# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2020--Zuo-Y-Chen-C-Li-X-et-al--Si-SNAP # implementation = SNAP_ZuoChenLi_2019_Si__MO_869330304805_000 # composition = Si # 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 2024-11-27 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 6.645139765e+02 nan nan nan nan 0.78 nan nan nan nan nan 5.380014333e+02 nan nan nan nan 0.80 nan nan nan nan nan 4.419443717e+02 nan nan 6.221940272e+02 nan 0.82 nan nan nan nan nan 3.716879324e+02 nan nan 4.990193964e+02 nan 0.84 nan nan nan nan nan 3.213583210e+02 nan nan 4.050238672e+02 nan 0.86 nan nan nan nan nan 2.763469727e+02 nan nan 3.332051340e+02 nan 0.88 nan nan nan nan nan 2.342768179e+02 nan nan 2.750475979e+02 nan 0.90 nan 5.098120837e+02 nan nan nan 1.973019572e+02 5.338336236e+02 nan 2.271078759e+02 5.017094545e+02 0.92 nan 4.177745529e+02 nan nan nan 1.667344835e+02 4.331811554e+02 nan 1.890938628e+02 4.133229799e+02 0.94 nan 3.430987669e+02 nan nan nan 1.428221309e+02 3.532432723e+02 nan 1.592879326e+02 3.409185690e+02 0.96 nan 2.818877679e+02 6.257913495e+02 nan nan 1.236749240e+02 2.902733791e+02 nan 1.366918863e+02 2.859456528e+02 0.98 nan 2.340194396e+02 5.226820639e+02 nan nan 1.080482929e+02 2.409945798e+02 5.704745546e+02 1.195699471e+02 2.425261596e+02 1.00 5.683314057e+02 1.955030032e+02 4.382616078e+02 5.563485434e+02 5.531987033e+02 9.549287944e+01 2.039216650e+02 4.722376392e+02 1.060576462e+02 2.043258074e+02 1.02 4.712297950e+02 1.640870952e+02 3.656707717e+02 4.663528494e+02 4.646223464e+02 8.440129008e+01 1.743232675e+02 3.898878044e+02 9.465892599e+01 1.711420168e+02 1.04 3.906927102e+02 1.372247627e+02 3.051781592e+02 3.927106898e+02 3.925945565e+02 7.488051256e+01 1.482115153e+02 3.240189488e+02 8.433855040e+01 1.448371077e+02 1.06 3.245444842e+02 1.161028088e+02 2.520271647e+02 3.301153822e+02 3.320338615e+02 6.768979011e+01 1.256216817e+02 2.705672196e+02 7.478457613e+01 1.261628439e+02 1.08 2.720199310e+02 9.961059674e+01 2.081994963e+02 2.774351958e+02 2.799469517e+02 6.287741209e+01 1.073755552e+02 2.273199069e+02 6.612685960e+01 1.128466206e+02 1.10 2.294259058e+02 8.628735390e+01 1.747704787e+02 2.328164493e+02 2.344963368e+02 5.984523321e+01 9.336977157e+01 1.924945360e+02 5.840252782e+01 1.018687778e+02 1.12 1.955673130e+02 7.550247353e+01 1.495227638e+02 1.961312074e+02 1.966917129e+02 5.776257044e+01 8.265877550e+01 1.646356677e+02 5.159088862e+01 9.209511886e+01 1.14 1.686018887e+02 6.591680203e+01 1.286403038e+02 1.666151541e+02 1.664681269e+02 5.621376305e+01 7.373198795e+01 1.416642105e+02 4.529335013e+01 8.309352890e+01 1.16 1.452266050e+02 5.760637404e+01 1.106794737e+02 1.425610343e+02 1.421418675e+02 5.499694743e+01 6.618269800e+01 1.220160478e+02 3.951416291e+01 7.464102544e+01 1.18 1.250984811e+02 5.106965268e+01 9.625334663e+01 1.228168112e+02 1.222377416e+02 5.398762102e+01 5.976705174e+01 1.053868980e+02 3.456837676e+01 6.645047220e+01 1.20 1.082782968e+02 4.558168003e+01 8.495609560e+01 