# 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 = CoNi2Pb # 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 1.886932380e+02 1.886932380e+02 1.30 1.745589763e+02 1.745589763e+02 1.32 1.614850855e+02 1.614850855e+02 1.34 1.493852108e+02 1.493852108e+02 1.36 1.381810891e+02 1.381810891e+02 1.38 1.278016696e+02 1.278016696e+02 1.40 1.181825285e+02 1.181825285e+02 1.42 1.092655156e+02 1.092655156e+02 1.44 1.009979637e+02 1.009979637e+02 1.46 9.333143171e+01 9.333143171e+01 1.48 8.622076143e+01 8.622076143e+01 1.50 7.962389010e+01 7.962389010e+01 1.52 7.350197575e+01 7.350197575e+01 1.54 6.781924366e+01 6.781924366e+01 1.56 6.254254624e+01 6.254254624e+01 1.58 5.764097037e+01 5.764097037e+01 1.60 5.308570442e+01 5.308570442e+01 1.62 4.885018793e+01 4.885018793e+01 1.64 4.491089595e+01 4.491089595e+01 1.66 4.125317829e+01 4.125317829e+01 1.68 3.785871721e+01 3.785871721e+01 1.70 3.470868081e+01 3.470868081e+01 1.72 3.178553169e+01 3.178553169e+01 1.74 2.907275269e+01 2.907275269e+01 1.76 2.655481030e+01 2.655481030e+01 1.78 2.421731642e+01 2.421731642e+01 1.80 2.204720302e+01 2.204720302e+01 1.82 2.003275556e+01 2.003275556e+01 1.84 1.816346474e+01 1.816346474e+01 1.86 1.642978454e+01 1.642978454e+01 1.88 1.482289065e+01 1.482289065e+01 1.90 1.333447432e+01 1.333447432e+01 1.92 1.195659668e+01 1.195659668e+01 1.94 1.068161196e+01 1.068161196e+01 1.96 9.502148618e+00 9.502148618e+00 1.98 8.411158374e+00 8.411158374e+00 2.00 7.402004542e+00 7.402004542e+00 2.02 6.468549052e+00 6.468549052e+00 2.04 5.605195446e+00 5.605195446e+00 2.06 4.806878993e+00 4.806878993e+00 2.08 4.069020778e+00 4.069020778e+00 2.10 3.387470418e+00 3.387470418e+00 2.12 2.758448168e+00 2.758448168e+00 2.14 2.178487175e+00 2.178487175e+00 2.16 1.644380994e+00 1.644380994e+00 2.18 1.153136877e+00 1.153136877e+00 2.20 7.019354606e-01 7.019354606e-01 2.22 2.881019848e-01 2.881019848e-01 2.24 -9.091123633e-02 -9.091123633e-02 2.26 -4.375303718e-01 -4.375303718e-01 2.28 -7.540625902e-01 -7.540625902e-01 2.30 -1.042695199e+00 -1.042695199e+00 2.32 -1.305511208e+00 -1.305511208e+00 2.34 -1.544495485e+00 -1.544495485e+00 2.36 -1.761541082e+00 -1.761541082e+00 2.38 -1.958435051e+00 -1.958435051e+00 2.40 -2.136833558e+00 -2.136833558e+00 2.42 -2.298237908e+00 -2.298237908e+00 2.44 -2.443990781e+00 -2.443990781e+00 2.46 -2.575312212e+00 -2.575312212e+00 2.48 -2.693195556e+00 -2.693195556e+00 2.50 -2.798519303e+00 -2.798519303e+00 2.52 -2.892093055e+00 -2.892093055e+00 2.54 -2.974676795e+00 -2.974676795e+00 2.56 -3.046995537e+00 -3.046995537e+00 2.58 -3.109747959e+00 -3.109747959e+00 2.60 -3.163606521e+00 -3.163606521e+00 2.62 -3.209081347e+00 -3.209081347e+00 2.64 -3.246424551e+00 -3.246424551e+00 2.66 -3.275904769e+00 -3.275904769e+00 2.68 -3.297842504e+00 -3.297842504e+00 2.70 -3.312606489e+00 -3.312606489e+00 2.72 -3.320612135e+00 -3.320612135e+00 2.74 -3.322316381e+00 -3.322316381e+00 2.76 -3.318205680e+00 -3.318205680e+00 2.78 -3.308777002e+00 -3.308777002e+00 2.80 -3.294516880e+00 -3.294516880e+00 2.82 -3.275879911e+00 -3.275879911e+00 2.84 -3.253276619e+00 -3.253276619e+00 2.86 -3.227068406e+00 -3.227068406e+00 2.88 -3.197570414e+00 -3.197570414e+00 2.90 -3.165059318e+00 -3.165059318e+00 2.92 -3.129783146e+00 -3.129783146e+00 2.94 -3.091970956e+00 -3.091970956e+00 2.96 -3.051841189e+00 -3.051841189e+00 2.98 -3.009608143e+00 -3.009608143e+00 3.00 -2.965509449e+00 -2.965509449e+00 3.02 -2.919770822e+00 -2.919770822e+00 3.04 -2.872569703e+00 -2.872569703e+00 3.06 -2.824093377e+00 -2.824093377e+00 3.08 -2.774529037e+00 -2.774529037e+00 3.10 -2.724061124e+00 -2.724061124e+00 3.12 -2.672865464e+00 -2.672865464e+00 3.14 -2.621109957e+00 -2.621109957e+00 3.16 -2.568946732e+00 -2.568946732e+00 3.18 -2.516509441e+00 -2.516509441e+00 3.20 -2.463923246e+00 -2.463923246e+00 3.22 -2.411306745e+00 -2.411306745e+00 3.24 -2.358770660e+00 -2.358770660e+00 3.26 -2.306416284e+00 -2.306416284e+00 3.28 -2.254334161e+00 -2.254334161e+00 3.30 -2.202603375e+00 -2.202603375e+00 3.32 -2.151291527e+00 -2.151291527e+00 3.34 -2.100455296e+00 -2.100455296e+00 3.36 -2.050141303e+00 -2.050141303e+00 3.38 -2.000387057e+00 -2.000387057e+00 3.40 -1.951221627e+00 -1.951221627e+00 3.42 -1.902667156e+00 -1.902667156e+00 3.44 -1.854738206e+00 -1.854738206e+00 3.46 -1.807443222e+00 -1.807443222e+00 3.48 -1.760784927e+00 -1.760784927e+00 3.50 -1.714761066e+00 -1.714761066e+00 3.52 -1.669365322e+00 -1.669365322e+00 3.54 -1.624588382e+00 -1.624588382e+00 3.56 -1.580419128e+00 -1.580419128e+00 3.58 -1.536845890e+00 -1.536845890e+00 3.60 -1.493857697e+00 -1.493857697e+00 3.62 -1.451445462e+00 -1.451445462e+00 3.64 -1.409603062e+00 -1.409603062e+00 3.66 -1.368328262e+00 -1.368328262e+00 3.68 -1.327623507e+00 -1.327623507e+00 3.70 -1.287496543e+00 -1.287496543e+00 3.72 -1.247960886e+00 -1.247960886e+00 3.74 -1.209036145e+00 -1.209036145e+00 3.76 -1.170748162e+00 -1.170748162e+00 3.78 -1.133128956e+00 -1.133128956e+00 3.80 -1.096216370e+00 -1.096216370e+00 3.82 -1.060053324e+00 -1.060053324e+00 3.84 -1.024686521e+00 -1.024686521e+00 3.86 -9.901645166e-01 -9.901645166e-01 3.88 -9.565351287e-01 -9.565351287e-01 3.90 -9.238423341e-01 -9.238423341e-01 3.92 -8.921226264e-01 -8.921226264e-01 3.94 -8.614033557e-01 -8.614033557e-01 3.96 -8.316980823e-01 -8.316980823e-01 3.98 -8.030067670e-01 -8.030067670e-01 4.00 -7.753151499e-01 -7.753151499e-01 4.02 -7.485956769e-01 -7.485956769e-01 4.04 -7.228093260e-01 -7.228093260e-01 4.06 -6.979080035e-01 -6.979080035e-01 4.08 -6.738371740e-01 -6.738371740e-01 4.10 -6.505373758e-01 -6.505373758e-01 4.12 -6.279510505e-01 -6.279510505e-01 4.14 -6.060175316e-01 -6.060175316e-01 4.16 -5.846796809e-01 -5.846796809e-01 4.18 -5.638839536e-01 -5.638839536e-01 4.20 -5.435815018e-01 -5.435815018e-01 4.22 -5.237290457e-01 -5.237290457e-01 4.24 -5.042895396e-01 -5.042895396e-01 4.26 -4.852326545e-01 -4.852326545e-01 4.28 -4.665350919e-01 -4.665350919e-01 4.30 -4.481807573e-01 -4.481807573e-01 4.32 -4.301608290e-01 -4.301608290e-01 4.34 -4.124737594e-01 -4.124737594e-01 4.36 -3.951252323e-01 -3.951252323e-01 4.38 -3.781280541e-01 -3.781280541e-01 4.40 -3.615019099e-01 -3.615019099e-01 4.42 -3.452728635e-01 -3.452728635e-01 