# 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 = Sb # 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 A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan 2.401655832e+02 nan nan nan nan 0.68 nan nan nan nan nan 2.310200997e+02 nan nan nan nan 0.70 nan nan nan nan nan 2.222019891e+02 nan nan 3.371688173e+02 nan 0.72 nan nan nan nan nan 2.136999584e+02 nan nan 3.234284616e+02 nan 0.74 nan nan nan nan nan 2.055030948e+02 nan nan 3.102238923e+02 nan 0.76 nan nan nan nan nan 1.976008525e+02 nan nan 2.975346727e+02 nan 0.78 nan 3.360637299e+02 nan nan nan 1.899830413e+02 3.532468207e+02 nan 2.853411296e+02 7.600577535e+01 0.80 nan 3.219530025e+02 nan nan nan 1.826398143e+02 3.397909057e+02 nan 2.736243231e+02 7.250821122e+01 0.82 nan 3.083447955e+02 nan nan nan 1.755616566e+02 3.268233481e+02 nan 2.623660161e+02 6.915142089e+01 0.84 nan 2.952136748e+02 1.187165778e+02 nan nan 1.687393748e+02 3.143267885e+02 nan 2.515486441e+02 6.593009438e+01 0.86 1.333241374e+02 2.825354571e+02 1.136177340e+02 2.123471146e+02 2.913700918e+02 1.621640856e+02 3.022844102e+02 1.303025310e+02 2.411552850e+02 6.283911416e+01 0.88 1.277354449e+02 2.702873667e+02 1.087178873e+02 2.005794570e+02 2.734234692e+02 1.558272062e+02 2.906798971e+02 1.247087269e+02 2.311696299e+02 5.987354838e+01 0.90 1.223611364e+02 2.584481839e+02 1.040096401e+02 1.894695206e+02 2.565779048e+02 1.497204441e+02 2.794973867e+02 1.193339676e+02 2.215759526e+02 5.702864430e+01 0.92 1.171933603e+02 2.469983760e+02 9.948586175e+01 1.789840774e+02 2.407747945e+02 1.438357872e+02 2.687214186e+02 1.141701099e+02 2.123590798e+02 5.429982202e+01 0.94 1.122245436e+02 2.359202031e+02 9.513967886e+01 1.690905581e+02 2.259565726e+02 1.381654949e+02 2.583368792e+02 1.092093009e+02 2.035043613e+02 5.168266834e+01 0.96 1.074473829e+02 2.251977894e+02 9.096446619e+01 1.597572432e+02 2.120671036e+02 1.327020890e+02 2.483289434e+02 1.044439685e+02 1.949976400e+02 4.917293091e+01 0.98 1.028548350e+02 2.148171556e+02 8.695383801e+01 1.509534135e+02 1.990519921e+02 1.274383448e+02 2.386830157e+02 9.986681174e+01 1.868252224e+02 4.676651248e+01 1.00 9.844010728e+01 2.047662082e+02 8.310163957e+01 1.426494631e+02 1.868588188e+02 1.223672829e+02 2.293846730e+02 9.547079132e+01 1.789738495e+02 4.445946549e+01 1.02 9.419664974e+01 1.950346834e+02 7.940193899e+01 1.348169811e+02 1.754373125e+02 1.174821609e+02 2.204196127e+02 9.124912075e+01 1.714306694e+02 4.224798669e+01 1.04 9.011814599e+01 1.856140478e+02 7.584901933e+01 1.274288055e+02 1.647394650e+02 1.127764655e+02 2.117736090e+02 8.719525759e+01 1.641832109e+02 4.012841208e+01 1.06 8.619850533e+01 1.764973575e+02 7.243737101e+01 1.204590527e+02 1.547196000e+02 1.082439050e+02 2.034324828e+02 8.330289501e+01 1.572193590e+02 3.809721195e+01 1.08 8.243185485e+01 1.676790825e+02 6.916168444e+01 1.138831281e+02 1.453344014e+02 1.038784018e+02 1.953820874e+02 7.956595368e+01 1.505273341e+02 3.615098611e+01 1.10 7.881253180e+01 1.591549026e+02 6.601684296e+01 1.076777201e+02 1.365429083e+02 9.967408547e+01 1.876083143e+02 7.597857388e+01 1.440956736e+02 3.428645927e+01 1.12 7.533507629e+01 1.509214827e+02 6.299791600e+01 1.018207807e+02 1.283064852e+02 9.562528552e+01 1.800971214e+02 7.253510786e+01 1.379132178e+02 3.250047663e+01 1.14 7.199422414e+01 1.429762387e+02 6.010015245e+01 9.629149685e+01 1.205887696e+02 9.172652498e+01 1.728345857e+02 6.923011252e+01 1.319691008e+02 3.078999956e+01 1.16 6.878490010e+01 1.353171007e+02 5.731897429e+01 9.107025219e+01 1.133556043e+02 8.797251387e+01 1.658069791e+02 6.605834225e+01 1.262527459e+02 2.915210147e+01 1.18 6.570221117e+01 