# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2009--Do-E-C-Shin-Y-H-Lee-B-J--In-N # implementation = 2009--Do-E-C--In-N--LAMMPS--ipr1 # composition = InN3 # 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 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 1.877815450e+03 nan nan 0.80 1.701758989e+03 nan nan 0.82 1.541832226e+03 nan nan 0.84 1.396579129e+03 1.436760065e+03 nan 0.86 1.264676047e+03 1.315078694e+03 2.022565043e+03 0.88 1.144919234e+03 1.203443453e+03 1.853264833e+03 0.90 1.036213588e+03 1.101036596e+03 1.697875862e+03 0.92 9.375625014e+02 1.007107541e+03 1.555269692e+03 0.94 8.480587228e+02 9.209671869e+02 1.424410204e+03 0.96 7.668761238e+02 8.419827189e+02 1.304345798e+03 0.98 6.932622851e+02 7.695728394e+02 1.194202242e+03 1.00 6.265318076e+02 7.032034294e+02 1.093176156e+03 1.02 5.660602730e+02 6.423835868e+02 1.000529068e+03 1.04 5.112787821e+02 5.866620211e+02 9.155820049e+02 1.06 4.616690099e+02 5.356237700e+02 8.377105593e+02 1.08 4.167587215e+02 4.888872062e+02 7.663404019e+02 1.10 3.761177004e+02 4.461013127e+02 7.009431887e+02 1.12 3.393540482e+02 4.069431919e+02 6.410328236e+02 1.14 3.061108166e+02 3.711157957e+02 5.861620501e+02 1.16 2.760629409e+02 3.383458456e+02 5.359193290e+02 1.18 2.489144441e+02 3.083819328e+02 4.899259865e+02 1.20 2.243958878e+02 2.809927738e+02 4.478335953e+02 1.22 2.022620455e+02 2.559656129e+02 4.093215758e+02 1.24 1.822897792e+02 2.331047539e+02 3.740949922e+02 1.26 1.642760999e+02 2.122302120e+02 3.418825272e+02 1.28 1.480363970e+02 1.931764730e+02 3.124346203e+02 1.30 1.334028202e+02 1.757913522e+02 2.855217529e+02 1.32 1.202228016e+02 1.599349440e+02 2.609328718e+02 1.34 1.083577059e+02 1.454786531e+02 2.384739339e+02 1.36 9.768159670e+01 1.323043039e+02 2.179665685e+02 1.38 8.808011009e+01 1.203033170e+02 1.992468407e+02 1.40 7.944942563e+01 1.093759525e+02 1.821641145e+02 1.42 7.169532654e+01 9.943060996e+01 1.665800020e+02 1.44 6.473234151e+01 9.038318491e+01 1.523673954e+02 1.46 5.848296129e+01 8.215647366e+01 1.394095741e+02 1.48 5.287692341e+01 7.467962533e+01 1.275993807e+02 1.50 4.785055955e+01 6.788763619e+01 1.168384614e+02 1.52 4.334619985e+01 6.172088312e+01 1.070365650e+02 1.54 3.931162962e+01 5.612469384e+01 9.811089710e+01 1.56 3.569959369e+01 5.104894997e+01 8.998552344e+01 1.58 3.246734458e+01 4.644772174e+01 8.259082090e+01 1.60 2.957623040e+01 4.227893054e+01 7.586297027e+01 1.62 2.699131943e+01 3.850403847e+01 6.974348957e+01 1.64 2.468105788e+01 3.508776176e+01 6.417880318e+01 1.66 2.261695817e+01 3.199780696e+01 5.911984519e+01 1.68 2.077331502e+01 2.920462775e+01 5.452169371e+01 1.70 1.912694695e+01 2.668120093e+01 5.034323401e+01 1.72 1.765696087e+01 2.440282022e+01 4.654684829e+01 1.74 1.634453801e+01 2.234690616e+01 4.309812979e+01 1.76 1.517273894e+01 2.049283132e+01 3.996561989e+01 1.78 1.412632644e+01 1.882175925e+01 3.712056562e+01 1.80 1.319160419e+01 1.731649639e+01 3.453669693e+01 1.82 1.235627035e+01 