# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1985--Foiles-S-M--Ni-Cu # implementation = 1985--Foiles-S-M--Ni-Cu--LAMMPS--ipr1 # composition = Cu3Ni # 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 nan nan nan 0.80 3.897356742e+02 nan nan 0.82 3.639466185e+02 nan nan 0.84 3.402297228e+02 nan nan 0.86 3.182338360e+02 nan nan 0.88 2.976789934e+02 nan nan 0.90 2.783650816e+02 3.589124206e+02 nan 0.92 2.601530738e+02 3.376276111e+02 3.647621905e+02 0.94 2.429240581e+02 3.176939002e+02 3.437462347e+02 0.96 2.266033309e+02 2.989076499e+02 3.240675038e+02 0.98 2.111345962e+02 2.811364962e+02 3.055282162e+02 1.00 1.964683518e+02 2.642663328e+02 2.879863841e+02 1.02 1.825757370e+02 2.482184823e+02 2.713277028e+02 1.04 1.694266878e+02 2.329374358e+02 2.554703512e+02 1.06 1.570016632e+02 2.183704543e+02 2.403474669e+02 1.08 1.452744279e+02 2.044937591e+02 2.259134460e+02 1.10 1.342216935e+02 1.912770502e+02 2.121290859e+02 1.12 1.238231249e+02 1.786975242e+02 1.989680485e+02 1.14 1.140587327e+02 1.667302710e+02 1.864104896e+02 1.16 1.049088822e+02 1.553668054e+02 1.744337073e+02 1.18 9.634974419e+01 1.445920111e+02 1.630290706e+02 1.20 8.835537173e+01 1.343914490e+02 1.521848045e+02 1.22 8.090011046e+01 1.247444770e+02 1.418827694e+02 1.24 7.396182342e+01 1.156424857e+02 1.321157621e+02 1.26 6.751400083e+01 1.070673258e+02 1.228667337e+02 1.28 6.152817367e+01 9.900040510e+01 1.141242442e+02 1.30 5.598339184e+01 9.142262822e+01 1.058672681e+02 1.32 5.085494267e+01 8.431172478e+01 9.808683097e+01 1.34 4.611626540e+01 7.765080586e+01 9.076433311e+01 1.36 4.174253946e+01 7.142193765e+01 8.388223424e+01 1.38 3.770932678e+01 6.560334902e+01 7.742121079e+01 1.40 3.399725916e+01 6.017608274e+01 7.135997924e+01 1.42 3.058548001e+01 5.511903063e+01 6.568830920e+01 1.44 2.745204776e+01 5.041176062e+01 6.038671779e+01 1.46 2.457609669e+01 4.603281807e+01 5.543669663e+01 1.48 2.193886084e+01 4.196580780e+01 5.082172336e+01 1.50 1.952416123e+01 3.819527641e+01 4.652308637e+01 1.52 1.731698931e+01 3.470327571e+01 4.252262563e+01 1.54 1.528538038e+01 3.147175387e+01 3.880395158e+01 1.56 1.344365722e+01 2.848509455e+01 3.535224429e+01 1.58 1.176096988e+01 2.572732184e+01 3.214963864e+01 1.60 1.022496537e+01 2.318321202e+01 2.918214658e+01 1.62 8.823259181e+00 2.083705737e+01 2.643420919e+01 1.64 7.528207644e+00 1.867660420e+01 2.389325415e+01 1.66 6.356445497e+00 1.668703150e+01 2.154364721e+01 1.68 5.302073651e+00 1.484039343e+01 1.937300269e+01 1.70 4.345718877e+00 1.315645899e+01 1.737129375e+01 1.72 3.478877588e+00 1.160650204e+01 1.552665364e+01 1.74 2.694849760e+00 1.018260104e+01 1.381201215e+01 1.76 1.986202496e+00 8.874711292e+00 1.224624841e+01 1.78 1.346685424e+00 7.665134329e+00 1.080378504e+01 1.80 7.698509544e-01 6.547120618e+00 9.476463927e+00 1.82 2.504915449e-01 5.542832970e+00 8.255758211e+00 1.84 -2.158445002e-01 4.625081948e+00 7.103867213e+00 1.86 -6.342845780e-01 3.787329979e+00 6.075455408e+00 1.88 -1.007381715e+00 3.022723491e+00 5.130677163e+00 1.90 -1.339478674e+00 2.326521187e+00 4.263302934e+00 1.92 -1.634206496e+00 1.692549484e+00 3.470284950e+00 1.94 -1.894898648e+00 1.114639869e+00 2.746077090e+00 1.96 -2.124574152e+00 5.907436975e-01 2.085495383e+00 1.98 -2.329937696e+00 1.150841099e-01 1.483311920e+00 2.00 -2.516642315e+00 -3.153680571e-01 9.354948904e-01 2.02 -2.685662739e+00 -7.034761210e-01 4.377552308e-01 2.04 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-8.190344132e-01 -9.847665061e-01 3.82 -4.109462341e-01 -7.893569210e-01 -9.519822135e-01 3.84 -3.902021969e-01 -7.604467301e-01 -9.199742210e-01 3.86 -3.694900405e-01 -7.322556308e-01 -8.887384692e-01 3.88 -3.488198140e-01 -7.047148352e-01 -8.582522336e-01 3.90 -3.281490020e-01 -6.777814832e-01 -8.284900014e-01 3.92 -3.074778285e-01 -6.515330111e-01 -7.994541976e-01 3.94 -2.870274130e-01 -6.260452611e-01 -7.711486967e-01 3.96 -2.669773597e-01 -6.013736086e-01 -7.435750247e-01 3.98 -2.474628594e-01 -5.775563917e-01 -7.166494205e-01 4.00 -2.285829051e-01 -5.546618757e-01 -6.902642902e-01 4.02 -2.104071449e-01 -5.327718384e-01 -6.645034389e-01 4.04 -1.939363872e-01 -5.117555897e-01 -6.394437508e-01 4.06 -1.789540102e-01 -4.913302785e-01 -6.151426073e-01 4.08 -1.658117827e-01 -4.712835109e-01 -5.916410385e-01 4.10 -1.533056798e-01 -4.514638431e-01 -5.689664241e-01 4.12 -1.414240877e-01 -4.317684256e-01 -5.472028190e-01 4.14 -1.301514407e-01 -4.121329570e-01 -5.264352979e-01 4.16 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