# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1989--Adams-J-B-Foiles-S-M-Wolfer-W-G--Ag-Au-Cu-Ni-Pd-Pt # implementation = 1989--Adams-J-B--Ag-Au-Cu-Ni-Pd-Pt--LAMMPS--ipr1 # composition = AgCu2Pt # 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 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 4.564625887e+02 4.564625887e+02 1.00 4.173883885e+02 4.173883885e+02 1.02 3.819411349e+02 3.819411349e+02 1.04 3.497590320e+02 3.497590320e+02 1.06 3.205108940e+02 3.205108940e+02 1.08 2.939122169e+02 2.939122169e+02 1.10 2.697064507e+02 2.697064507e+02 1.12 2.476594481e+02 2.476594481e+02 1.14 2.275585686e+02 2.275585686e+02 1.16 2.092176423e+02 2.092176423e+02 1.18 1.924727044e+02 1.924727044e+02 1.20 1.771716186e+02 1.771716186e+02 1.22 1.631750793e+02 1.631750793e+02 1.24 1.503665154e+02 1.503665154e+02 1.26 1.386337633e+02 1.386337633e+02 1.28 1.278776191e+02 1.278776191e+02 1.30 1.180054943e+02 1.180054943e+02 1.32 1.089362633e+02 1.089362633e+02 1.34 1.005995620e+02 1.005995620e+02 1.36 9.292854341e+01 9.292854341e+01 1.38 8.586198214e+01 8.586198214e+01 1.40 7.934805289e+01 7.934805289e+01 1.42 7.333780440e+01 7.333780440e+01 1.44 6.778586866e+01 6.778586866e+01 1.46 6.265186749e+01 6.265186749e+01 1.48 5.790174302e+01 5.790174302e+01 1.50 5.350416025e+01 5.350416025e+01 1.52 4.942934782e+01 4.942934782e+01 1.54 4.564937301e+01 4.564937301e+01 1.56 4.214108084e+01 4.214108084e+01 1.58 3.888286805e+01 3.888286805e+01 1.60 3.585553123e+01 3.585553123e+01 1.62 3.304096935e+01 3.304096935e+01 1.64 3.042251117e+01 3.042251117e+01 1.66 2.798462304e+01 2.798462304e+01 1.68 2.571383610e+01 2.571383610e+01 1.70 2.359848989e+01 2.359848989e+01 1.72 2.162716013e+01 2.162716013e+01 1.74 1.978954519e+01 1.978954519e+01 1.76 1.805938753e+01 1.805938753e+01 1.78 1.646136988e+01 1.646136988e+01 1.80 1.497397837e+01 1.497397837e+01 1.82 1.358992867e+01 1.358992867e+01 1.84 1.230230615e+01 1.230230615e+01 1.86 1.110466053e+01 1.110466053e+01 1.88 9.958803304e+00 9.958803304e+00 1.90 8.906760982e+00 8.906760982e+00 1.92 7.912722946e+00 7.912722946e+00 1.94 6.972583996e+00 6.972583996e+00 1.96 6.086101323e+00 6.086101323e+00 1.98 5.250242624e+00 5.250242624e+00 2.00 4.463508395e+00 4.463508395e+00 2.02 3.724436037e+00 3.724436037e+00 2.04 3.031245276e+00 3.031245276e+00 2.06 2.382062836e+00 2.382062836e+00 2.08 1.775136780e+00 1.775136780e+00 2.10 1.209088885e+00 1.209088885e+00 2.12 6.820531191e-01 6.820531191e-01 2.14 1.925972291e-01 1.925972291e-01 2.16 -2.611466056e-01 -2.611466056e-01 2.18 -6.804627594e-01 -6.804627594e-01 2.20 -1.066850344e+00 -1.066850344e+00 2.22 -1.421927406e+00 -1.421927406e+00 2.24 -1.747045797e+00 -1.747045797e+00 2.26 -2.043717273e+00 -2.043717273e+00 2.28 -2.313396536e+00 -2.313396536e+00 2.30 -2.556120493e+00 -2.556120493e+00 2.32 -2.775066486e+00 -2.775066486e+00 2.34 -2.971520828e+00 -2.971520828e+00 2.36 -3.146780237e+00 -3.146780237e+00 2.38 -3.302101525e+00 -3.302101525e+00 2.40 -3.438700223e+00 -3.438700223e+00 2.42 -3.557771408e+00 -3.557771408e+00 2.44 -3.660424672e+00 -3.660424672e+00 2.46 -3.747742387e+00 -3.747742387e+00 2.48 -3.820868769e+00 -3.820868769e+00 2.50 -3.881024504e+00 -3.881024504e+00 2.52 -3.928197385e+00 -3.928197385e+00 2.54 -3.963566398e+00 -3.963566398e+00 2.56 -3.988396522e+00 -3.988396522e+00 2.58 -4.003462894e+00 -4.003462894e+00 2.60 -4.011217568e+00 -4.011217568e+00 2.62 -4.011150020e+00 -4.011150020e+00 2.64 -4.003492072e+00 -4.003492072e+00 2.66 -3.988956546e+00 -3.988956546e+00 2.68 -3.968149822e+00 -3.968149822e+00 2.70 -3.941593118e+00 -3.941593118e+00 2.72 -3.909827844e+00 -3.909827844e+00 2.74 -3.873361635e+00 -3.873361635e+00 2.76 -3.832667299e+00 -3.832667299e+00 2.78 -3.788391490e+00 -3.788391490e+00 2.80 -3.740886124e+00 -3.740886124e+00 2.82 -3.690370514e+00 -3.690370514e+00 2.84 -3.637205094e+00 -3.637205094e+00 2.86 -3.581504994e+00 -3.581504994e+00 2.88 -3.522377232e+00 -3.522377232e+00 2.90 -3.461477992e+00 -3.461477992e+00 2.92 -3.398687728e+00 -3.398687728e+00 2.94 -3.334796871e+00 -3.334796871e+00 2.96 -3.270022788e+00 -3.270022788e+00 2.98 -3.204568485e+00 -3.204568485e+00 3.00 -3.138616819e+00 -3.138616819e+00 3.02 -3.072337517e+00 -3.072337517e+00 3.04 -3.006242531e+00 -3.006242531e+00 3.06 -2.940582634e+00 -2.940582634e+00 3.08 -2.874945679e+00 -2.874945679e+00 3.10 -2.809419208e+00 -2.809419208e+00 3.12 -2.744162456e+00 -2.744162456e+00 3.14 -2.679287439e+00 -2.679287439e+00 3.16 -2.614878482e+00 -2.614878482e+00 3.18 -2.551013794e+00 -2.551013794e+00 3.20 -2.487763362e+00 -2.487763362e+00 3.22 -2.425189747e+00 -2.425189747e+00 3.24 -2.363342091e+00 -2.363342091e+00 3.26 -2.302612754e+00 -2.302612754e+00 3.28 -2.242802558e+00 -2.242802558e+00 3.30 -2.183831118e+00 -2.183831118e+00 3.32 -2.125732854e+00 -2.125732854e+00 3.34 -2.068537763e+00 -2.068537763e+00 3.36 -2.012271702e+00 -2.012271702e+00 3.38 -1.956953181e+00 -1.956953181e+00 3.40 -1.902619402e+00 -1.902619402e+00 3.42 -1.849335476e+00 -1.849335476e+00 3.44 -1.796981991e+00 -1.796981991e+00 3.46 -1.745514593e+00 -1.745514593e+00 3.48 -1.694811317e+00 -1.694811317e+00 3.50 -1.644938562e+00 -1.644938562e+00 3.52 -1.596105625e+00 -1.596105625e+00 3.54 -1.548324152e+00 -1.548324152e+00 3.56 -1.501497434e+00 -1.501497434e+00 3.58 -1.455592118e+00 -1.455592118e+00 3.60 -1.410657291e+00 -1.410657291e+00 3.62 -1.366741030e+00 -1.366741030e+00 3.64 -1.323858344e+00 -1.323858344e+00 3.66 -1.281987627e+00 -1.281987627e+00 3.68 -1.241111058e+00 -1.241111058e+00 3.70 -1.201212688e+00 -1.201212688e+00 3.72 -1.162283119e+00 -1.162283119e+00 3.74 -1.124307557e+00 -1.124307557e+00 3.76 -1.087267020e+00 -1.087267020e+00 3.78 -1.051150062e+00 -1.051150062e+00 3.80 -1.015941601e+00 -1.015941601e+00 3.82 -9.816182236e-01 -9.816182236e-01 3.84 -9.481563068e-01 -9.481563068e-01 3.86 -9.155490202e-01 -9.155490202e-01 3.88 -8.837993229e-01 -8.837993229e-01 3.90 -8.528895976e-01 -8.528895976e-01 3.92 -8.227210065e-01 -8.227210065e-01 3.94 -7.931898738e-01 -7.931898738e-01 3.96 -7.643661776e-01 -7.643661776e-01 3.98 -7.363642369e-01 -7.363642369e-01 4.00 -7.092684769e-01 -7.092684769e-01 4.02 -6.831385013e-01 -6.831385013e-01 4.04 -6.580193034e-01 -6.580193034e-01 4.06 -6.340130726e-01 -6.340130726e-01 4.08 -6.111871013e-01 -6.111871013e-01 4.10 -5.892497592e-01 -5.892497592e-01 4.12 -5.678807940e-01 -5.678807940e-01 4.14 -5.468451815e-01 -5.468451815e-01 4.16 -5.259765149e-01 -5.259765149e-01 4.18 -5.051631360e-01 -5.051631360e-01 4.20 -4.843366107e-01 -4.843366107e-01 4.22 -4.634621724e-01 -4.634621724e-01 4.24 -4.425308503e-01 -4.425308503e-01 4.26 -4.215526736e-01 -4.215526736e-01 4.28 -4.005007149e-01 -4.005007149e-01 4.30 -3.801949804e-01 -3.801949804e-01 4.32 -3.603196954e-01 -3.603196954e-01 4.34 -3.406675587e-01 -3.406675587e-01 4.36 -3.213824547e-01 -3.213824547e-01 4.38 -3.025687947e-01 -3.025687947e-01 4.40 -2.843052573e-01 -2.843052573e-01 4.42 -2.666492510e-01 -2.666492510e-01 4.44 -2.496406737e-01 -2.496406737e-01 4.46 -2.333050832e-01 -2.333050832e-01 4.48 -2.176563790e-01 -2.176563790e-01 4.50 -2.026990408e-01 -2.026990408e-01 4.52 -1.884300149e-01 -1.884300149e-01 4.54 -1.748402891e-01 -1.748402891e-01 4.56 -1.619160970e-01 -1.619160970e-01 4.58 -1.496310029e-01 -1.496310029e-01 4.60 -1.382273019e-01 -1.382273019e-01 4.62 -1.276535298e-01 -1.276535298e-01 4.64 -1.176214225e-01 -1.176214225e-01 4.66 -1.081176206e-01 -1.081176206e-01 4.68 -9.911945712e-02 -9.911945712e-02 4.70 -9.060424085e-02 -9.060424085e-02 4.72 -8.254950420e-02 -8.254950420e-02 4.74 -7.493316879e-02 -7.493316879e-02 4.76 -6.773367621e-02 -6.773367621e-02 4.78 -6.093008088e-02 -6.093008088e-02 4.80 -5.449950326e-02 -5.449950326e-02 4.82 -4.850242310e-02 -4.850242310e-02 4.84 -4.286726236e-02 -4.286726236e-02 4.86 -3.754359354e-02 -3.754359354e-02 4.88 -3.251482596e-02 -3.251482596e-02 4.90 -2.776512008e-02 -2.776512008e-02 4.92 -2.327858798e-02 -2.327858798e-02 4.94 -1.894695399e-02 -1.894695399e-02 4.96 -1.620923181e-02 -1.620923181e-02 4.98 -1.494529681e-02 -1.494529681e-02 5.00 -1.366861156e-02 -1.366861156e-02 5.02 -1.246703341e-02 -1.246703341e-02 5.04 -1.133689681e-02 -1.133689681e-02 5.06 -1.027406401e-02 -1.027406401e-02 5.08 -9.274626492e-03 -9.274626492e-03 5.10 -8.334893872e-03 -8.334893872e-03 5.12 -7.451383068e-03 -7.451383068e-03 5.14 -6.620807678e-03 -6.620807678e-03 5.16 -5.840067672e-03 -5.840067672e-03 5.18 -5.106239536e-03 -5.106239536e-03 5.20 -4.416566826e-03 -4.416566826e-03 5.22 -3.768451162e-03 -3.768451162e-03 5.24 -3.159443438e-03 -3.159443438e-03 5.26 -2.587226865e-03 -2.587226865e-03 5.28 -2.050196190e-03 -2.050196190e-03 5.30 -1.558677146e-03 -1.558677146e-03 5.32 -1.372391905e-03 -1.372391905e-03 5.34 -1.206574201e-03 -1.206574201e-03 5.36 -1.053182760e-03 -1.053182760e-03 5.38 -9.093785592e-04 -9.093785592e-04 5.40 -7.745764051e-04 -7.745764051e-04 5.42 -6.482259389e-04 -6.482259389e-04 5.44 -5.298096065e-04 -5.298096065e-04 5.46 -4.188407516e-04 -4.188407516e-04 5.48 -3.148618248e-04 -3.148618248e-04 5.50 -2.174426945e-04 -2.174426945e-04 5.52 -1.261790316e-04 -1.261790316e-04 5.54 -4.014389261e-05 -4.014389261e-05 5.56 0.000000000e+00 0.000000000e+00 5.58 0.000000000e+00 0.000000000e+00 5.60 0.000000000e+00 0.000000000e+00 5.62 0.000000000e+00 0.000000000e+00 5.64 0.000000000e+00 0.000000000e+00 5.66 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 5.70 0.000000000e+00 0.000000000e+00 5.72 0.000000000e+00 0.000000000e+00 5.74 0.000000000e+00 0.000000000e+00 5.76 0.000000000e+00 0.000000000e+00 5.78 0.000000000e+00 0.000000000e+00 5.80 0.000000000e+00 0.000000000e+00 5.82 0.000000000e+00 0.000000000e+00 5.84 0.000000000e+00 0.000000000e+00 5.86 0.000000000e+00 0.000000000e+00 5.88 0.000000000e+00 0.000000000e+00 5.90 0.000000000e+00 0.000000000e+00 5.92 0.000000000e+00 0.000000000e+00 5.94 0.000000000e+00 0.000000000e+00 5.96 0.000000000e+00 0.000000000e+00 5.98 0.000000000e+00 0.000000000e+00 6.00 0.000000000e+00 0.000000000e+00