# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Park-J-H-Jo-H-J-Ahn-H-H-et-al--Fe-Cu-Pb # implementation = 2026--Park-J-H--Fe-Cu-Pb--LAMMPS--ipr1 # composition = CuFePb2 # 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 2026-06-16 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 7.654171269e+02 7.654171269e+02 0.86 7.218520537e+02 7.218520537e+02 0.88 6.806844636e+02 6.806844636e+02 0.90 6.417850315e+02 6.417850315e+02 0.92 6.050313268e+02 6.050313268e+02 0.94 5.703074477e+02 5.703074477e+02 0.96 5.375036755e+02 5.375036755e+02 0.98 5.065161465e+02 5.065161465e+02 1.00 4.772465417e+02 4.772465417e+02 1.02 4.496017929e+02 4.496017929e+02 1.04 4.234938038e+02 4.234938038e+02 1.06 3.988391865e+02 3.988391865e+02 1.08 3.755590116e+02 3.755590116e+02 1.10 3.535785716e+02 3.535785716e+02 1.12 3.328271566e+02 3.328271566e+02 1.14 3.132378425e+02 3.132378425e+02 1.16 2.947472895e+02 2.947472895e+02 1.18 2.772955523e+02 2.772955523e+02 1.20 2.608258993e+02 2.608258993e+02 1.22 2.452846424e+02 2.452846424e+02 1.24 2.306209745e+02 2.306209745e+02 1.26 2.167868157e+02 2.167868157e+02 1.28 2.037366643e+02 2.037366643e+02 1.30 1.914274498e+02 1.914274498e+02 1.32 1.798183784e+02 1.798183784e+02 1.34 1.688707633e+02 1.688707633e+02 1.36 1.585478271e+02 1.585478271e+02 1.38 1.488144768e+02 1.488144768e+02 1.40 1.396370609e+02 1.396370609e+02 1.42 1.309831411e+02 1.309831411e+02 1.44 1.228213276e+02 1.228213276e+02 1.46 1.151212300e+02 1.151212300e+02 1.48 1.078535650e+02 1.078535650e+02 1.50 1.009904318e+02 1.009904318e+02 1.52 9.450571806e+01 9.450571806e+01 1.54 8.837555803e+01 8.837555803e+01 1.56 8.257872518e+01 8.257872518e+01 1.58 7.709684393e+01 7.709684393e+01 1.60 7.191433522e+01 7.191433522e+01 1.62 6.701807852e+01 6.701807852e+01 1.64 6.239684704e+01 6.239684704e+01 1.66 5.804063050e+01 5.804063050e+01 1.68 5.393997732e+01 5.393997732e+01 1.70 5.008546507e+01 5.008546507e+01 1.72 4.646735874e+01 4.646735874e+01 1.74 4.307546295e+01 4.307546295e+01 1.76 3.989913429e+01 3.989913429e+01 1.78 3.692740110e+01 3.692740110e+01 1.80 3.414913697e+01 3.414913697e+01 1.82 3.155324504e+01 3.155324504e+01 1.84 2.912882498e+01 2.912882498e+01 1.86 2.686530769e+01 2.686530769e+01 1.88 2.475255365e+01 2.475255365e+01 1.90 2.278091687e+01 2.278091687e+01 1.92 2.094127966e+01 2.094127966e+01 1.94 1.922506476e+01 1.922506476e+01 1.96 1.762423077e+01 1.762423077e+01 1.98 1.613125632e+01 1.613125632e+01 2.00 1.473911689e+01 1.473911689e+01 2.02 1.344125771e+01 1.344125771e+01 2.04 1.223156469e+01 1.223156469e+01 2.06 1.110433507e+01 1.110433507e+01 2.08 1.005424884e+01 1.005424884e+01 2.10 9.076341260e+00 9.076341260e+00 2.12 8.165977196e+00 8.165977196e+00 2.14 7.318827064e+00 7.318827064e+00 2.16 6.530844651e+00 6.530844651e+00 2.18 5.798246639e+00 5.798246639e+00 2.20 5.117493804e+00 5.117493804e+00 2.22 4.485273732e+00 4.485273732e+00 2.24 3.898484976e+00 3.898484976e+00 2.26 3.354222479e+00 3.354222479e+00 2.28 2.849764204e+00 2.849764204e+00 2.30 2.382558807e+00 2.382558807e+00 2.32 1.950214295e+00 1.950214295e+00 2.34 