# 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 = CoCu2Ni # 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 L2_1--AlCu2Mn--h L2_1--AlCu2Mn--h 0.50 nan nan 0.52 nan nan 0.54 nan nan 0.56 nan nan 0.58 nan nan 0.60 nan nan 0.62 nan nan 0.64 nan nan 0.66 nan nan 0.68 nan nan 0.70 nan nan 0.72 nan nan 0.74 nan nan 0.76 nan nan 0.78 nan nan 0.80 nan nan 0.82 nan nan 0.84 nan nan 0.86 nan nan 0.88 nan nan 0.90 nan nan 0.92 nan nan 0.94 nan nan 0.96 nan nan 0.98 nan nan 1.00 nan nan 1.02 nan nan 1.04 nan nan 1.06 nan nan 1.08 nan nan 1.10 nan nan 1.12 nan nan 1.14 nan nan 1.16 nan nan 1.18 nan nan 1.20 nan nan 1.22 nan nan 1.24 nan nan 1.26 nan nan 1.28 1.049010089e+02 1.049010089e+02 1.30 9.605982900e+01 9.605982900e+01 1.32 8.793159107e+01 8.793159107e+01 1.34 8.045229377e+01 8.045229377e+01 1.36 7.356614643e+01 7.356614643e+01 1.38 6.722515121e+01 6.722515121e+01 1.40 6.138712727e+01 6.138712727e+01 1.42 5.601388168e+01 5.601388168e+01 1.44 5.106979875e+01 5.106979875e+01 1.46 4.652085781e+01 4.652085781e+01 1.48 4.233438574e+01 4.233438574e+01 1.50 3.847954053e+01 3.847954053e+01 1.52 3.492804201e+01 3.492804201e+01 1.54 3.165456727e+01 3.165456727e+01 1.56 2.863677991e+01 2.863677991e+01 1.58 2.585511022e+01 2.585511022e+01 1.60 2.329098993e+01 2.329098993e+01 1.62 2.092783177e+01 2.092783177e+01 1.64 1.875104602e+01 1.875104602e+01 1.66 1.674768716e+01 1.674768716e+01 1.68 1.490591689e+01 1.490591689e+01 1.70 1.321446821e+01 1.321446821e+01 1.72 1.166224752e+01 1.166224752e+01 1.74 1.023816222e+01 1.023816222e+01 1.76 8.931249831e+00 8.931249831e+00 1.78 7.731066186e+00 7.731066186e+00 1.80 6.628138530e+00 6.628138530e+00 1.82 5.614256179e+00 5.614256179e+00 1.84 4.682474443e+00 4.682474443e+00 1.86 3.826866076e+00 3.826866076e+00 1.88 3.042164575e+00 3.042164575e+00 1.90 2.323451051e+00 2.323451051e+00 1.92 1.665973379e+00 1.665973379e+00 1.94 1.065113838e+00 1.065113838e+00 1.96 5.164659167e-01 5.164659167e-01 1.98 1.594894732e-02 1.594894732e-02 2.00 -4.401085713e-01 -4.401085713e-01 2.02 -8.549535583e-01 -8.549535583e-01 2.04 -1.231458629e+00 -1.231458629e+00 2.06 -1.572208975e+00 -1.572208975e+00 2.08 -1.879589136e+00 -1.879589136e+00 2.10 -2.155844818e+00 -2.155844818e+00 2.12 -2.403115185e+00 -2.403115185e+00 2.14 -2.623445203e+00 -2.623445203e+00 2.16 -2.818790691e+00 -2.818790691e+00 2.18 -2.991024710e+00 -2.991024710e+00 2.20 -3.141948236e+00 -3.141948236e+00 2.22 -3.273303578e+00 -3.273303578e+00 2.24 -3.386787275e+00 -3.386787275e+00 2.26 -3.484060664e+00 -3.484060664e+00 2.28 -3.566757839e+00 -3.566757839e+00 2.30 -3.636487869e+00 -3.636487869e+00 2.32 -3.694846686e+00 -3.694846686e+00 2.34 -3.743356738e+00 -3.743356738e+00 2.36 -3.783311183e+00 -3.783311183e+00 2.38 -3.815821622e+00 -3.815821622e+00 2.40 -3.841777148e+00 -3.841777148e+00 2.42 -3.861839016e+00 -3.861839016e+00 2.44 -3.876475617e+00 -3.876475617e+00 2.46 -3.886008506e+00 -3.886008506e+00 2.48 -3.890641434e+00 -3.890641434e+00 2.50 -3.890750712e+00 -3.890750712e+00 2.52 -3.885924709e+00 -3.885924709e+00 2.54 -3.875819823e+00 -3.875819823e+00 2.56 -3.860255359e+00 -3.860255359e+00 2.58 -3.839186159e+00 -3.839186159e+00 2.60 -3.812678997e+00 -3.812678997e+00 2.62 -3.780891838e+00 -3.780891838e+00 2.64 -3.744078512e+00 -3.744078512e+00 