824417080e+00 -2.962640403e+00 3.36 -2.288887885e+00 -2.797781500e+00 -2.948979640e+00 3.38 -2.254357308e+00 -2.769757473e+00 -2.932930636e+00 3.40 -2.219660110e+00 -2.740481106e+00 -2.914685540e+00 3.42 -2.184854741e+00 -2.710079940e+00 -2.894425046e+00 3.44 -2.149995048e+00 -2.678673425e+00 -2.872319015e+00 3.46 -2.115130579e+00 -2.646373379e+00 -2.848527066e+00 3.48 -2.080306861e+00 -2.613284408e+00 -2.823199137e+00 3.50 -2.045565670e+00 -2.579504319e+00 -2.796476009e+00 3.52 -2.010945277e+00 -2.545124504e+00 -2.768489817e+00 3.54 -1.976480688e+00 -2.510230299e+00 -2.739364523e+00 3.56 -1.942203857e+00 -2.474901336e+00 -2.709216365e+00 3.58 -1.908143895e+00 -2.439211863e+00 -2.678154290e+00 3.60 -1.874327262e+00 -2.403231057e+00 -2.646280357e+00 3.62 -1.840777950e+00 -2.367023314e+00 -2.613690120e+00 3.64 -1.807517651e+00 -2.330648526e+00 -2.580472994e+00 3.66 -1.774565915e+00 -2.294162343e+00 -2.546712601e+00 3.68 -1.741940299e+00 -2.257616421e+00 -2.512487091e+00 3.70 -1.709656509e+00 -2.221058656e+00 -2.477869457e+00 3.72 -1.677728529e+00 -2.184533402e+00 -2.442927825e+00 3.74 -1.646168740e+00 -2.148081686e+00 -2.407725730e+00 3.76 -1.614988042e+00 -2.111741400e+00 -2.372322381e+00 3.78 -1.584195952e+00 -2.075547495e+00 -2.336772906e+00 3.80 -1.553800712e+00 -2.039532148e+00 -2.301128589e+00 3.82 -1.523809377e+00 -2.003724941e+00 -2.265437093e+00 3.84 -1.494227908e+00 -1.968153007e+00 -2.229742667e+00 3.86 -1.465061248e+00 -1.932841188e+00 -2.194086347e+00 3.88 -1.436313404e+00 -1.897812172e+00 -2.158506145e+00 3.90 -1.407987515e+00 -1.863086624e+00 -2.123037224e+00 3.92 -1.380085922e+00 -1.828683317e+00 -2.087712068e+00 3.94 -1.352610226e+00 -1.794619246e+00 -2.052560642e+00 3.96 -1.325561351e+00 -1.760909742e+00 -2.017610538e+00 3.98 -1.298939596e+00 -1.727568575e+00 -1.982887122e+00 4.00 -1.272744687e+00 -1.694608059e+00 -1.948413666e+00 4.02 -1.246387859e+00 -1.662039139e+00 -1.914211475e+00 4.04 -1.212050093e+00 -1.629871485e+00 -1.880300005e+00 4.06 -1.155626584e+00 -1.598113575e+00 -1.846696978e+00 4.08 -1.092590454e+00 -1.566772770e+00 -1.813418490e+00 4.10 -1.070118830e+00 -1.535855392e+00 -1.780479110e+00 4.12 -1.049068292e+00 -1.505366793e+00 -1.747891975e+00 4.14 -1.028342925e+00 -1.475311420e+00 -1.715668879e+00 4.16 -1.007941156e+00 -1.445692880e+00 -1.683820363e+00 4.18 -9.878612120e-01 -1.416513993e+00 -1.652355788e+00 4.20 -9.681011340e-01 -1.387776854e+00 -1.621283416e+00 4.22 -9.486587950e-01 -1.359482878e+00 -1.590610477e+00 4.24 -9.295319147e-01 -1.331632856e+00 -1.560343241e+00 4.26 -9.107180733e-01 -1.304103150e+00 -1.530487076e+00 4.28 -8.922147243e-01 -1.274377744e+00 -1.501046512e+00 4.30 -8.740192069e-01 -1.235590443e+00 -1.472025294e+00 4.32 -8.561287569e-01 -1.185983941e+00 -1.443426438e+00 4.34 -8.385405171e-01 -1.153975933e+00 -1.415252279e+00 4.36 -8.212515469e-01 -1.129540789e+00 -1.387504519e+00 4.38 -8.042588312e-01 -1.105537495e+00 -1.360184270e+00 4.40 -7.871357350e-01 -1.081962710e+00 -1.333292097e+00 4.42 -7.621616803e-01 -1.058812834e+00 -1.306828058e+00 4.44 -7.051246362e-01 -1.036084029e+00 -1.280791737e+00 4.46 -5.813250566e-01 -1.013772244e+00 -1.255182284e+00 4.48 -5.068185339e-01 -9.918732325e-01 -1.229998445e+00 4.50 -4.960931128e-01 -9.703825747e-01 -1.205238592e+00 4.52 -4.855515778e-01 -9.492956952e-01 -1.180900753e+00 4.54 -4.751926813e-01 -9.286078803e-01 -1.156982640e+00 4.56 -4.650150888e-01 -9.083142937e-01 -1.133481673e+00 4.58 -4.550173848e-01 -8.884099916e-01 -1.110395003e+00 4.60 -4.451980778e-01 -8.688899368e-01 -1.087719538e+00 4.62 -4.355556058e-01 -8.497490118e-01 -1.065451961e+00 4.64 -4.260883414e-01 -8.309820307e-01 -1.043588750e+00 4.66 -4.167945961e-01 -8.125837505e-01 -1.022126200e+00 4.68 -4.076726256e-01 -7.945488822e-01 -1.001060435e+00 4.70 -3.987206332e-01 -7.768720999e-01 -9.803874279e-01 4.72 -3.899367752e-01 -7.595480503e-01 -9.601030153e-01 4.74 -3.813191640e-01 -7.425713609e-01 -9.402029109e-01 4.76 -3.728658722e-01 -7.259366483e-01 -9.206827195e-01 4.78 -3.645749368e-01 -7.096385249e-01 -9.015379493e-01 4.80 -3.564443621e-01 -6.936716058e-01 -8.827640236e-01 4.82 -3.484721235e-01 -6.780305153e-01 -8.643562915e-01 4.84 -3.406561705e-01 -6.627098921e-01 -8.463100385e-01 4.86 -3.329944302e-01 -6.477043951e-01 -8.286204955e-01 4.88 -3.254848099e-01 -6.330087078e-01 -8.112828480e-01 4.90 -3.181252000e-01 -6.186175430e-01 -7.942922442e-01 4.92 -3.101807789e-01 -6.030748023e-01 -7.758374706e-01 4.94 -2.923979871e-01 -5.680662002e-01 -7.330223537e-01 4.96 -2.411253165e-01 -4.670397475e-01 -6.067887117e-01 4.98 -1.285186901e-01 -2.468628261e-01 -3.256711660e-01 5.00 -7.889189564e-23 -1.961498358e-22 -1.922480646e-22 5.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 6.00 0.000000000e+00 0.000000000e+00 0.000000000e+00