# 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-Sb # implementation = 2026--Park-J-H--Fe-Cu-Sb--LAMMPS--ipr1 # composition = CuSb2 # 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 C1--CaF2--fluori 0.50 nan 0.52 nan 0.54 nan 0.56 nan 0.58 nan 0.60 nan 0.62 nan 0.64 nan 0.66 nan 0.68 nan 0.70 nan 0.72 nan 0.74 nan 0.76 nan 0.78 9.156104077e+01 0.80 8.811791910e+01 0.82 8.476259852e+01 0.84 8.149483778e+01 0.86 7.831424221e+01 0.88 7.522027692e+01 0.90 7.221227931e+01 0.92 6.928947068e+01 0.94 6.645096724e+01 0.96 6.369579027e+01 0.98 6.102287573e+01 1.00 5.843108317e+01 1.02 5.591920405e+01 1.04 5.348596949e+01 1.06 5.113005750e+01 1.08 4.885009970e+01 1.10 4.664468755e+01 1.12 4.451237822e+01 1.14 4.245169992e+01 1.16 4.046115696e+01 1.18 3.853923443e+01 1.20 3.668440245e+01 1.22 3.489512026e+01 1.24 3.316983990e+01 1.26 3.150700963e+01 1.28 2.990507716e+01 1.30 2.836249254e+01 1.32 2.687771091e+01 1.34 2.544919501e+01 1.36 2.407541742e+01 1.38 2.275486274e+01 1.40 2.148602948e+01 1.42 2.026743185e+01 1.44 1.909760133e+01 1.46 1.797508819e+01 1.48 1.689846275e+01 1.50 1.586631659e+01 1.52 1.487726361e+01 1.54 1.392994098e+01 1.56 1.302300996e+01 1.58 1.215515660e+01 1.60 1.132509243e+01 1.62 1.053155494e+01 1.64 9.773308053e+00 1.66 9.049142468e+00 1.68 8.357875972e+00 1.70 7.698353634e+00 1.72 7.069447843e+00 1.74 6.470058751e+00 1.76 5.899114092e+00 1.78 5.355568816e+00 1.80 4.838405455e+00 1.82 4.346633851e+00 1.84 3.879290983e+00 1.86 3.435440757e+00 1.88 3.014173755e+00 1.90 2.614606954e+00 1.92 2.235883417e+00 1.94 1.877171946e+00 1.96 1.537666720e+00 1.98 1.216586908e+00 2.00 9.131762572e-01 2.02 6.267026696e-01 2.04 3.564577578e-01 2.06 1.017563909e-01 2.08 -1.380637732e-01 2.10 -3.636427649e-01 2.12 -5.755987877e-01 2.14 -7.745287101e-01 2.16 -9.610085622e-01 2.18 -1.135594036e+00 2.20 -1.298820986e+00 2.22 -1.451205937e+00 2.24 -1.593246583e+00 2.26 -1.725422291e+00 2.28 -1.848194603e+00 2.30 -1.962007730e+00 2.32 -2.067289048e+00 2.34 -2.164449584e+00 2.36 -2.253884504e+00 2.38 -2.335973586e+00 2.40 -2.411083245e+00 2.42 -2.479634108e+00 2.44 -2.542125544e+00 2.46 -2.598427351e+00 2.48 -2.648948685e+00 2.50 -2.694107384e+00 2.52 -2.734188241e+00 2.54 -2.769464222e+00 2.56 -2.800196869e+00 2.58 -2.826636699e+00 2.60 -2.849023591e+00 2.62 -2.867587165e+00 2.64 -2.882547150e+00 2.66 -2.894113747e+00 2.68 -2.902487974e+00 2.70 -2.907862011e+00 2.72 -2.910419527e+00 2.74 -2.910336005e+00 2.76 -2.907779053e+00 2.78 -2.902908705e+00 2.80 -2.895877718e+00 2.82 -2.886831853e+00 2.84 -2.875910153e+00 2.86 -2.863245207e+00 2.88 -2.848963411e+00 2.90 -2.833185213e+00 2.92 -2.816025357e+00 2.94 -2.797593113e+00 2.96 -2.777992500e+00 2.98 -2.757322505e+00 3.00 -2.735677286e+00 3.02 -2.713146375e+00 3.04 -2.689814870e+00 