# 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 = Co2CuNi # 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 1.135474968e+02 1.135474968e+02 1.30 1.038871466e+02 1.038871466e+02 1.32 9.501210455e+01 9.501210455e+01 1.34 8.685298590e+01 8.685298590e+01 1.36 7.934840109e+01 7.934840109e+01 1.38 7.244461281e+01 7.244461281e+01 1.40 6.609389686e+01 6.609389686e+01 1.42 6.025289634e+01 6.025289634e+01 1.44 5.488123306e+01 5.488123306e+01 1.46 4.994066594e+01 4.994066594e+01 1.48 4.539516794e+01 4.539516794e+01 1.50 4.121155441e+01 4.121155441e+01 1.52 3.735986786e+01 3.735986786e+01 1.54 3.381322182e+01 3.381322182e+01 1.56 3.054733377e+01 3.054733377e+01 1.58 2.754010036e+01 2.754010036e+01 1.60 2.477267306e+01 2.477267306e+01 1.62 2.222698780e+01 2.222698780e+01 1.64 1.988601311e+01 1.988601311e+01 1.66 1.773426525e+01 1.773426525e+01 1.68 1.575749828e+01 1.575749828e+01 1.70 1.394248007e+01 1.394248007e+01 1.72 1.227676438e+01 1.227676438e+01 1.74 1.074847419e+01 1.074847419e+01 1.76 9.346248411e+00 9.346248411e+00 1.78 8.059433134e+00 8.059433134e+00 1.80 6.878385572e+00 6.878385572e+00 1.82 5.794662867e+00 5.794662867e+00 1.84 4.800970484e+00 4.800970484e+00 1.86 3.890912674e+00 3.890912674e+00 1.88 3.058673738e+00 3.058673738e+00 1.90 2.298745360e+00 2.298745360e+00 1.92 1.605764644e+00 1.605764644e+00 1.94 9.744821091e-01 9.744821091e-01 1.96 3.998385453e-01 3.998385453e-01 1.98 -1.229050505e-01 -1.229050505e-01 2.00 -5.980504698e-01 -5.980504698e-01 2.02 -1.029406143e+00 -1.029406143e+00 2.04 -1.420308838e+00 -1.420308838e+00 2.06 -1.773706180e+00 -1.773706180e+00 2.08 -2.092259534e+00 -2.092259534e+00 2.10 -2.378429819e+00 -2.378429819e+00 2.12 -2.634530963e+00 -2.634530963e+00 2.14 -2.862755092e+00 -2.862755092e+00 2.16 -3.065180485e+00 -3.065180485e+00 2.18 -3.243772637e+00 -3.243772637e+00 2.20 -3.400386316e+00 -3.400386316e+00 2.22 -3.536773076e+00 -3.536773076e+00 2.24 -3.654594132e+00 -3.654594132e+00 2.26 -3.755435591e+00 -3.755435591e+00 2.28 -3.840822990e+00 -3.840822990e+00 2.30 -3.912231941e+00 -3.912231941e+00 2.32 -3.971089053e+00 -3.971089053e+00 2.34 -4.018768131e+00 -4.018768131e+00 2.36 -4.056636418e+00 -4.056636418e+00 2.38 -4.085722600e+00 -4.085722600e+00 2.40 -4.106866695e+00 -4.106866695e+00 2.42 -4.120775051e+00 -4.120775051e+00 2.44 -4.128033659e+00 -4.128033659e+00 2.46 -4.129139375e+00 -4.129139375e+00 2.48 -4.124534865e+00 -4.124534865e+00 2.50 -4.114637623e+00 -4.114637623e+00 2.52 -4.099839140e+00 -4.099839140e+00 2.54 -4.079985697e+00 -4.079985697e+00 2.56 -4.054985581e+00 -4.054985581e+00 2.58 -4.024881403e+00 -4.024881403e+00 2.60 -3.989826358e+00 -3.989826358e+00 2.62 -3.950056874e+00 -3.950056874e+00 2.64 -3.905864379e+00 -3.905864379e+00 2.66 -3.857592815e+00 -3.857592815e+00 2.68 -3.805624208e+00 -3.805624208e+00 2.70 -3.750345161e+00 -3.750345161e+00 2.72 -3.692147774e+00 -3.692147774e+00 2.74 -3.631429628e+00 -3.631429628e+00 2.76 -3.568585993e+00 -3.568585993e+00 2.78 -3.503994955e+00 -3.503994955e+00 2.80 -3.438000321e+00 -3.438000321e+00 2.82 -3.370898248e+00 -3.370898248e+00 2.84 -3.302931686e+00 -3.302931686e+00 2.86 -3.234293364e+00 -3.234293364e+00 2.88 -3.165135333e+00 -3.165135333e+00 2.90 -3.095581856e+00 -3.095581856e+00 2.92 -3.025742781e+00 -3.025742781e+00 2.94 -2.955725521e+00 -2.955725521e+00 2.96 -2.885644667e+00 -2.885644667e+00 2.98 -2.815628682e+00 -2.815628682e+00 3.00 -2.745823018e+00 -2.745823018e+00 3.02 -2.676388924e+00 -2.676388924e+00 3.04 -2.607497522e+00 -2.607497522e+00 3.06 -2.539319762e+00 -2.539319762e+00 3.08 -2.472014239e+00 -2.472014239e+00 3.10 -2.405715903e+00 -2.405715903e+00 3.12 -2.340528498e+00 -2.340528498e+00 3.14 -2.276522256e+00 -2.276522256e+00 3.16 -2.213736558e+00 -2.213736558e+00 3.18 -2.152185901e+00 -2.152185901e+00 3.20 -2.091867130e+00 -2.091867130e+00 3.22 -2.032766272e+00 -2.032766272e+00 3.24 -1.974864045e+00 -1.974864045e+00 3.26 -1.918139792e+00 -1.918139792e+00 3.28 -1.862573965e+00 -1.862573965e+00 3.30 -1.808149480e+00 -1.808149480e+00 3.32 -1.754852233e+00 -1.754852233e+00 3.34 -1.702671045e+00 -1.702671045e+00 3.36 -1.651597209e+00 -1.651597209e+00 3.38 -1.601623783e+00 -1.601623783e+00 3.40 -1.552744724e+00 -1.552744724e+00 3.42 -1.504953949e+00 -1.504953949e+00 3.44 -1.458244415e+00 -1.458244415e+00 3.46 -1.412607278e+00 -1.412607278e+00 3.48 -1.368031188e+00 -1.368031188e+00 3.50 -1.324501787e+00 -1.324501787e+00 3.52 -1.282001404e+00 -1.282001404e+00 3.54 -1.240508990e+00 -1.240508990e+00 3.56 -1.200000257e+00 -1.200000257e+00 3.58 -1.160448045e+00 -1.160448045e+00 3.60 -1.121822882e+00 -1.121822882e+00 3.62 -1.084093751e+00 -1.084093751e+00 3.64 -1.047229062e+00 -1.047229062e+00 3.66 -1.011197834e+00 -1.011197834e+00 3.68 -9.759710837e-01 -9.759710837e-01 3.70 -9.415233765e-01 -9.415233765e-01 3.72 -9.078344714e-01 -9.078344714e-01 3.74 -8.748909178e-01 -8.748909178e-01 3.76 -8.426874182e-01 -8.426874182e-01 3.78 -8.112277214e-01 -8.112277214e-01 3.80 -7.805248034e-01 -7.805248034e-01 3.82 -7.506001310e-01 -7.506001310e-01 3.84 -7.214819021e-01 -7.214819021e-01 3.86 -6.932023094e-01 -6.932023094e-01 3.88 -6.657940526e-01 -6.657940526e-01 3.90 -6.392864892e-01 -6.392864892e-01 3.92 -6.137019171e-01 -6.137019171e-01 3.94 -5.890524812e-01 -5.890524812e-01 3.96 -5.653380918e-01 -5.653380918e-01 3.98 -5.425455604e-01 -5.425455604e-01 4.00 -5.206489465e-01 -5.206489465e-01 4.02 -4.996109267e-01 -4.996109267e-01 4.04 -4.793848866e-01 -4.793848866e-01 4.06 -4.599174040e-01 -4.599174040e-01 4.08 -4.411508328e-01 -4.411508328e-01 4.10 -4.230257727e-01 -4.230257727e-01 4.12 -4.054833045e-01 -4.054833045e-01 4.14 -3.884669366e-01 -3.884669366e-01 4.16 -3.719242674e-01 -3.719242674e-01 4.18 -3.558083768e-01 -3.558083768e-01 4.20 -3.400789592e-01 -3.400789592e-01 4.22 -3.247031922e-01 -3.247031922e-01 4.24 -3.096563146e-01 -3.096563146e-01 4.26 -2.949218832e-01 -2.949218832e-01 4.28 -2.804916867e-01 -2.804916867e-01 4.30 -2.663653294e-01 -2.663653294e-01 4.32 -2.525495331e-01 -2.525495331e-01 4.34 -2.390572378e-01 -2.390572378e-01 4.36 -2.259065882e-01 -2.259065882e-01 4.38 -2.131198730e-01 -2.131198730e-01 4.40 -2.007224334e-01 -2.007224334e-01 4.42 -1.887415167e-01 -1.887415167e-01 4.44 -1.772050230e-01 -1.772050230e-01 4.46 -1.661401026e-01 -1.661401026e-01 4.48 -1.555716156e-01 -1.555716156e-01 4.50 -1.455205234e-01 -1.455205234e-01 4.52 -1.360023506e-01 -1.360023506e-01 4.54 -1.270258823e-01 -1.270258823e-01 4.56 -1.185922569e-01 -1.185922569e-01 4.58 -1.106945676e-01 -1.106945676e-01 4.60 -1.033180149e-01 -1.033180149e-01 4.62 -9.644057631e-02 -9.644057631e-02 4.64 -9.003409988e-02 -9.003409988e-02 4.66 -8.406568549e-02 -8.406568549e-02 4.68 -7.849921518e-02 -7.849921518e-02 4.70 -7.329690419e-02 -7.329690419e-02 4.72 -6.842072748e-02 -6.842072748e-02 4.74 -6.383347353e-02 -6.383347353e-02 4.76 -5.950079039e-02 -5.950079039e-02 4.78 -5.539152605e-02 -5.539152605e-02 4.80 -5.147836909e-02 -5.147836909e-02 4.82 -4.773847247e-02 -4.773847247e-02 4.84 -4.415385647e-02 -4.415385647e-02 4.86 -4.071159101e-02 -4.071159101e-02 4.88 -3.740374538e-02 -3.740374538e-02 4.90 -3.422709329e-02 -3.422709329e-02 4.92 -3.118256832e-02 -3.118256832e-02 4.94 -2.827448300e-02 -2.827448300e-02 4.96 -2.550955115e-02 -2.550955115e-02 4.98 -2.289578059e-02 -2.289578059e-02 5.00 -2.044133037e-02 -2.044133037e-02 5.02 -1.815343788e-02 -1.815343788e-02 5.04 -1.603751427e-02 -1.603751427e-02 5.06 -1.409648647e-02 -1.409648647e-02 5.08 -1.233022607e-02 -1.233022607e-02 5.10 -1.073574105e-02 -1.073574105e-02 5.12 -9.307674171e-03 -9.307674171e-03 5.14 -8.038199337e-03 -8.038199337e-03 5.16 -6.917546612e-03 -6.917546612e-03 5.18 -5.934582753e-03 -5.934582753e-03 5.20 -5.077378518e-03 -5.077378518e-03 5.22 -4.333717587e-03 -4.333717587e-03 5.24 -3.691520317e-03 -3.691520317e-03 5.26 -3.139171689e-03 -3.139171689e-03 5.28 -2.665755038e-03 -2.665755038e-03 5.30 -2.261201168e-03 -2.261201168e-03 5.32 -1.916366710e-03 -1.916366710e-03 5.34 -1.623056867e-03 -1.623056867e-03 5.36 -1.374007114e-03 -1.374007114e-03 5.38 -1.162836602e-03 -1.162836602e-03 5.40 -9.839838068e-04 -9.839838068e-04 5.42 -8.326326295e-04 -8.326326295e-04 5.44 -7.046350236e-04 -7.046350236e-04 5.46 -5.964344374e-04 -5.964344374e-04 5.48 -5.049928877e-04 -5.049928877e-04 5.50 -4.277233735e-04 -4.277233735e-04 5.52 -3.624285114e-04 -3.624285114e-04 5.54 -3.072456975e-04 -3.072456975e-04 5.56 -2.605987062e-04 -2.605987062e-04 5.58 -2.211553934e-04 -2.211553934e-04 5.60 -1.877910272e-04 -1.877910272e-04 5.62 -1.595567025e-04 -1.595567025e-04 5.64 -1.356522758e-04 -1.356522758e-04 5.66 -1.154032732e-04 -1.154032732e-04 5.68 -9.824125457e-05 -9.824125457e-05 5.70 -8.368716486e-05 -8.368716486e-05 5.72 -7.133724888e-05 -7.133724888e-05 5.74 -6.085115634e-05 -6.085115634e-05 5.76 -5.194191084e-05 -5.194191084e-05 5.78 -4.436745982e-05 -4.436745982e-05 5.80 -3.792356228e-05 -3.792356228e-05 5.82 -3.243780577e-05 -3.243780577e-05 5.84 -2.776457545e-05 -2.776457545e-05 5.86 -2.378082467e-05 -2.378082467e-05 5.88 -2.038251954e-05 -2.038251954e-05 5.90 -1.748165021e-05 -1.748165021e-05 5.92 -1.500371797e-05 -1.500371797e-05 5.94 -1.288562201e-05 -1.288562201e-05 5.96 -1.107388187e-05 -1.107388187e-05 5.98 -9.523141501e-06 -9.523141501e-06 6.00 -8.194909979e-06 -8.194909979e-06