1.064220654e+02 1.057528732e+02 5.310204398e+01 5.403759846e+01 9.104826715e+01 3.049165165e+01 5.868757071e+01 1.22 9.312161642e+01 4.054766347e+01 7.437918228e+01 9.261015437e+01 9.219485603e+01 5.201424290e+01 4.888945256e+01 7.869115659e+01 2.731370800e+01 5.068808826e+01 1.24 8.033199020e+01 3.623962624e+01 6.488910928e+01 8.132765566e+01 8.144976715e+01 5.059392327e+01 4.391256341e+01 6.842417071e+01 2.497056554e+01 4.310394981e+01 1.26 7.023599517e+01 3.257299373e+01 5.677260426e+01 7.230122764e+01 7.281061264e+01 4.876940344e+01 3.889377476e+01 6.062961598e+01 2.320185073e+01 3.647443553e+01 1.28 6.256594201e+01 2.898203028e+01 5.029475700e+01 6.490536911e+01 6.554650027e+01 4.661624837e+01 3.400852456e+01 5.470495673e+01 2.197122537e+01 3.113473113e+01 1.30 5.611572598e+01 2.564878076e+01 4.493972801e+01 5.831869663e+01 5.891770941e+01 4.423402621e+01 2.959003218e+01 5.006430866e+01 2.120957568e+01 2.712223865e+01 1.32 5.109459502e+01 2.283132617e+01 3.990611519e+01 5.234820269e+01 5.262005115e+01 4.163713892e+01 2.585347271e+01 4.642576834e+01 2.077594035e+01 2.425092251e+01 1.34 4.739525963e+01 2.066141183e+01 3.539468355e+01 4.715752101e+01 4.690890950e+01 3.891452716e+01 2.262698486e+01 4.333103140e+01 2.048889795e+01 2.187057199e+01 1.36 4.478790320e+01 1.883450601e+01 3.148754348e+01 4.270884772e+01 4.185579224e+01 3.608912912e+01 1.985236133e+01 4.045788697e+01 2.022744983e+01 2.002955400e+01 1.38 4.229766794e+01 1.707165816e+01 2.814146484e+01 3.876159544e+01 3.738173818e+01 3.314912675e+01 1.747259542e+01 3.734888119e+01 1.990121077e+01 1.866861147e+01 1.40 3.927366309e+01 1.541704922e+01 2.549828686e+01 3.520345737e+01 3.349073140e+01 3.021641739e+01 1.542226339e+01 3.395455201e+01 1.944091028e+01 1.776283926e+01 1.42 3.596223623e+01 1.394068936e+01 2.364957127e+01 3.206368639e+01 3.023580571e+01 2.739175869e+01 1.375475533e+01 3.046519267e+01 1.883596393e+01 1.736063436e+01 1.44 3.233573438e+01 1.261602717e+01 2.243574685e+01 2.927752538e+01 2.760867291e+01 2.474364535e+01 1.240644710e+01 2.708153846e+01 1.810999618e+01 1.736211169e+01 1.46 2.865048734e+01 1.141969167e+01 2.127051437e+01 2.672212265e+01 2.538697999e+01 2.222522182e+01 1.133602446e+01 2.398808351e+01 1.728878436e+01 1.763087243e+01 1.48 2.527143607e+01 1.024664344e+01 1.990807906e+01 2.440272534e+01 2.348295617e+01 1.984936179e+01 1.065503983e+01 2.119322576e+01 1.639908486e+01 1.799985349e+01 1.50 2.220737042e+01 9.074279432e+00 1.837203288e+01 2.226543888e+01 2.181232902e+01 1.764824690e+01 1.039377919e+01 1.870120260e+01 1.548162086e+01 1.828572311e+01 1.52 1.950094064e+01 7.962065334e+00 1.662958915e+01 2.030823442e+01 2.033127302e+01 1.561546294e+01 1.049454816e+01 1.655807469e+01 1.456870546e+01 1.839636243e+01 1.54 1.726788506e+01 6.960440147e+00 1.468106831e+01 1.854645464e+01 1.900920349e+01 1.374379156e+01 1.083122651e+01 1.477893061e+01 1.365594743e+01 1.829709774e+01 1.56 1.548595331e+01 6.091416558e+00 1.264558875e+01 1.691117015e+01 1.776489179e+01 