# 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 = CoNi2Pt # 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 1.729583603e+02 1.729583603e+02 1.30 1.595108478e+02 1.595108478e+02 1.32 1.470347932e+02 1.470347932e+02 1.34 1.354643203e+02 1.354643203e+02 1.36 1.247404433e+02 1.247404433e+02 1.38 1.148031254e+02 1.148031254e+02 1.40 1.055891234e+02 1.055891234e+02 1.42 9.703526286e+01 9.703526286e+01 1.44 8.908312812e+01 8.908312812e+01 1.46 8.168228243e+01 8.168228243e+01 1.48 7.479116386e+01 7.479116386e+01 1.50 6.837577495e+01 6.837577495e+01 1.52 6.240661368e+01 6.240661368e+01 1.54 5.685514835e+01 5.685514835e+01 1.56 5.169174543e+01 5.169174543e+01 1.58 4.688571681e+01 4.688571681e+01 1.60 4.240654704e+01 4.240654704e+01 1.62 3.822525025e+01 3.822525025e+01 1.64 3.431547287e+01 3.431547287e+01 1.66 3.066451968e+01 3.066451968e+01 1.68 2.730980053e+01 2.730980053e+01 1.70 2.423763983e+01 2.423763983e+01 1.72 2.142782146e+01 2.142782146e+01 1.74 1.886215505e+01 1.886215505e+01 1.76 1.652316433e+01 1.652316433e+01 1.78 1.439355290e+01 1.439355290e+01 1.80 1.245638702e+01 1.245638702e+01 1.82 1.069551457e+01 1.069551457e+01 1.84 9.095839263e+00 9.095839263e+00 1.86 7.643377646e+00 7.643377646e+00 1.88 6.325182801e+00 6.325182801e+00 1.90 5.129231603e+00 5.129231603e+00 1.92 4.044344554e+00 4.044344554e+00 1.94 3.060169689e+00 3.060169689e+00 1.96 2.167229998e+00 2.167229998e+00 1.98 1.357007030e+00 1.357007030e+00 2.00 6.220036229e-01 6.220036229e-01 2.02 -4.427580285e-02 -4.427580285e-02 2.04 -6.474453032e-01 -6.474453032e-01 2.06 -1.192419180e+00 -1.192419180e+00 2.08 -1.683596256e+00 -1.683596256e+00 2.10 -2.125005802e+00 -2.125005802e+00 2.12 -2.520402181e+00 -2.520402181e+00 2.14 -2.873312543e+00 -2.873312543e+00 2.16 -3.187049850e+00 -3.187049850e+00 2.18 -3.464707848e+00 -3.464707848e+00 2.20 -3.709154761e+00 -3.709154761e+00 2.22 -3.923036045e+00 -3.923036045e+00 2.24 -4.108787400e+00 -4.108787400e+00 2.26 -4.268654781e+00 -4.268654781e+00 2.28 -4.404720162e+00 -4.404720162e+00 2.30 -4.518934031e+00 -4.518934031e+00 2.32 -4.613151546e+00 -4.613151546e+00 2.34 -4.689953654e+00 -4.689953654e+00 2.36 -4.752078521e+00 -4.752078521e+00 2.38 -4.800625294e+00 -4.800625294e+00 2.40 -4.836652619e+00 -4.836652619e+00 2.42 -4.861175055e+00 -4.861175055e+00 2.44 -4.875150980e+00 -4.875150980e+00 2.46 -4.879490406e+00 -4.879490406e+00 2.48 -4.875089468e+00 -4.875089468e+00 2.50 -4.862853447e+00 -4.862853447e+00 2.52 -4.843605416e+00 -4.843605416e+00 2.54 -4.818170392e+00 -4.818170392e+00 2.56 -4.787357815e+00 -4.787357815e+00 2.58 -4.751922791e+00 -4.751922791e+00 2.60 -4.712528803e+00 -4.712528803e+00 2.62 -4.669723364e+00 -4.669723364e+00 2.64 -4.623923665e+00 -4.623923665e+00 2.66 -4.575233177e+00 -4.575233177e+00 2.68 -4.523542849e+00 -4.523542849e+00 2.70 -4.468793229e+00 -4.468793229e+00 2.72 -4.410990431e+00 -4.410990431e+00 2.74 -4.350204807e+00 -4.350204807e+00 2.76 -4.286560674e+00 -4.286560674e+00 2.78 -4.220218651e+00 -4.220218651e+00 2.80 -4.151355437e+00 -4.151355437e+00 2.82 -4.080147158e+00 -4.080147158e+00 2.84 -4.006761367e+00 -4.006761367e+00 2.86 -3.931359656e+00 -3.931359656e+00 2.88 -3.854109503e+00 -3.854109503e+00 2.90 -3.775201331e+00 -3.775201331e+00 2.92 -3.694865497e+00 -3.694865497e+00 2.94 -3.613383856e+00 -3.613383856e+00 2.96 -3.531091533e+00 -3.531091533e+00 2.98 -3.448366675e+00 -3.448366675e+00 3.00 -3.365608991e+00 -3.365608991e+00 3.02 -3.283211097e+00 -3.283211097e+00 3.04 -3.201528912e+00 -3.201528912e+00 3.06 -3.120880400e+00 -3.120880400e+00 3.08 -3.041610399e+00 -3.041610399e+00 3.10 -2.963973364e+00 -2.963973364e+00 3.12 -2.888106890e+00 -2.888106890e+00 3.14 -2.814058945e+00 -2.814058945e+00 3.16 -2.741815804e+00 -2.741815804e+00 3.18 -2.671326688e+00 -2.671326688e+00 3.20 -2.602523027e+00 -2.602523027e+00 3.22 -2.535331952e+00 -2.535331952e+00 3.24 -2.469684676e+00 -2.469684676e+00 3.26 -2.405520878e+00 -2.405520878e+00 3.28 -2.342790246e+00 -2.342790246e+00 3.30 -2.281452170e+00 -2.281452170e+00 3.32 -2.221474332e+00 -2.221474332e+00 3.34 -2.162830707e+00 -2.162830707e+00 3.36 -2.105499357e+00 -2.105499357e+00 3.38 -2.049460264e+00 -2.049460264e+00 3.40 -1.994693366e+00 -1.994693366e+00 3.42 -1.941176933e+00 -1.941176933e+00 3.44 -1.888886347e+00 -1.888886347e+00 3.46 -1.837793338e+00 -1.837793338e+00 3.48 -1.787865686e+00 -1.787865686e+00 3.50 -1.739067356e+00 -1.739067356e+00 3.52 -1.691359006e+00 -1.691359006e+00 3.54 -1.644698786e+00 -1.644698786e+00 3.56 -1.599043303e+00 -1.599043303e+00 3.58 -1.554348643e+00 -1.554348643e+00 3.60 -1.510571343e+00 -1.510571343e+00 3.62 -1.467669250e+00 -1.467669250e+00 3.64 -1.425602255e+00 -1.425602255e+00 3.66 -1.384332918e+00 -1.384332918e+00 3.68 -1.343827067e+00 -1.343827067e+00 3.70 -1.304054447e+00 -1.304054447e+00 3.72 -1.264989492e+00 -1.264989492e+00 3.74 -1.226612220e+00 -1.226612220e+00 3.76 -1.188909222e+00 -1.188909222e+00 3.78 -1.151874582e+00 -1.151874582e+00 3.80 -1.115510521e+00 -1.115510521e+00 3.82 -1.079827511e+00 -1.079827511e+00 3.84 -1.044843597e+00 -1.044843597e+00 3.86 -1.010582788e+00 -1.010582788e+00 3.88 -9.770725056e-01 -9.770725056e-01 3.90 -9.443403139e-01 -9.443403139e-01 3.92 -9.124103327e-01 -9.124103327e-01 3.94 -8.812998793e-01 -8.812998793e-01 3.96 -8.510168645e-01 -8.510168645e-01 3.98 -8.215583870e-01 -8.215583870e-01 4.00 -7.929107114e-01 -7.929107114e-01 4.02 -7.650505927e-01 -7.650505927e-01 4.04 -7.379476874e-01 -7.379476874e-01 4.06 -7.115676557e-01 -7.115676557e-01 4.08 -6.858755099e-01 -6.858755099e-01 4.10 -6.608387789e-01 -6.608387789e-01 4.12 -6.364301546e-01 -6.364301546e-01 4.14 -6.126293016e-01 -6.126293016e-01 4.16 -5.894237376e-01 -5.894237376e-01 4.18 -5.668086813e-01 -5.668086813e-01 4.20 -5.447859587e-01 -5.447859587e-01 4.22 -5.233621475e-01 -5.233621475e-01 4.24 -5.025462455e-01 -5.025462455e-01 4.26 -4.823472096e-01 -4.823472096e-01 4.28 -4.627717184e-01 -4.627717184e-01 4.30 -4.438224604e-01 -4.438224604e-01 4.32 -4.254971378e-01 -4.254971378e-01 4.34 -4.077882454e-01 -4.077882454e-01 4.36 -3.906835394e-01 -3.906835394e-01 4.38 -3.741670044e-01 -3.741670044e-01 4.40 -3.582200575e-01 -3.582200575e-01 4.42 -3.428227200e-01 -3.428227200e-01 4.44 -3.279545277e-01 -3.279545277e-01 4.46 -3.135950317e-01 -3.135950317e-01 4.48 -2.997238460e-01 -2.997238460e-01 4.50 -2.863202996e-01 -2.863202996e-01 4.52 -2.733628366e-01 -2.733628366e-01 4.54 -2.608283557e-01 -2.608283557e-01 4.56 -2.486916890e-01 -2.486916890e-01 4.58 -2.369253858e-01 -2.369253858e-01 4.60 -2.254999096e-01 -2.254999096e-01 4.62 -2.143842804e-01 -2.143842804e-01 4.64 -2.035471260e-01 -2.035471260e-01 4.66 -1.929580530e-01 -1.929580530e-01 4.68 -1.825892243e-01 -1.825892243e-01 4.70 -1.724169529e-01 -1.724169529e-01 4.72 -1.624232161e-01 -1.624232161e-01 4.74 -1.525975330e-01 -1.525975330e-01 4.76 -1.429365762e-01 -1.429365762e-01 4.78 -1.334448993e-01 -1.334448993e-01 4.80 -1.241357857e-01 -1.241357857e-01 4.82 -1.150303523e-01 -1.150303523e-01 4.84 -1.061563561e-01 -1.061563561e-01 4.86 -9.754656246e-02 -9.754656246e-02 4.88 -8.923677102e-02 -8.923677102e-02 4.90 -8.126364058e-02 -8.126364058e-02 4.92 -7.366248140e-02 -7.366248140e-02 4.94 -6.646518463e-02 -6.646518463e-02 4.96 -5.969844414e-02 -5.969844414e-02 4.98 -5.338239096e-02 -5.338239096e-02 5.00 -4.752971531e-02 -4.752971531e-02 5.02 -4.214530072e-02 -4.214530072e-02 5.04 -3.722634657e-02 -3.722634657e-02 5.06 -3.276291526e-02 -3.276291526e-02 5.08 -2.873881114e-02 -2.873881114e-02 5.10 -2.513268344e-02 -2.513268344e-02 5.12 -2.191924129e-02 -2.191924129e-02 5.14 -1.907048047e-02 -1.907048047e-02 5.16 -1.655684311e-02 -1.655684311e-02 5.18 -1.434824488e-02 -1.434824488e-02 5.20 -1.241472979e-02 -1.241472979e-02 5.22 -1.072734092e-02 -1.072734092e-02 5.24 -9.259191460e-03 -9.259191460e-03 5.26 -7.985091351e-03 -7.985091351e-03 5.28 -6.881793207e-03 -6.881793207e-03 5.30 -5.928124117e-03 -5.928124117e-03 5.32 -5.105010105e-03 -5.105010105e-03 5.34 -4.395423398e-03 -4.395423398e-03 5.36 -3.784277524e-03 -3.784277524e-03 5.38 -3.258290108e-03 -3.258290108e-03 5.40 -2.805828516e-03 -2.805828516e-03 5.42 -2.416749499e-03 -2.416749499e-03 5.44 -2.082240598e-03 -2.082240598e-03 5.46 -1.794668517e-03 -1.794668517e-03 5.48 -1.547437644e-03 -1.547437644e-03 5.50 -1.334860429e-03 -1.334860429e-03 5.52 -1.152040313e-03 -1.152040313e-03 5.54 -9.947671477e-04 -9.947671477e-04 5.56 -8.594246026e-04 -8.594246026e-04 5.58 -7.429087748e-04 -7.429087748e-04 5.60 -6.425570480e-04 -6.425570480e-04 5.62 -5.560862101e-04 -5.560862101e-04 5.64 -4.815388251e-04 -4.815388251e-04 5.66 -4.172369046e-04 -4.172369046e-04 5.68 -3.617419843e-04 -3.617419843e-04 5.70 -3.138207914e-04 -3.138207914e-04 5.72 -2.724157669e-04 -2.724157669e-04 5.74 -2.366197889e-04 -2.366197889e-04 5.76 -2.056545200e-04 -2.056545200e-04 5.78 -1.788518728e-04 -1.788518728e-04 5.80 -1.556381530e-04 -1.556381530e-04 5.82 -1.355204993e-04 -1.355204993e-04 5.84 -1.180752888e-04 -1.180752888e-04 5.86 -1.029382242e-04 -1.029382242e-04 5.88 -8.979585951e-05 -8.979585951e-05 5.90 -7.837835363e-05 -7.837835363e-05 5.92 -6.845327347e-05 -6.845327347e-05 5.94 -5.982029301e-05 -5.982029301e-05 5.96 -5.230665732e-05 -5.230665732e-05 5.98 -4.576329986e-05 -4.576329986e-05 6.00 -4.006151755e-05 -4.006151755e-05