# 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 = CoCu3 # 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 1.208131075e+02 nan nan 1.16 1.099554931e+02 nan nan 1.18 1.000469411e+02 nan nan 1.20 9.100324939e+01 nan nan 1.22 8.274695461e+01 nan nan 1.24 7.520539031e+01 nan nan 1.26 6.831236246e+01 nan nan 1.28 6.200879668e+01 1.024876215e+02 1.197086237e+02 1.30 5.624139927e+01 9.393317908e+01 1.100303923e+02 1.32 5.096156827e+01 8.606451202e+01 1.011111869e+02 1.34 4.612554777e+01 7.882075856e+01 9.288869096e+01 1.36 4.169498137e+01 7.214888556e+01 8.530600831e+01 1.38 3.763678558e+01 6.600287193e+01 7.831072553e+01 1.40 3.392205916e+01 6.034186453e+01 7.185465165e+01 1.42 3.052518110e+01 5.512872261e+01 6.589398234e+01 1.44 2.742113228e+01 5.032880420e+01 6.038934830e+01 1.46 2.458472967e+01 4.590900791e+01 5.530529898e+01 1.48 2.199183143e+01 4.183755525e+01 5.060931961e+01 1.50 1.962021192e+01 3.808458107e+01 4.627110242e+01 1.52 1.745030771e+01 3.462293928e+01 4.226261418e+01 1.54 1.546518999e+01 3.142879450e+01 3.855853643e+01 1.56 1.364987158e+01 2.848136213e+01 3.513628450e+01 1.58 1.199047761e+01 2.576101384e+01 3.197563189e+01 1.60 1.047376270e+01 2.325017875e+01 2.905870679e+01 1.62 9.087063180e+00 2.093334021e+01 2.636802513e+01 1.64 7.818521306e+00 1.879699126e+01 2.388689158e+01 1.66 6.657424913e+00 1.682921504e+01 2.159892818e+01 1.68 5.594510015e+00 1.501904800e+01 1.948786026e+01 1.70 4.622044017e+00 1.335589652e+01 1.753797122e+01 1.72 3.733620109e+00 1.182913583e+01 1.573494208e+01 1.74 2.923777990e+00 1.042796877e+01 1.406648360e+01 1.76 2.187624409e+00 9.141608911e+00 1.252236741e+01 1.78 1.520550136e+00 7.959726324e+00 1.109396663e+01 1.80 9.180453656e-01 6.872941806e+00 9.773687719e+00 1.82 3.755808938e-01 5.873128816e+00 8.554574311e+00 1.84 -1.114536511e-01 4.953404776e+00 7.430136890e+00 1.86 -5.477354417e-01 4.107872953e+00 6.394320503e+00 1.88 -9.379172193e-01 3.331279811e+00 5.441501595e+00 1.90 -1.286503257e+00 2.618734133e+00 4.566449661e+00 1.92 -1.597745207e+00 1.965558808e+00 3.764229204e+00 1.94 -1.875574637e+00 1.367279562e+00 3.030041480e+00 1.96 -2.123559430e+00 8.197062572e-01 2.359051711e+00 1.98 -2.344870954e+00 3.190330295e-01 1.746297326e+00 2.00 -2.542259716e+00 -1.381089876e-01 1.186756662e+00 2.02 -2.718046392e+00 -5.546728078e-01 6.755662210e-01 2.04 -2.874140376e+00 -9.332767453e-01 2.082805810e-01 2.06 -3.012094594e+00 -1.276310201e+00 -2.189509847e-01 2.08 -3.133191695e+00 -1.586027043e+00 -6.093545303e-01 2.10 -3.238543000e+00 -1.864604312e+00 -9.656267124e-01 2.12 -3.329214655e+00 -2.114164879e+00 -1.290089813e+00 2.14 -3.406225467e+00 -2.336776815e+00 -1.584847742e+00 2.16 -3.470548263e+00 -2.534444723e+00 -1.851911692e+00 2.18 -3.523194383e+00 -2.709103524e+00 -2.093283480e+00 2.20 -3.565183434e+00 -2.862618742e+00 -2.310989533e+00 2.22 -3.597499808e+00 -2.996792528e+00 -2.507059562e+00 