1.203920641e+01 1.125513938e+01 1.323904898e+01 1.272670115e+01 1.798599647e+01 1.58 1.389633698e+01 5.352468587e+00 1.062254029e+01 1.534070776e+01 1.653416442e+01 1.049576016e+01 1.164293223e+01 1.176821989e+01 1.176499123e+01 1.749430247e+01 1.60 1.245521496e+01 4.722258123e+00 8.683228972e+00 1.378631465e+01 1.517286624e+01 9.097989265e+00 1.189655341e+01 1.034007843e+01 1.077234120e+01 1.686613285e+01 1.62 1.114960204e+01 4.163837879e+00 6.879083503e+00 1.225842978e+01 1.366737255e+01 7.824016004e+00 1.196100029e+01 8.941305521e+00 9.764348147e+00 1.615288600e+01 1.64 9.951526066e+00 3.665495017e+00 5.245981941e+00 1.079673226e+01 1.210100747e+01 6.649673749e+00 1.181499241e+01 7.598457940e+00 8.758788052e+00 1.541981481e+01 1.66 8.664954899e+00 3.224917895e+00 3.732553402e+00 9.341024455e+00 1.048185667e+01 5.565627505e+00 1.146750299e+01 6.278549915e+00 7.760923456e+00 1.466994066e+01 1.68 7.320739441e+00 2.839423411e+00 2.416079711e+00 7.936002782e+00 8.887036426e+00 4.563138462e+00 1.095125041e+01 5.065745684e+00 6.778192905e+00 1.389063452e+01 1.70 6.028603739e+00 2.496129621e+00 1.382255380e+00 6.649742328e+00 7.405215397e+00 3.629684977e+00 1.031083475e+01 4.030426965e+00 5.826456425e+00 1.308259598e+01 1.72 4.875870030e+00 2.175282567e+00 6.699492104e-01 5.497504395e+00 6.063446294e+00 2.752866480e+00 9.590900038e+00 3.198876382e+00 4.909469769e+00 1.225068787e+01 1.74 3.909918638e+00 1.859388081e+00 2.703733571e-01 4.505704440e+00 4.902320096e+00 1.925375553e+00 8.818289347e+00 2.555746947e+00 4.039382823e+00 1.139819424e+01 1.76 3.132154485e+00 1.543039972e+00 1.381239741e-01 3.694662669e+00 3.962221236e+00 1.173086351e+00 8.006162923e+00 2.058909843e+00 3.224909725e+00 1.048323952e+01 1.78 2.523359458e+00 1.228215981e+00 2.350681967e-01 3.061719730e+00 3.249751304e+00 5.016922822e-01 7.171869101e+00 1.662534600e+00 2.468948226e+00 9.503712938e+00 1.80 2.041713444e+00 9.242225888e-01 5.087808511e-01 2.581039407e+00 2.742433954e+00 -9.259041334e-02 6.331199733e+00 1.332962881e+00 1.770191234e+00 8.480417864e+00 1.82 1.639571045e+00 6.371360192e-01 8.944543840e-01 2.213951185e+00 2.397438982e+00 -6.152408640e-01 5.489828372e+00 1.058100204e+00 1.124745051e+00 7.440215049e+00 1.84 1.285357477e+00 3.613303858e-01 1.320572769e+00 1.924472838e+00 2.165183999e+00 -1.073550287e+00 4.655173974e+00 8.383395842e-01 5.274297492e-01 6.410996590e+00 1.86 9.802854427e-01 7.863331638e-02 1.714207230e+00 1.689597515e+00 2.002257297e+00 -1.476599690e+00 3.839566534e+00 6.744933056e-01 -2.550394182e-02 5.417359301e+00 1.88 7.402178806e-01 -2.230630882e-01 2.009609970e+00 1.497047502e+00 1.881333033e+00 -1.834989564e+00 3.055427201e+00 5.569488856e-01 -5.345724922e-01 4.477738859e+00 1.90 5.604750213e-01 -5.506048671e-01 2.162458661e+00 1.335632691e+00 1.781867183e+00 -2.160207060e+00 2.314302704e+00 4.737427687e-01 -1.000097211e+00 3.603306259e+00 1.92 4.315350956e-01 -9.046526947e-01 2.191901175e+00 1.196480210e+00 1.688487070e+00 -2.463576338e+00 1.622075345e+00 4.128082834e-01 -1.422712304e+00 2.798453672e+00 1.94 3.418875386e-01 -1.280134617e+00 2.124916334e+00 1.070626480e+00 1.588265958e+00 -2.754865598e+00 9.790599157e-01 3.627391714e-01 -1.803497285e+00 2.062347396e+00 1.96 2.790671285e-01 -1.667820687e+00 1.988443158e+00 9.483275501e-01 1.469274055e+00 -3.035962653e+00 3.793798901e-01 3.135665705e-01 -2.144977714e+00 1.390890639e+00 1.98 2.307984384e-01 -2.056524625e+00 1.812414031e+00 8.202870528e-01 1.324264707e+00 -3.294640586e+00 -1.746098578e-01 2.528505289e-01 -2.451195735e+00 7.785228047e-01 2.00 1.860929276e-01 -2.435340063e+00 1.597338357e+00 6.800945886e-01 1.147453761e+00 -3.533915119e+00 -6.763711460e-01 1.697777216e-01 -2.727584862e+00 2.195124181e-01 2.02 1.318235560e-01 -2.795374140e+00 1.343789574e+00 5.229767198e-01 9.373985660e-01 -3.757137163e+00 -1.123078218e+00 6.072476537e-02 -2.979373992e+00 -2.941687123e-01 2.04 5.706899363e-02 -3.130625025e+00 1.054685702e+00 3.462624594e-01 6.954922589e-01 -3.966433252e+00 -1.515856780e+00 -7.527845409e-02 -3.210094315e+00 -7.649054113e-01 2.06 -4.147556807e-02 -3.437913851e+00 7.352674906e-01 1.512152141e-01 4.260359207e-01 -4.162746468e+00 -1.859245877e+00 -2.372295951e-01 -3.422185001e+00 -1.190681764e+00 2.08 -1.648982930e-01 -3.716059639e+00 3.926225231e-01 -6.130533994e-02 1.336281298e-01 -4.345975709e+00 -2.160065135e+00 -4.227110206e-01 -3.618750076e+00 -1.571747700e+00 2.10 -3.130684080e-01 -3.965222082e+00 3.486409980e-02 -2.913199032e-01 -1.788504977e-01 -4.515203180e+00 -2.426023178e+00 -6.333148409e-01 -3.803372467e+00 -1.910668784e+00 2.12 -4.852049978e-01 -4.187239016e+00 -3.298339094e-01 -5.370899092e-01 -5.061579628e-01 -4.668994525e+00 -2.664449644e+00 -8.681898869e-01 -3.975771593e+00 -2.212164005e+00 2.14 -6.798076058e-01 -4.380709434e+00 -7.004972848e-01 -7.958844433e-01 -8.416367702e-01 -4.804837220e+00 -2.881679757e+00 -1.122611487e+00 -4.136071599e+00 -2.482619962e+00 2.16 -8.940147672e-01 -4.546419809e+00 -1.080342358e+00 -1.063702874e+00 -1.177629795e+00 -4.921993466e+00 -3.083965955e+00 -1.391137480e+00 -4.285356332e+00 -2.729246757e+00 2.18 -1.122721289e+00 -4.685135826e+00 -1.463523374e+00 -1.334979395e+00 -1.506023752e+00 -5.022433745e+00 -3.273707702e+00 -1.667439484e+00 -4.424048505e+00 -2.958965810e+00 2.20 -1.360237721e+00 -4.796616599e+00 -1.843194616e+00 -1.604366603e+00 -1.820515425e+00 -5.108149637e+00 -3.451967502e+00 -1.950720193e+00 -4.551659964e+00 -3.176107754e+00 2.22 -1.617184929e+00 -4.882543790e+00 -2.212025847e+00 -1.880398372e+00 -2.128143640e+00 -5.180971678e+00 -3.619688331e+00 -2.244983461e+00 -4.667775080e+00 -3.374764287e+00 2.24 -1.893338823e+00 -4.943876569e+00 -2.562790747e+00 -2.163099789e+00 -2.428591033e+00 -5.242439475e+00 -3.778213432e+00 -2.545312570e+00 -4.769276442e+00 -3.554892803e+00 2.26 -2.183686503e+00 -4.982133207e+00 -2.889000413e+00 -2.448694273e+00 -2.718677453e+00 -5.293731241e+00 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