1.596135567e+01 3.219002136e+01 1.84 1.160928430e+01 1.474203119e+01 3.005863541e+01 1.86 1.094074570e+01 1.364548284e+01 2.812255077e+01 1.88 1.034178452e+01 1.265983029e+01 2.636353477e+01 1.90 9.804461258e+00 1.177425546e+01 2.476496345e+01 1.92 9.321676349e+00 1.097891300e+01 2.331168662e+01 1.94 8.887087898e+00 1.026484786e+01 2.198990387e+01 1.96 8.495037103e+00 9.623919746e+00 2.078705050e+01 1.98 8.140480587e+00 9.048733622e+00 1.969169291e+01 2.00 7.818929059e+00 8.532575911e+00 1.869343236e+01 2.02 7.526391713e+00 8.069355989e+00 1.778281671e+01 2.04 7.259325864e+00 7.653552401e+00 1.695125936e+01 2.06 7.014591331e+00 7.280163599e+00 1.619096484e+01 2.08 6.789409139e+00 6.944662681e+00 1.549486057e+01 2.10 6.581324166e+00 6.642955939e+00 1.485653419e+01 2.12 6.388171338e+00 6.371344820e+00 1.427017621e+01 2.14 6.208045093e+00 6.126491070e+00 1.373052727e+01 2.16 6.039271776e+00 5.905384806e+00 1.323282992e+01 2.18 5.880384722e+00 5.705315241e+00 1.277278436e+01 2.20 5.730101772e+00 5.523843900e+00 1.234650792e+01 2.22 5.587304994e+00 5.358780071e+00 1.195049792e+01 2.24 5.451022415e+00 5.208158360e+00 1.158159768e+01 2.26 5.320411571e+00 5.070218121e+00 1.123696538e+01 2.28 5.194744713e+00 4.943384671e+00 1.091404558e+01 2.30 5.073395505e+00 4.826252081e+00 1.061054315e+01 2.32 4.955827085e+00 4.717567460e+00 1.032439941e+01 2.34 4.841581366e+00 4.616216586e+00 1.005377032e+01 2.36 4.730269436e+00 4.521210767e+00 9.797006547e+00 2.38 4.621562985e+00 4.431674858e+00 9.552635224e+00 2.40 4.515186637e+00 4.346836299e+00 9.319343292e+00 2.42 4.410911115e+00 4.266015125e+00 9.095962293e+00 2.44 4.308547147e+00 4.188614839e+00 8.881454467e+00 2.46 4.207940054e+00 4.114114096e+00 8.674900071e+00 2.48 4.108964942e+00 4.042059112e+00 8.475485803e+00 2.50 4.011522446e+00 3.972056758e+00 8.282494243e+00 2.52 3.915534962e+00 3.903768256e+00 8.095294225e+00 2.54 3.820943330e+00 3.836903453e+00 7.913332064e+00 2.56 3.727703913e+00 3.771215598e+00 7.736123561e+00 2.58 3.635786027e+00 3.706496609e+00 7.563246731e+00 2.60 3.545169704e+00 3.642572755e+00 7.394335177e+00 2.62 3.455843725e+00 3.579300746e+00 7.229072075e+00 2.64 3.367803924e+00 3.516564186e+00 7.067184700e+00 2.66 3.281051705e+00 3.454270351e+00 6.908439464e+00 2.68 3.195592770e+00 3.392347282e+00 6.752637410e+00 2.70 3.111436021e+00 3.330741145e+00 6.599610132e+00 2.72 3.028592628e+00 3.269413853e+00 6.449216083e+00 2.74 2.947075223e+00 3.208340925e+00 6.301337230e+00 2.76 2.866897237e+00 3.147509546e+00 6.155876048e+00 2.78 2.788072325e+00 3.086916835e+00 6.012752798e+00 2.80 2.710613900e+00 3.026568286e+00 5.871903085e+00 2.82 2.634534749e+00 2.966476372e+00 5.733275660e+00 2.84 2.559846713e+00 2.906659302e+00 5.596830455e+00 2.86 2.486560442e+00 2.847139907e+00 5.462536825e+00 2.88 2.414685192e+00 2.787944662e+00 5.330371977e+00 2.90 2.344228683e+00 2.729102812e+00 5.200319578e+00 2.92 2.275196987e+00 2.670645605e+00 5.072368515e+00 2.94 2.207594453e+00 