2.66 -3.702609861e+00 -3.702609861e+00 2.68 -3.656909234e+00 -3.656909234e+00 2.70 -3.607439606e+00 -3.607439606e+00 2.72 -3.554699510e+00 -3.554699510e+00 2.74 -3.499209357e+00 -3.499209357e+00 2.76 -3.441487126e+00 -3.441487126e+00 2.78 -3.382018089e+00 -3.382018089e+00 2.80 -3.321226781e+00 -3.321226781e+00 2.82 -3.259459010e+00 -3.259459010e+00 2.84 -3.196977798e+00 -3.196977798e+00 2.86 -3.133972255e+00 -3.133972255e+00 2.88 -3.070574865e+00 -3.070574865e+00 2.90 -3.006881686e+00 -3.006881686e+00 2.92 -2.942971083e+00 -2.942971083e+00 2.94 -2.878918485e+00 -2.878918485e+00 2.96 -2.814806417e+00 -2.814806417e+00 2.98 -2.750730008e+00 -2.750730008e+00 3.00 -2.686798507e+00 -2.686798507e+00 3.02 -2.623133302e+00 -2.623133302e+00 3.04 -2.559862940e+00 -2.559862940e+00 3.06 -2.497115972e+00 -2.497115972e+00 3.08 -2.435012926e+00 -2.435012926e+00 3.10 -2.373659068e+00 -2.373659068e+00 3.12 -2.313139430e+00 -2.313139430e+00 3.14 -2.253516849e+00 -2.253516849e+00 3.16 -2.194832846e+00 -2.194832846e+00 3.18 -2.137110491e+00 -2.137110491e+00 3.20 -2.080358217e+00 -2.080358217e+00 3.22 -2.024573739e+00 -2.024573739e+00 3.24 -1.969747615e+00 -1.969747615e+00 3.26 -1.915866251e+00 -1.915866251e+00 3.28 -1.862914369e+00 -1.862914369e+00 3.30 -1.810876951e+00 -1.810876951e+00 3.32 -1.759740713e+00 -1.759740713e+00 3.34 -1.709495073e+00 -1.709495073e+00 3.36 -1.660132628e+00 -1.660132628e+00 3.38 -1.611649113e+00 -1.611649113e+00 3.40 -1.564042905e+00 -1.564042905e+00 3.42 -1.517314147e+00 -1.517314147e+00 3.44 -1.471463618e+00 -1.471463618e+00 3.46 -1.426491502e+00 -1.426491502e+00 3.48 -1.382396209e+00 -1.382396209e+00 3.50 -1.339173356e+00 -1.339173356e+00 3.52 -1.296815027e+00 -1.296815027e+00 3.54 -1.255309352e+00 -1.255309352e+00 3.56 -1.214640437e+00 -1.214640437e+00 3.58 -1.174788651e+00 -1.174788651e+00 3.60 -1.135731260e+00 -1.135731260e+00 3.62 -1.097443392e+00 -1.097443392e+00 3.64 -1.059899343e+00 -1.059899343e+00 3.66 -1.023074195e+00 -1.023074195e+00 3.68 -9.869457313e-01 -9.869457313e-01 3.70 -9.514965740e-01 -9.514965740e-01 3.72 -9.167164193e-01 -9.167164193e-01 3.74 -8.826041730e-01 -8.826041730e-01 3.76 -8.491697020e-01 -8.491697020e-01 3.78 -8.164348721e-01 -8.164348721e-01 3.80 -7.844335317e-01 -7.844335317e-01 3.82 -7.532101752e-01 -7.532101752e-01 3.84 -7.228171766e-01 -7.228171766e-01 3.86 -6.933107147e-01 -6.933107147e-01 3.88 -6.647457689e-01 -6.647457689e-01 3.90 -6.371707815e-01 -6.371707815e-01 3.92 -6.106226921e-01 -6.106226921e-01 3.94 -5.851230085e-01 -5.851230085e-01 3.96 -5.606753923e-01 -5.606753923e-01 3.98 -5.372649593e-01 -5.372649593e-01 4.00 -5.148591999e-01 -5.148591999e-01 4.02 -4.934101929e-01 -4.934101929e-01 4.04 -4.728576577e-01 -4.728576577e-01 4.06 -4.531323819e-01 -4.531323819e-01 4.08 -4.341596317e-01 -4.341596317e-01 4.10 -4.158622819e-01 -4.158622819e-01 4.12 -3.981635284e-01 -3.981635284e-01 4.14 -3.809891548e-01 -3.809891548e-01 4.16 -3.642693992e-01 -3.642693992e-01 4.18 -3.479404961e-01 -3.479404961e-01 4.20 -3.319459774e-01 -3.319459774e-01 4.22 -3.162377915e-01 -3.162377915e-01 4.24 -3.007772734e-01 -3.007772734e-01 4.26 -2.855359699e-01 -2.855359699e-01 4.28 -2.704962979e-01 -2.704962979e-01 4.30 -2.556519980e-01 -2.556519980e-01 4.32 -2.410083380e-01 -2.410083380e-01 