3.06 -2.665763619e+00 3.08 -2.641069397e+00 3.10 -2.615805074e+00 3.12 -2.590039783e+00 3.14 -2.563839070e+00 3.16 -2.537265049e+00 3.18 -2.510376538e+00 3.20 -2.483229199e+00 3.22 -2.455875667e+00 3.24 -2.428365673e+00 3.26 -2.400746157e+00 3.28 -2.373061385e+00 3.30 -2.345353050e+00 3.32 -2.317660373e+00 3.34 -2.290020193e+00 3.36 -2.262467060e+00 3.38 -2.235033154e+00 3.40 -2.206694554e+00 3.42 -2.166602604e+00 3.44 -2.085300632e+00 3.46 -1.963334950e+00 3.48 -1.932489008e+00 3.50 -1.908841877e+00 3.52 -1.885422434e+00 3.54 -1.862227218e+00 3.56 -1.839251860e+00 3.58 -1.816491218e+00 3.60 -1.793939533e+00 3.62 -1.771590584e+00 3.64 -1.749437848e+00 3.66 -1.727474666e+00 3.68 -1.705694404e+00 3.70 -1.684090609e+00 3.72 -1.662657162e+00 3.74 -1.641388406e+00 3.76 -1.620279274e+00 3.78 -1.599325382e+00 3.80 -1.578523114e+00 3.82 -1.557869671e+00 3.84 -1.537363104e+00 3.86 -1.517002320e+00 3.88 -1.496787058e+00 3.90 -1.476717857e+00 3.92 -1.454459636e+00 3.94 -1.399486162e+00 3.96 -1.220680972e+00 3.98 -7.386021181e-01 4.00 -3.255745720e-22 4.02 0.000000000e+00 4.04 0.000000000e+00 4.06 0.000000000e+00 4.08 0.000000000e+00 4.10 0.000000000e+00 4.12 0.000000000e+00 4.14 0.000000000e+00 4.16 0.000000000e+00 4.18 0.000000000e+00 4.20 0.000000000e+00 4.22 0.000000000e+00 4.24 0.000000000e+00 4.26 0.000000000e+00 4.28 0.000000000e+00 4.30 0.000000000e+00 4.32 0.000000000e+00 4.34 0.000000000e+00 4.36 0.000000000e+00 4.38 0.000000000e+00 4.40 0.000000000e+00 4.42 0.000000000e+00 4.44 0.000000000e+00 4.46 0.000000000e+00 4.48 0.000000000e+00 4.50 0.000000000e+00 4.52 0.000000000e+00 4.54 0.000000000e+00 4.56 0.000000000e+00 4.58 0.000000000e+00 4.60 0.000000000e+00 4.62 0.000000000e+00 4.64 0.000000000e+00 4.66 0.000000000e+00 4.68 0.000000000e+00 4.70 0.000000000e+00 4.72 0.000000000e+00 4.74 0.000000000e+00 4.76 0.000000000e+00 4.78 0.000000000e+00 4.80 0.000000000e+00 4.82 0.000000000e+00 4.84 0.000000000e+00 4.86 0.000000000e+00 4.88 0.000000000e+00 4.90 0.000000000e+00 4.92 0.000000000e+00 4.94 0.000000000e+00 4.96 0.000000000e+00 4.98 0.000000000e+00 5.00 0.000000000e+00 5.02 0.000000000e+00 5.04 0.000000000e+00 5.06 0.000000000e+00 5.08 0.000000000e+00 5.10 0.000000000e+00 5.12 0.000000000e+00 5.14 0.000000000e+00 5.16 0.000000000e+00 5.18 0.000000000e+00 5.20 0.000000000e+00 5.22 0.000000000e+00 5.24 0.000000000e+00 5.26 0.000000000e+00 5.28 0.000000000e+00 5.30 0.000000000e+00 5.32 0.000000000e+00 5.34 0.000000000e+00 5.36 0.000000000e+00 5.38 0.000000000e+00 5.40 0.000000000e+00 5.42 0.000000000e+00 5.44 0.000000000e+00 5.46 0.000000000e+00 5.48 0.000000000e+00 5.50 0.000000000e+00 5.52 0.000000000e+00 5.54 0.000000000e+00 5.56 0.000000000e+00 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 6.00 0.000000000e+00