# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1986--Foiles-S-M-Baskes-M-I-Daw-M-S--Ag-Au-Cu-Ni-Pd-Pt # implementation = 1986--Foiles-S-M--Ag-Au-Cu-Ni-Pd-Pt--LAMMPS--ipr1 # composition = AgNi2Pt # 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 5.889709893e+02 5.889709893e+02 1.00 5.368843183e+02 5.368843183e+02 1.02 4.896756817e+02 4.896756817e+02 1.04 4.468657275e+02 4.468657275e+02 1.06 4.080255491e+02 4.080255491e+02 1.08 3.727655338e+02 3.727655338e+02 1.10 3.407391288e+02 3.407391288e+02 1.12 3.116319956e+02 3.116319956e+02 1.14 2.851623535e+02 2.851623535e+02 1.16 2.610818223e+02 2.610818223e+02 1.18 2.391600905e+02 2.391600905e+02 1.20 2.191933883e+02 2.191933883e+02 1.22 2.009941303e+02 2.009941303e+02 1.24 1.843978645e+02 1.843978645e+02 1.26 1.692514379e+02 1.692514379e+02 1.28 1.554166481e+02 1.554166481e+02 1.30 1.427711562e+02 1.427711562e+02 1.32 1.312047933e+02 1.312047933e+02 1.34 1.206165014e+02 1.206165014e+02 1.36 1.109173067e+02 1.109173067e+02 1.38 1.020254152e+02 1.020254152e+02 1.40 9.386409183e+01 9.386409183e+01 1.42 8.636729607e+01 8.636729607e+01 1.44 7.947746567e+01 7.947746567e+01 1.46 7.314060533e+01 7.314060533e+01 1.48 6.730679120e+01 6.730679120e+01 1.50 6.193198449e+01 6.193198449e+01 1.52 5.697687823e+01 5.697687823e+01 1.54 5.240478149e+01 5.240478149e+01 1.56 4.818270674e+01 4.818270674e+01 1.58 4.428142625e+01 4.428142625e+01 1.60 4.067503530e+01 4.067503530e+01 1.62 3.733846656e+01 3.733846656e+01 1.64 3.425030314e+01 3.425030314e+01 1.66 3.139079575e+01 3.139079575e+01 1.68 2.874190049e+01 2.874190049e+01 1.70 2.628679761e+01 2.628679761e+01 1.72 2.400900288e+01 2.400900288e+01 1.74 2.189696089e+01 2.189696089e+01 1.76 1.993813033e+01 1.993813033e+01 1.78 1.812051870e+01 1.812051870e+01 1.80 1.643402789e+01 1.643402789e+01 1.82 1.486932952e+01 1.486932952e+01 1.84 1.340341968e+01 1.340341968e+01 1.86 1.205883346e+01 1.205883346e+01 1.88 1.081244941e+01 1.081244941e+01 1.90 9.614885125e+00 9.614885125e+00 1.92 8.514859526e+00 8.514859526e+00 1.94 7.474152682e+00 7.474152682e+00 1.96 6.491544345e+00 6.491544345e+00 1.98 5.565408290e+00 5.565408290e+00 2.00 4.694280925e+00 4.694280925e+00 2.02 3.876514759e+00 3.876514759e+00 2.04 3.110388333e+00 3.110388333e+00 2.06 2.393976769e+00 2.393976769e+00 2.08 1.725373975e+00 1.725373975e+00 2.10 1.102734184e+00 1.102734184e+00 2.12 5.242910971e-01 5.242910971e-01 2.14 -1.160828963e-02 -1.160828963e-02 2.16 -5.063034896e-01 -5.063034896e-01 2.18 -9.612516607e-01 -9.612516607e-01 2.20 -1.379296116e+00 -1.379296116e+00 2.22 -1.762274759e+00 -1.762274759e+00 2.24 -2.111872652e+00 -2.111872652e+00 2.26 -2.429774140e+00 -2.429774140e+00 2.28 -2.717616170e+00 -2.717616170e+00 2.30 -2.976888908e+00 -2.976888908e+00 2.32 -3.209385475e+00 -3.209385475e+00 2.34 -3.416546056e+00 -3.416546056e+00 2.36 -3.599917135e+00 -3.599917135e+00 2.38 -3.760985663e+00 -3.760985663e+00 2.40 -3.901065803e+00 -3.901065803e+00 2.42 -4.021544877e+00 -4.021544877e+00 2.44 -4.123806537e+00 -4.123806537e+00 2.46 -4.209092561e+00 -4.209092561e+00 2.48 -4.278603494e+00 -4.278603494e+00 2.50 -4.333490571e+00 -4.333490571e+00 2.52 -4.375632853e+00 -4.375632853e+00 2.54 -4.405571467e+00 -4.405571467e+00 2.56 -4.423853979e+00 -4.423853979e+00 2.58 -4.431584222e+00 -4.431584222e+00 2.60 -4.429660086e+00 -4.429660086e+00 2.62 -4.418909307e+00 -4.418909307e+00 2.64 -4.400131684e+00 -4.400131684e+00 2.66 -4.374159989e+00 -4.374159989e+00 2.68 -4.341693771e+00 -4.341693771e+00 2.70 -4.303339725e+00 -4.303339725e+00 2.72 -4.259715243e+00 -4.259715243e+00 2.74 -4.211395831e+00 -4.211395831e+00 2.76 -4.158913961e+00 -4.158913961e+00 2.78 -4.102975552e+00 -4.102975552e+00 2.80 -4.043022814e+00 -4.043022814e+00 2.82 -3.980264362e+00 -3.980264362e+00 2.84 -3.915143491e+00 -3.915143491e+00 2.86 -3.848014861e+00 -3.848014861e+00 2.88 -3.778899247e+00 -3.778899247e+00 2.90 -3.707871624e+00 -3.707871624e+00 2.92 -3.635874889e+00 -3.635874889e+00 2.94 -3.563081145e+00 -3.563081145e+00 2.96 -3.490268967e+00 -3.490268967e+00 2.98 -3.417040648e+00 -3.417040648e+00 3.00 -3.343583692e+00 -3.343583692e+00 3.02 -3.270073747e+00 -3.270073747e+00 3.04 -3.196589871e+00 -3.196589871e+00 3.06 -3.123295559e+00 -3.123295559e+00 3.08 -3.050362674e+00 -3.050362674e+00 3.10 -2.977899712e+00 -2.977899712e+00 3.12 -2.906004400e+00 -2.906004400e+00 3.14 -2.834763740e+00 -2.834763740e+00 3.16 -2.764254869e+00 -2.764254869e+00 3.18 -2.694545910e+00 -2.694545910e+00 3.20 -2.625696763e+00 -2.625696763e+00 3.22 -2.557759758e+00 -2.557759758e+00 3.24 -2.490773454e+00 -2.490773454e+00 3.26 -2.425134318e+00 -2.425134318e+00 3.28 -2.360624587e+00 -2.360624587e+00 3.30 -2.297148996e+00 -2.297148996e+00 3.32 -2.234732094e+00 -2.234732094e+00 3.34 -2.173394656e+00 -2.173394656e+00 3.36 -2.113152501e+00 -2.113152501e+00 3.38 -2.054026184e+00 -2.054026184e+00 3.40 -1.996012413e+00 -1.996012413e+00 3.42 -1.939222210e+00 -1.939222210e+00 3.44 -1.883543005e+00 -1.883543005e+00 3.46 -1.828668642e+00 -1.828668642e+00 3.48 -1.774581220e+00 -1.774581220e+00 3.50 -1.721565539e+00 -1.721565539e+00 3.52 -1.669737058e+00 -1.669737058e+00 3.54 -1.619070100e+00 -1.619070100e+00 3.56 -1.569533232e+00 -1.569533232e+00 3.58 -1.521113635e+00 -1.521113635e+00 3.60 -1.473804980e+00 -1.473804980e+00 3.62 -1.427592521e+00 -1.427592521e+00 3.64 -1.382458857e+00 -1.382458857e+00 3.66 -1.338396985e+00 -1.338396985e+00 3.68 -1.295379185e+00 -1.295379185e+00 3.70 -1.253381808e+00 -1.253381808e+00 3.72 -1.212397712e+00 -1.212397712e+00 3.74 -1.172421059e+00 -1.172421059e+00 3.76 -1.133438639e+00 -1.133438639e+00 3.78 -1.095392226e+00 -1.095392226e+00 3.80 -1.058181038e+00 -1.058181038e+00 3.82 -1.021838794e+00 -1.021838794e+00 3.84 -9.864530185e-01 -9.864530185e-01 3.86 -9.521079776e-01 -9.521079776e-01 3.88 -9.188637526e-01 -9.188637526e-01 3.90 -8.867916233e-01 -8.867916233e-01 3.92 -8.558812013e-01 -8.558812013e-01 3.94 -8.259702771e-01 -8.259702771e-01 3.96 -7.968651052e-01 -7.968651052e-01 3.98 -7.684206770e-01 -7.684206770e-01 4.00 -7.405415609e-01 -7.405415609e-01 4.02 -7.131700592e-01 -7.131700592e-01 4.04 -6.862766668e-01 -6.862766668e-01 4.06 -6.599220384e-01 -6.599220384e-01 4.08 -6.341637116e-01 -6.341637116e-01 4.10 -6.087626734e-01 -6.087626734e-01 4.12 -5.835151479e-01 -5.835151479e-01 4.14 -5.582824445e-01 -5.582824445e-01 4.16 -5.332066289e-01 -5.332066289e-01 4.18 -5.090792208e-01 -5.090792208e-01 4.20 -4.851758042e-01 -4.851758042e-01 4.22 -4.615862123e-01 -4.615862123e-01 4.24 -4.383725494e-01 -4.383725494e-01 4.26 -4.155882274e-01 -4.155882274e-01 4.28 -3.932785109e-01 -3.932785109e-01 4.30 -3.714424277e-01 -3.714424277e-01 4.32 -3.500886404e-01 -3.500886404e-01 4.34 -3.293258336e-01 -3.293258336e-01 4.36 -3.092363355e-01 -3.092363355e-01 4.38 -2.898783175e-01 -2.898783175e-01 4.40 -2.712902577e-01 -2.712902577e-01 4.42 -2.534946856e-01 -2.534946856e-01 4.44 -2.365013002e-01 -2.365013002e-01 4.46 -2.203095783e-01 -2.203095783e-01 4.48 -2.049109452e-01 -2.049109452e-01 4.50 -1.902905689e-01 -1.902905689e-01 4.52 -1.764288407e-01 -1.764288407e-01 4.54 -1.633025954e-01 -1.633025954e-01 4.56 -1.508860100e-01 -1.508860100e-01 4.58 -1.391427000e-01 -1.391427000e-01 4.60 -1.282968481e-01 -1.282968481e-01 4.62 -1.182886730e-01 -1.182886730e-01 4.64 -1.088338402e-01 -1.088338402e-01 4.66 -9.991445118e-02 -9.991445118e-02 4.68 -9.150422786e-02 -9.150422786e-02 4.70 -8.357740194e-02 -8.357740194e-02 4.72 -7.610889359e-02 -7.610889359e-02 4.74 -6.907441968e-02 -6.907441968e-02 4.76 -6.245057078e-02 -6.245057078e-02 4.78 -5.622208240e-02 -5.622208240e-02 4.80 -5.037126539e-02 -5.037126539e-02 4.82 -4.668664247e-02 -4.668664247e-02 4.84 -4.327511566e-02 -4.327511566e-02 4.86 -4.006381035e-02 -4.006381035e-02 4.88 -3.704172461e-02 -3.704172461e-02 4.90 -3.419823190e-02 -3.419823190e-02 4.92 -3.152321859e-02 -3.152321859e-02 4.94 -2.900707525e-02 -2.900707525e-02 4.96 -2.664068412e-02 -2.664068412e-02 4.98 -2.441540444e-02 -2.441540444e-02 5.00 -2.232305594e-02 -2.232305594e-02 5.02 -2.035590164e-02 -2.035590164e-02 5.04 -1.850662962e-02 -1.850662962e-02 5.06 -1.676833385e-02 -1.676833385e-02 5.08 -1.513449553e-02 -1.513449553e-02 5.10 -1.359896439e-02 -1.359896439e-02 5.12 -1.215594053e-02 -1.215594053e-02 5.14 -1.079995628e-02 -1.079995628e-02 5.16 -9.525858709e-03 -9.525858709e-03 5.18 -8.328792799e-03 -8.328792799e-03 5.20 -7.204185262e-03 -7.204185262e-03 5.22 -6.147729116e-03 -6.147729116e-03 5.24 -5.155368636e-03 -5.155368636e-03 5.26 -4.223271073e-03 -4.223271073e-03 5.28 -3.348766209e-03 -3.348766209e-03 5.30 -2.548551702e-03 -2.548551702e-03 5.32 -2.243968027e-03 -2.243968027e-03 5.34 -1.972769312e-03 -1.972769312e-03 5.36 -1.721891229e-03 -1.721891229e-03 5.38 -1.486714588e-03 -1.486714588e-03 5.40 -1.266278472e-03 -1.266278472e-03 5.42 -1.059679461e-03 -1.059679461e-03 5.44 -8.660682411e-04 -8.660682411e-04 5.46 -6.846464362e-04 -6.846464362e-04 5.48 -5.146636256e-04 -5.146636256e-04 5.50 -3.554145389e-04 -3.554145389e-04 5.52 -2.062363745e-04 -2.062363745e-04 5.54 -6.561240402e-05 -6.561240402e-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