4.34 -2.265820093e-01 -2.265820093e-01 4.36 -2.124006507e-01 -2.124006507e-01 4.38 -1.985019258e-01 -1.985019258e-01 4.40 -1.849320806e-01 -1.849320806e-01 4.42 -1.717439330e-01 -1.717439330e-01 4.44 -1.589943005e-01 -1.589943005e-01 4.46 -1.467409565e-01 -1.467409565e-01 4.48 -1.350393040e-01 -1.350393040e-01 4.50 -1.239390388e-01 -1.239390388e-01 4.52 -1.134811179e-01 -1.134811179e-01 4.54 -1.036953393e-01 -1.036953393e-01 4.56 -9.459876651e-02 -9.459876651e-02 4.58 -8.619511929e-02 -8.619511929e-02 4.60 -7.847512340e-02 -7.847512340e-02 4.62 -7.141769470e-02 -7.141769470e-02 4.64 -6.499175025e-02 -6.499175025e-02 4.66 -5.915839978e-02 -5.915839978e-02 4.68 -5.387328309e-02 -5.387328309e-02 4.70 -4.908884413e-02 -4.908884413e-02 4.72 -4.475612605e-02 -4.475612605e-02 4.74 -4.082697622e-02 -4.082697622e-02 4.76 -3.725573365e-02 -3.725573365e-02 4.78 -3.399971248e-02 -3.399971248e-02 4.80 -3.102004915e-02 -3.102004915e-02 4.82 -2.828225666e-02 -2.828225666e-02 4.84 -2.575651664e-02 -2.575651664e-02 4.86 -2.341775141e-02 -2.341775141e-02 4.88 -2.124550428e-02 -2.124550428e-02 4.90 -1.922365062e-02 -1.922365062e-02 4.92 -1.733995983e-02 -1.733995983e-02 4.94 -1.558553138e-02 -1.558553138e-02 4.96 -1.395412620e-02 -1.395412620e-02 4.98 -1.244126680e-02 -1.244126680e-02 5.00 -1.104394843e-02 -1.104394843e-02 5.02 -9.759827810e-03 -9.759827810e-03 5.04 -8.586525003e-03 -8.586525003e-03 5.06 -7.521189779e-03 -7.521189779e-03 5.08 -6.560223089e-03 -6.560223089e-03 5.10 -5.699153070e-03 -5.699153070e-03 5.12 -4.932647129e-03 -4.932647129e-03 5.14 -4.254629175e-03 -4.254629175e-03 5.16 -3.658465365e-03 -3.658465365e-03 5.18 -3.137182490e-03 -3.137182490e-03 5.20 -2.683688595e-03 -2.683688595e-03 5.22 -2.290973565e-03 -2.290973565e-03 5.24 -1.952275935e-03 -1.952275935e-03 5.26 -1.661209887e-03 -1.661209887e-03 5.28 -1.411852252e-03 -1.411852252e-03 5.30 -1.198793238e-03 -1.198793238e-03 5.32 -1.017156781e-03 -1.017156781e-03 5.34 -8.625971543e-04 -8.625971543e-04 5.36 -7.312782677e-04 -7.312782677e-04 5.38 -6.198413723e-04 -6.198413723e-04 5.40 -5.253658635e-04 -5.253658635e-04 5.42 -4.453268434e-04 -4.453268434e-04 5.44 -3.775521320e-04 -3.775521320e-04 5.46 -3.201805956e-04 -3.201805956e-04 5.48 -2.716229930e-04 -2.716229930e-04 5.50 -2.305260331e-04 -2.305260331e-04 5.52 -1.957399640e-04 -1.957399640e-04 5.54 -1.662897517e-04 -1.662897517e-04 5.56 -1.413497347e-04 -1.413497347e-04 5.58 -1.202215320e-04 -1.202215320e-04 5.60 -1.023149279e-04 -1.023149279e-04 5.62 -8.713142656e-05 -8.713142656e-05 5.64 -7.425017280e-05 -7.425017280e-05 5.66 -6.331594420e-05 -6.331594420e-05 5.68 -5.402894229e-05 -5.402894229e-05 5.70 -4.613613526e-05 -4.613613526e-05 5.72 -3.942393124e-05 -3.942393124e-05 5.74 -3.371198754e-05 -3.371198754e-05 5.76 -2.884798637e-05 -2.884798637e-05 5.78 -2.470323018e-05 -2.470323018e-05 5.80 -2.116893078e-05 -2.116893078e-05 5.82 -1.815308434e-05 -1.815308434e-05 5.84 -1.557784061e-05 -1.557784061e-05 5.86 -1.337728847e-05 -1.337728847e-05 5.88 -1.149559192e-05 -1.149559192e-05 5.90 -9.885420954e-06 -9.885420954e-06 5.92 -8.506630375e-06 -8.506630375e-06 5.94 -7.325147021e-06 -7.325147021e-06 5.96 -6.312032246e-06 -6.312032246e-06 5.98 -5.442691726e-06 -5.442691726e-06 6.00 -4.696209110e-06 -4.696209110e-06