2.612605622e+00 4.946511812e+00 2.96 2.141423670e+00 2.555016187e+00 4.822745664e+00 2.98 2.076685440e+00 2.497910860e+00 4.701068599e+00 3.00 2.013378791e+00 2.441323001e+00 4.581480751e+00 3.02 1.951500989e+00 2.385285392e+00 4.463983229e+00 3.04 1.891047581e+00 2.329829924e+00 4.348577568e+00 3.06 1.832012440e+00 2.274987334e+00 4.235265278e+00 3.08 1.774387826e+00 2.220786984e+00 4.124047447e+00 3.10 1.718164450e+00 2.167256691e+00 4.014924423e+00 3.12 1.663331548e+00 2.114422585e+00 3.907895547e+00 3.14 1.609876959e+00 2.062309008e+00 3.802958943e+00 3.16 1.557787207e+00 2.010938440e+00 3.700111349e+00 3.18 1.507047584e+00 1.960331446e+00 3.599347994e+00 3.20 1.455625010e+00 1.910506657e+00 3.500662513e+00 3.22 1.358369811e+00 1.861480760e+00 3.404046884e+00 3.24 1.097103132e+00 1.813268511e+00 3.309491404e+00 3.26 6.977595729e-01 1.765882763e+00 3.216984682e+00 3.28 6.332301692e-01 1.719334501e+00 3.126513655e+00 3.30 6.152371446e-01 1.673632899e+00 3.038063621e+00 3.32 5.974954370e-01 1.628785369e+00 2.951618287e+00 3.34 5.800197497e-01 1.584797634e+00 2.867159828e+00 3.36 5.628230448e-01 1.541673796e+00 2.784668955e+00 3.38 5.459166504e-01 1.499416411e+00 2.704124995e+00 3.40 5.293103633e-01 1.458026568e+00 2.625505972e+00 3.42 5.130125500e-01 1.417503966e+00 2.548788694e+00 3.44 4.970302428e-01 1.377847002e+00 2.473948843e+00 3.46 4.813692325e-01 1.339052846e+00 2.400961068e+00 3.48 4.660341578e-01 1.301117524e+00 2.329799074e+00 3.50 4.507080807e-01 1.264036000e+00 2.260435718e+00 3.52 4.198195003e-01 1.227802252e+00 2.192843095e+00 3.54 3.141552667e-01 1.192409349e+00 2.126992629e+00 3.56 7.198368504e-02 1.157849528e+00 2.062855158e+00 3.58 7.970186260e-02 1.124114263e+00 2.000401018e+00 3.60 7.687816889e-02 1.091194332e+00 1.939600122e+00 3.62 7.414835537e-02 1.059079889e+00 1.880422036e+00 3.64 7.150966801e-02 1.027760521e+00 1.822836053e+00 3.66 6.895940760e-02 9.972253117e-01 1.766811260e+00 3.68 6.649493118e-02 9.674628966e-01 1.712316605e+00 3.70 6.411365328e-02 9.384615164e-01 1.659320953e+00 3.72 6.181304661e-02 9.102090682e-01 1.607793151e+00 3.74 5.959064266e-02 8.826931521e-01 1.557702071e+00 3.76 5.744403185e-02 8.559011161e-01 1.509016668e+00 3.78 5.537086356e-02 8.298200973e-01 1.461706019e+00 3.80 5.336884597e-02 8.044370607e-01 1.415739370e+00 3.82 5.143574565e-02 7.797388349e-01 1.371086168e+00 3.84 4.956938710e-02 7.557121457e-01 1.327716103e+00 3.86 4.776765208e-02 7.323436468e-01 1.285599134e+00 3.88 4.602847898e-02 7.096199484e-01 1.244705522e+00 3.90 4.434986191e-02 6.875276438e-01 1.205005855e+00 3.92 4.237080240e-02 6.628705867e-01 1.161161659e+00 3.94 3.578922320e-02 5.968753258e-01 1.048456145e+00 3.96 1.651808853e-02 4.086419999e-01 7.307060783e-01 3.98 -9.385042282e-03 1.016032679e-01 2.045978460e-01 4.00 -4.569445675e-23 -1.623110860e-22 -1.825049178e-22 4.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 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