2.24 -3.621054105e+00 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-3.058059501e+00 -3.631059780e+00 -3.713012637e+00 2.62 -2.999908769e+00 -3.603022945e+00 -3.697081576e+00 2.64 -2.940752585e+00 -3.569917794e+00 -3.677034688e+00 2.66 -2.880636859e+00 -3.532181788e+00 -3.653143524e+00 2.68 -2.819619570e+00 -3.490288553e+00 -3.625622426e+00 2.70 -2.757780219e+00 -3.444745304e+00 -3.594695159e+00 2.72 -2.695226401e+00 -3.396083910e+00 -3.560552180e+00 2.74 -2.632096174e+00 -3.344841551e+00 -3.523346115e+00 2.76 -2.568555189e+00 -3.291532290e+00 -3.483217801e+00 2.78 -2.504788797e+00 -3.236616409e+00 -3.440315937e+00 2.80 -2.440991114e+00 -3.180476453e+00 -3.394809990e+00 2.82 -2.377353951e+00 -3.123406630e+00 -3.346896955e+00 2.84 -2.314058008e+00 -3.065617090e+00 -3.296802242e+00 2.86 -2.251267050e+00 -3.007249790e+00 -3.244774587e+00 2.88 -2.189124413e+00 -2.948400162e+00 -3.191075424e+00 2.90 -2.127750919e+00 -2.889139063e+00 -3.135964537e+00 2.92 -2.067243960e+00 -2.829531231e+00 -3.079685444e+00 2.94 -2.007678161e+00 -2.769648603e+00 -3.022454381e+00 2.96 -1.949107969e+00 -2.709578328e+00 -2.964455568e+00 2.98 -1.891571878e+00 -2.649426130e+00 -2.905843178e+00 3.00 -1.835097343e+00 -2.589315707e+00 -2.846748412e+00 3.02 -1.779705286e+00 -2.529384784e+00 -2.787289204e+00 3.04 -1.725413375e+00 -2.469778352e+00 -2.727580195e+00 3.06 -1.672237739e+00 -2.410639965e+00 -2.667741197e+00 3.08 -1.620193272e+00 -2.352102427e+00 -2.607902928e+00 3.10 -1.569292870e+00 -2.294279571e+00 -2.548209086e+00 3.12 -1.519546081e+00 -2.237260639e+00 -2.488814184e+00 3.14 -1.470957573e+00 -2.181108019e+00 -2.429877099e+00 3.16 -1.423525719e+00 -2.125858165e+00 -2.371551152e+00 3.18 -1.377241510e+00 -2.071524808e+00 -2.313972506e+00 3.20 -1.332087892e+00 -2.018103396e+00 -2.257249328e+00 3.22 -1.288039572e+00 -1.965575858e+00 -2.201454132e+00 3.24 -1.245063274e+00 -1.913915160e+00 -2.146620972e+00 3.26 -1.203118397e+00 -1.863089414e+00 -2.092747858e+00 3.28 -1.162158013e+00 -1.813065463e+00 -2.039803562e+00 3.30 -1.122130114e+00 -1.763811923e+00 -1.987737172e+00 3.32 -1.082979024e+00 -1.715301612e+00 -1.936488495e+00 3.34 -1.044646898e+00 -1.667513323e+00 -1.885997718e+00 3.36 -1.007075254e+00 -1.620432841e+00 -1.836213214e+00 3.38 -9.702065402e-01 -1.574053184e+00 -1.787097002e+00 3.40 -9.339857908e-01 -1.528374104e+00 -1.738627775e+00 3.42 -8.983624590e-01 -1.483400931e+00 -1.690801757e+00 3.44 -8.632925551e-01 -1.439142958e+00 -1.643631776e+00 3.46 -8.287411747e-01 -1.395611550e+00 -1.597144978e+00 3.48 -7.946854224e-01 -1.352818199e+00 -1.551379545e+00 3.50 -7.611175832e-01 -1.310772723e+00 -1.506380791e+00 3.52 -7.280481985e-01 -1.269481753e+00 -1.462196972e+00 3.54 -6.955085000e-01 -1.228947632e+00 -1.418875186e+00 3.56 -6.635515072e-01 -1.189167795e+00 -1.376457782e+00 3.58 -6.322510772e-01 -1.150134660e+00 -1.334979621e+00 3.60 -6.016983822e-01 -1.111836056e+00 -1.294466414e+00 3.62 -5.719956907e-01 -1.074256178e+00 -1.254934188e+00 3.64 -5.432479024e-01 -1.037377056e+00 -1.216389694e+00 3.66 -5.155528655e-01 -1.001180491e+00 -1.178831501e+00 3.68 -4.889919204e-01 -9.656503778e-01 -1.142251434e+00 3.70 -4.636221821e-01 -9.307752865e-01 -1.106636096e+00 3.72 -4.394717652e-01 -8.965510828e-01 -1.071968270e+00 3.74 -4.165385495e-01 -8.629833140e-01 -1.038228094e+00 3.76 -3.947923910e-01 -8.300889997e-01 -1.005393965e+00 3.78 -3.741800996e-01 -7.978974475e-01 -9.734431637e-01 3.80 -3.546321696e-01 -7.664497489e-01 -9.423522467e-01 3.82 -3.360701845e-01 -7.357967451e-01 -9.120972248e-01 3.84 -3.184139541e-01 -7.059954670e-01 -8.826535879e-01 3.86 -3.015876811e-01 -6.771043361e-01 -8.539962136e-01 3.88 -2.855247071e-01 -6.491776744e-01 -8.260992033e-01 3.90 -2.701705968e-01 -6.222602566e-01 -7.989356800e-01 3.92 -2.554844912e-01 -5.963826562e-01 -7.724775762e-01 3.94 -2.414387926e-01 -5.715580029e-01 -7.466954332e-01 3.96 -2.280173773e-01 -5.477804883e-01 -7.215582252e-01 3.98 -2.152126535e-01 -5.250256376e-01 -6.970332206e-01 4.00 -2.030219008e-01 -5.032520838e-01 -6.730858868e-01 4.02 -1.914433973e-01 -4.824043973e-01 -6.496798493e-01 4.04 -1.804728472e-01 -4.624164770e-01 -6.267769131e-01 4.06 -1.701005409e-01 -4.432150570e-01 -6.043371632e-01 4.08 -1.603095340e-01 -4.247230051e-01 -5.823191608e-01 4.10 -1.510749421e-01 -4.068622277e-01 -5.606802616e-01 4.12 -1.423642751e-01 -3.895561185e-01 -5.393770837e-01 4.14 -1.341386022e-01 -3.727315786e-01 -5.183661574e-01 4.16 -1.263542771e-01 -3.563206884e-01 -4.976047931e-01 4.18 -1.189649547e-01 -3.402621238e-01 -4.770521940e-01 4.20 -1.119236714e-01 -3.245023969e-01 -4.566708381e-01 4.22 -1.051848349e-01 -3.089969758e-01 -4.364281305e-01 4.24 -9.870603125e-02 -2.937112953e-01 -4.162983028e-01 4.26 -9.244954811e-02 -2.786216409e-01 -3.962644943e-01 4.28 -8.638364978e-02 -2.637158563e-01 -3.763209036e-01 4.30 -8.048414159e-02 -2.489938030e-01 -3.564748382e-01 4.32 -7.473470542e-02 -2.344674962e-01 -3.367484408e-01 4.34 -6.912735354e-02 -2.201608278e-01 -3.171798244e-01 4.36 -6.366250556e-02 -2.061087967e-01 -2.978233402e-01 4.38 -5.834855934e-02 -1.923561718e-01 -2.787487294e-01 4.40 -5.320091240e-02 -1.789555429e-01 -2.600389991e-01 4.42 -4.824043999e-02 -1.659647658e-01 -2.417869978e-01 4.44 -4.349150694e-02 -1.534438847e-01 -2.240908477e-01 4.46 -3.897967333e-02 -1.414517079e-01 -2.070485730e-01 4.48 -3.472932167e-02 -1.300423024e-01 -1.907524200e-01 4.50 -3.076146221e-02 -1.192617238e-01 -1.752834470e-01 4.52 -2.709196049e-02 -1.091453039e-01 -1.607069458e-01 4.54 -2.373036283e-02 -9.971575877e-02 -1.470691488e-01 4.56 -2.067939352e-02 -9.098226998e-02 -1.343954831e-01 4.58 -1.793498382e-02 -8.294056503e-02 -1.226904224e-01 4.60 -1.548672266e-02 -7.557389262e-02 -1.119387786e-01 4.62 -1.332004672e-02 -6.885469740e-02 -1.021081250e-01 4.64 -1.141659940e-02 -6.274674713e-02 -9.315196726e-02 4.66 -9.755417391e-03 -5.720746118e-02 -8.501326882e-02 4.68 -8.314159382e-03 -5.219022769e-02 -7.762798857e-02 4.70 -7.070149356e-03 -4.764653984e-02 -7.092836982e-02 4.72 -6.001199375e-03 -4.352760293e-02 -6.484581586e-02 4.74 -5.086210184e-03 -3.978627180e-02 -5.931327090e-02 4.76 -4.305569958e-03 -3.637844166e-02 -5.426705682e-02 4.78 -3.641383202e-03 -3.326338853e-02 -4.964816741e-02 4.80 -3.077565803e-03 -3.040442583e-02 -4.540367536e-02 4.82 -2.599840868e-03 -2.776930845e-02 -4.148699545e-02 4.84 -2.195665756e-03 -2.533041503e-02 -3.785815304e-02 4.86 -1.854115241e-03 -2.306474606e-02 -3.448383789e-02 4.88 -1.565740177e-03 -2.095375849e-02 -3.133720459e-02 4.90 -1.322415913e-03 -1.898305347e-02 -2.839744515e-02 4.92 -1.117190421e-03 -1.714193115e-02 -2.564915441e-02 4.94 -9.441387363e-04 -1.542283055e-02 -2.308151700e-02 4.96 -7.982276739e-04 -1.382066748e-02 -2.068735725e-02 4.98 -6.751929141e-04 -1.233195808e-02 -1.846197156e-02 5.00 -5.714292275e-04 -1.095455791e-02 -1.640211344e-02 5.02 -4.838937411e-04 -9.686835628e-03 -1.450560648e-02 5.04 -4.100215822e-04 -8.527011471e-03 -1.277001608e-02 5.06 -3.476529280e-04 -7.472738761e-03 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-4.446594679e-04 -6.661502793e-04 5.44 -1.735206753e-05 -3.770774919e-04 -5.649008643e-04 5.46 -1.492738583e-05 -3.198569946e-04 -4.791750367e-04 5.48 -1.285038699e-05 -2.714168896e-04 -4.066040394e-04 5.50 -1.106994792e-05 -2.304105163e-04 -3.451703023e-04 5.52 -9.542646529e-06 -1.956935076e-04 -2.931593155e-04 5.54 -8.231574785e-06 -1.662951975e-04 -2.491167603e-04 5.56 -7.105338596e-06 -1.413934614e-04 -2.118109924e-04 5.58 -6.137214642e-06 -1.202927787e-04 -1.801999112e-04 5.60 -5.304438978e-06 -1.024052417e-04 -1.534026934e-04 5.62 -4.587606411e-06 -8.723421326e-05 -1.306752621e-04 5.64 -3.970163064e-06 -7.436033107e-05 -1.113893175e-04 5.66 -3.437977347e-06 -6.342956852e-05 -9.501444984e-05 5.68 -2.978976970e-06 -5.414308172e-05 -8.110292749e-05 5.70 -2.582841597e-06 -4.624859796e-05 -6.927679448e-05 5.72 -2.240742455e-06 -3.953312624e-05 -5.921694897e-05 5.74 -1.945121537e-06 -3.381679694e-05 -5.065391334e-05 5.76 -1.689504256e-06 -2.894766232e-05 -4.336004374e-05 5.78 -1.468340368e-06 -2.479731202e-05 -3.714296095e-05 5.80 -1.276868809e-06 -2.125717861e-05 -3.184001497e-05 5.82 -1.111002754e-06 -1.823542589e-05 -2.731362288e-05 5.84 -9.672318172e-07 -1.565432894e-05 -2.344734332e-05 5.86 -8.425387755e-07 -1.344806836e-05 -2.014257184e-05 5.88 -7.343286032e-07 -1.156087344e-05 -1.731575870e-05 5.90 -6.403679630e-07 -9.945458684e-06 -1.489606651e-05 5.92 -5.587335745e-07 -8.561707240e-06 -1.282339764e-05 5.94 -4.877681278e-07 -7.375561809e-06 -1.104673255e-05 5.96 -4.260426129e-07 -6.358090102e-06 -9.522729659e-06 5.98 -3.723241124e-07 -5.484696989e-06 -8.214544943e-06 6.00 -3.255482444e-07 -4.734460039e-06 -7.090836475e-06