1.550487547e+00 1.550487547e+00 2.36 1.181274635e+00 1.181274635e+00 2.38 8.406018669e-01 8.406018669e-01 2.40 5.266174763e-01 5.266174763e-01 2.42 2.375839163e-01 2.375839163e-01 2.44 -2.812931281e-02 -2.812931281e-02 2.46 -2.720523283e-01 -2.720523283e-01 2.48 -4.956210871e-01 -4.956210871e-01 2.50 -7.001831791e-01 -7.001831791e-01 2.52 -8.870032455e-01 -8.870032455e-01 2.54 -1.057268037e+00 -1.057268037e+00 2.56 -1.212091148e+00 -1.212091148e+00 2.58 -1.352517451e+00 -1.352517451e+00 2.60 -1.479527243e+00 -1.479527243e+00 2.62 -1.594040141e+00 -1.594040141e+00 2.64 -1.696918731e+00 -1.696918731e+00 2.66 -1.788971994e+00 -1.788971994e+00 2.68 -1.870958517e+00 -1.870958517e+00 2.70 -1.943589521e+00 -1.943589521e+00 2.72 -2.007531692e+00 -2.007531692e+00 2.74 -2.063409851e+00 -2.063409851e+00 2.76 -2.111809461e+00 -2.111809461e+00 2.78 -2.153278984e+00 -2.153278984e+00 2.80 -2.188332100e+00 -2.188332100e+00 2.82 -2.217449793e+00 -2.217449793e+00 2.84 -2.241082314e+00 -2.241082314e+00 2.86 -2.259651027e+00 -2.259651027e+00 2.88 -2.273550150e+00 -2.273550150e+00 2.90 -2.283148389e+00 -2.283148389e+00 2.92 -2.288790482e+00 -2.288790482e+00 2.94 -2.290798643e+00 -2.290798643e+00 2.96 -2.289473932e+00 -2.289473932e+00 2.98 -2.285097540e+00 -2.285097540e+00 3.00 -2.277931996e+00 -2.277931996e+00 3.02 -2.268222304e+00 -2.268222304e+00 3.04 -2.256197022e+00 -2.256197022e+00 3.06 -2.242069263e+00 -2.242069263e+00 3.08 -2.226037652e+00 -2.226037652e+00 3.10 -2.208287212e+00 -2.208287212e+00 3.12 -2.188990213e+00 -2.188990213e+00 3.14 -2.168306958e+00 -2.168306958e+00 3.16 -2.146386529e+00 -2.146386529e+00 3.18 -2.123367491e+00 -2.123367491e+00 3.20 -2.099378547e+00 -2.099378547e+00 3.22 -2.074539158e+00 -2.074539158e+00 3.24 -2.048960130e+00 -2.048960130e+00 3.26 -2.022744158e+00 -2.022744158e+00 3.28 -1.995986342e+00 -1.995986342e+00 3.30 -1.968774672e+00 -1.968774672e+00 3.32 -1.941190485e+00 -1.941190485e+00 3.34 -1.913308886e+00 -1.913308886e+00 3.36 -1.885199157e+00 -1.885199157e+00 3.38 -1.856925195e+00 -1.856925195e+00 3.40 -1.828972119e+00 -1.828972119e+00 3.42 -1.805122664e+00 -1.805122664e+00 3.44 -1.790579052e+00 -1.790579052e+00 3.46 -1.777358373e+00 -1.777358373e+00 3.48 -1.748547010e+00 -1.748547010e+00 3.50 -1.719057477e+00 -1.719057477e+00 3.52 -1.689784189e+00 -1.689784189e+00 3.54 -1.660755709e+00 -1.660755709e+00 3.56 -1.631997778e+00 -1.631997778e+00 3.58 -1.603533505e+00 -1.603533505e+00 3.60 -1.575383538e+00 -1.575383538e+00 3.62 -1.547566228e+00 -1.547566228e+00 3.64 -1.520097781e+00 -1.520097781e+00 3.66 -1.492992399e+00 -1.492992399e+00 3.68 -1.466262410e+00 -1.466262410e+00 3.70 -1.439918393e+00 -1.439918393e+00 3.72 -1.413969291e+00 -1.413969291e+00 3.74 -1.388422513e+00 -1.388422513e+00 3.76 -1.363284037e+00 -1.363284037e+00 3.78 -1.338558498e+00 -1.338558498e+00 3.80 -1.314249270e+00 -1.314249270e+00 3.82 -1.290358548e+00 -1.290358548e+00 3.84 -1.266887418e+00 -1.266887418e+00 3.86 -1.243835921e+00 -1.243835921e+00 3.88 -1.221203121e+00 -1.221203121e+00 3.90 -1.198987161e+00 -1.198987161e+00 3.92 -1.175547552e+00 -1.175547552e+00 3.94 -1.129349003e+00 -1.129349003e+00 3.96 -9.928581521e-01 -9.928581521e-01 3.98 -6.151315845e-01 -6.151315845e-01 4.00 -4.445013027e-22 -4.443657987e-22 4.02 0.000000000e+00 0.000000000e+00 4.04 0.000000000e+00 0.000000000e+00 4.06 0.000000000e+00 0.000000000e+00 4.08 0.000000000e+00 0.000000000e+00 4.10 0.000000000e+00 0.000000000e+00 4.12 0.000000000e+00 0.000000000e+00 4.14 0.000000000e+00 0.000000000e+00 4.16 0.000000000e+00 0.000000000e+00 4.18 0.000000000e+00 0.000000000e+00 4.20 0.000000000e+00 0.000000000e+00 4.22 0.000000000e+00 0.000000000e+00 4.24 0.000000000e+00 0.000000000e+00 4.26 0.000000000e+00 0.000000000e+00 4.28 0.000000000e+00 0.000000000e+00 4.30 0.000000000e+00 0.000000000e+00 4.32 0.000000000e+00 0.000000000e+00 4.34 0.000000000e+00 0.000000000e+00 4.36 0.000000000e+00 0.000000000e+00 4.38 0.000000000e+00 0.000000000e+00 4.40 0.000000000e+00 0.000000000e+00 4.42 0.000000000e+00 0.000000000e+00 4.44 0.000000000e+00 0.000000000e+00 4.46 0.000000000e+00 0.000000000e+00 4.48 0.000000000e+00 0.000000000e+00 4.50 0.000000000e+00 0.000000000e+00 4.52 0.000000000e+00 0.000000000e+00 4.54 0.000000000e+00 0.000000000e+00 4.56 0.000000000e+00 0.000000000e+00 4.58 0.000000000e+00 0.000000000e+00 4.60 0.000000000e+00 0.000000000e+00 4.62 0.000000000e+00 0.000000000e+00 4.64 0.000000000e+00 0.000000000e+00 4.66 0.000000000e+00 0.000000000e+00 4.68 0.000000000e+00 0.000000000e+00 4.70 0.000000000e+00 0.000000000e+00 4.72 0.000000000e+00 0.000000000e+00 4.74 0.000000000e+00 0.000000000e+00 4.76 0.000000000e+00 0.000000000e+00 4.78 0.000000000e+00 0.000000000e+00 4.80 0.000000000e+00 0.000000000e+00 4.82 0.000000000e+00 0.000000000e+00 4.84 0.000000000e+00 0.000000000e+00 4.86 0.000000000e+00 0.000000000e+00 4.88 0.000000000e+00 0.000000000e+00 4.90 0.000000000e+00 0.000000000e+00 4.92 0.000000000e+00 0.000000000e+00 4.94 0.000000000e+00 0.000000000e+00 4.96 0.000000000e+00 0.000000000e+00 4.98 0.000000000e+00 0.000000000e+00 5.00 0.000000000e+00 0.000000000e+00 5.02 0.000000000e+00 0.000000000e+00 5.04 0.000000000e+00 0.000000000e+00 5.06 0.000000000e+00 0.000000000e+00 5.08 0.000000000e+00 0.000000000e+00 5.10 0.000000000e+00 0.000000000e+00 5.12 0.000000000e+00 0.000000000e+00 5.14 0.000000000e+00 0.000000000e+00 5.16 0.000000000e+00 0.000000000e+00 5.18 0.000000000e+00 0.000000000e+00 5.20 0.000000000e+00 0.000000000e+00 5.22 0.000000000e+00 0.000000000e+00 5.24 0.000000000e+00 0.000000000e+00 5.26 0.000000000e+00 0.000000000e+00 5.28 0.000000000e+00 0.000000000e+00 5.30 0.000000000e+00 0.000000000e+00 5.32 0.000000000e+00 0.000000000e+00 5.34 0.000000000e+00 0.000000000e+00 5.36 0.000000000e+00 0.000000000e+00 5.38 0.000000000e+00 0.000000000e+00 5.40 0.000000000e+00 0.000000000e+00 5.42 0.000000000e+00 0.000000000e+00 5.44 0.000000000e+00 0.000000000e+00 5.46 0.000000000e+00 0.000000000e+00 5.48 0.000000000e+00 0.000000000e+00 5.50 0.000000000e+00 0.000000000e+00 5.52 0.000000000e+00 0.000000000e+00 5.54 0.000000000e+00 0.000000000e+00 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