4.44 -3.294724675e-01 -3.294724675e-01 4.46 -3.141363753e-01 -3.141363753e-01 4.48 -2.993024295e-01 -2.993024295e-01 4.50 -2.850083060e-01 -2.850083060e-01 4.52 -2.712889117e-01 -2.712889117e-01 4.54 -2.581738100e-01 -2.581738100e-01 4.56 -2.456849776e-01 -2.456849776e-01 4.58 -2.338351579e-01 -2.338351579e-01 4.60 -2.226269813e-01 -2.226269813e-01 4.62 -2.120529002e-01 -2.120529002e-01 4.64 -2.020958932e-01 -2.020958932e-01 4.66 -1.927307664e-01 -1.927307664e-01 4.68 -1.839258378e-01 -1.839258378e-01 4.70 -1.756448124e-01 -1.756448124e-01 4.72 -1.678486607e-01 -1.678486607e-01 4.74 -1.604967697e-01 -1.604967697e-01 4.76 -1.535495655e-01 -1.535495655e-01 4.78 -1.469699308e-01 -1.469699308e-01 4.80 -1.407223110e-01 -1.407223110e-01 4.82 -1.347768780e-01 -1.347768780e-01 4.84 -1.291048923e-01 -1.291048923e-01 4.86 -1.236825915e-01 -1.236825915e-01 4.88 -1.184902867e-01 -1.184902867e-01 4.90 -1.135122030e-01 -1.135122030e-01 4.92 -1.087361412e-01 -1.087361412e-01 4.94 -1.041529887e-01 -1.041529887e-01 4.96 -9.975611541e-02 -9.975611541e-02 4.98 -9.554070041e-02 -9.554070041e-02 5.00 -9.150304442e-02 -9.150304442e-02 5.02 -8.763992666e-02 -8.763992666e-02 5.04 -8.394805921e-02 -8.394805921e-02 5.06 -8.042367950e-02 -8.042367950e-02 5.08 -7.706230202e-02 -7.706230202e-02 5.10 -7.385862858e-02 -7.385862858e-02 5.12 -7.080659724e-02 -7.080659724e-02 5.14 -6.789953553e-02 -6.789953553e-02 5.16 -6.513037719e-02 -6.513037719e-02 5.18 -6.249190198e-02 -6.249190198e-02 5.20 -5.997696400e-02 -5.997696400e-02 5.22 -5.757868310e-02 -5.757868310e-02 5.24 -5.529058426e-02 -5.529058426e-02 5.26 -5.310667390e-02 -5.310667390e-02 5.28 -5.102141154e-02 -5.102141154e-02 5.30 -4.902982142e-02 -4.902982142e-02 5.32 -4.712738590e-02 -4.712738590e-02 5.34 -4.530993863e-02 -4.530993863e-02 5.36 -4.357357621e-02 -4.357357621e-02 5.38 -4.191457207e-02 -4.191457207e-02 5.40 -4.032930108e-02 -4.032930108e-02 5.42 -3.881418057e-02 -3.881418057e-02 5.44 -3.736563059e-02 -3.736563059e-02 5.46 -3.598005312e-02 -3.598005312e-02 5.48 -3.465382841e-02 -3.465382841e-02 5.50 -3.338332478e-02 -3.338332478e-02 5.52 -3.216491811e-02 -3.216491811e-02 5.54 -3.099501691e-02 -3.099501691e-02 5.56 -2.987008958e-02 -2.987008958e-02 5.58 -2.878669107e-02 -2.878669107e-02 5.60 -2.774148722e-02 -2.774148722e-02 5.62 -2.673127561e-02 -2.673127561e-02 5.64 -2.575300238e-02 -2.575300238e-02 5.66 -2.480377577e-02 -2.480377577e-02 5.68 -2.388087658e-02 -2.388087658e-02 5.70 -2.298176635e-02 -2.298176635e-02 5.72 -2.210409423e-02 -2.210409423e-02 5.74 -2.124570336e-02 -2.124570336e-02 5.76 -2.040463744e-02 -2.040463744e-02 5.78 -1.957914815e-02 -1.957914815e-02 5.80 -1.876770356e-02 -1.876770356e-02 5.82 -1.796899790e-02 -1.796899790e-02 5.84 -1.718196214e-02 -1.718196214e-02 5.86 -1.640577523e-02 -1.640577523e-02 5.88 -1.563987496e-02 -1.563987496e-02 5.90 -1.488396757e-02 -1.488396757e-02 5.92 -1.413803470e-02 -1.413803470e-02 5.94 -1.340232285e-02 -1.340232285e-02 5.96 -1.267728952e-02 -1.267728952e-02 5.98 -1.196374257e-02 -1.196374257e-02 6.00 -1.126275370e-02 -1.126275370e-02