1.279422837e+02 5.464997044e+01 8.613858455e+01 1.065749579e+02 8.435814292e+01 1.590008688e+02 6.301474205e+01 1.207538662e+02 2.758396382e+01 1.20 6.274144026e+01 1.208500740e+02 5.208889087e+01 8.147913827e+01 1.002168363e+02 8.087847759e+01 1.524032361e+02 6.009444088e+01 1.154624708e+02 2.608287225e+01 1.22 5.989804000e+01 1.140386372e+02 4.963164077e+01 7.707561412e+01 9.425318824e+01 7.752875218e+01 1.460016119e+02 5.729274522e+01 1.103688765e+02 2.464621285e+01 1.24 5.716762679e+01 1.075058528e+02 4.727427511e+01 7.291271767e+01 8.865780854e+01 7.430436422e+01 1.397842222e+02 5.460513288e+01 1.054637242e+02 2.327146858e+01 1.26 5.454597506e+01 1.012491797e+02 4.501299326e+01 6.897610701e+01 8.340623897e+01 7.120086897e+01 1.337401358e+02 5.202724692e+01 1.007379995e+02 2.195621580e+01 1.28 5.202901169e+01 9.526555283e+01 4.284413385e+01 6.525234077e+01 7.847566984e+01 6.821397417e+01 1.278594082e+02 4.955488992e+01 9.618305737e+01 2.069812091e+01 1.30 4.961281067e+01 8.955131239e+01 4.076416978e+01 6.172882675e+01 7.384484282e+01 6.533953488e+01 1.221332120e+02 4.718401828e+01 9.179064899e+01 1.949493714e+01 1.32 4.729358793e+01 8.410216294e+01 3.876970345e+01 5.839377201e+01 6.949395608e+01 6.257354862e+01 1.165539472e+02 4.491073688e+01 8.755295019e+01 1.834450140e+01 1.34 4.506769631e+01 7.891316100e+01 3.685746212e+01 5.523613440e+01 6.540457249e+01 5.991215050e+01 1.111153222e+02 4.273129376e+01 8.346258963e+01 1.724473129e+01 1.36 4.293162076e+01 7.397872715e+01 3.502429343e+01 5.224557606e+01 6.155953137e+01 5.735160865e+01 1.058124019e+02 4.064207510e+01 7.951267562e+01 1.619362222e+01 1.38 4.088197367e+01 6.929267904e+01 3.326716112e+01 4.941241888e+01 5.794286410e+01 5.488831977e+01 1.006416154e+02 3.863960032e+01 7.569681981e+01 1.518924455e+01 1.40 3.891549037e+01 6.484828104e+01 3.158314081e+01 4.672760212e+01 5.453971387e+01 5.251880473e+01 9.560072342e+01 3.672051733e+01 7.200915640e+01 1.422974093e+01 1.42 3.702902479e+01 6.063830658e+01 2.996941607e+01 4.418264221e+01 5.133625962e+01 5.023970447e+01 9.068874290e+01 3.488159797e+01 6.844435537e+01 1.331332369e+01 1.44 3.521954527e+01 5.665510912e+01 2.842327447e+01 4.176959479e+01 4.831964430e+01 4.804777587e+01 8.590583273e+01 3.311973362e+01 6.499762864e+01 1.243827230e+01 1.46 3.348413051e+01 5.289069808e+01 2.694210391e+01 3.948101890e+01 4.547790729e+01 4.593988787e+01 8.125314385e+01 3.143193091e+01 6.166472798e+01 1.160293094e+01 1.48 3.181996565e+01 4.933681684e+01 2.552338894e+01 3.730994335e+01 4.279992105e+01 4.391301755e+01 7.673264066e+01 2.981530760e+01 5.844193423e+01 1.080570620e+01 1.50 3.022433850e+01 4.598501987e+01 2.416470736e+01 3.524983511e+01 4.027533173e+01 4.196424639e+01 7.234690165e+01 2.826708865e+01 5.532603733e+01 1.004506477e+01 1.52 2.869463591e+01 4.282674697e+01 2.286372680e+01 3.329456980e+01 3.789450369e+01 4.009075645e+01 6.809890847e+01 2.678460231e+01 5.231430728e+01 9.319531270e+00 1.54 2.722834027e+01 3.985339297e+01 2.161820152e+01 3.143840401e+01 3.564846775e+01 3.828982644e+01 6.399183261e+01 2.536527649e+01 4.940445650e+01 8.627686158e+00 1.56 2.582302607e+01 3.705637165e+01 2.042596928e+01 2.967594953e+01 3.352887299e+01 3.655882769e+01 6.002882911e+01 2.400663512e+01 4.659459447e+01 7.968163695e+00 1.58 2.447635665e+01 3.442717324e+01 1.928494830e+01 2.800214926e+01 3.152794188e+01 3.489521964e+01 5.621284552e+01 2.270629472e+01 4.388317580e+01 7.339649981e+00 1.60 2.318608104e+01 3.195741484e+01 1.819313440e+01 2.641225481e+01 2.963842858e+01 3.329654487e+01 5.254645296e+01 2.146196108e+01 4.126894327e+01 6.740881072e+00 1.62 2.195003092e+01 2.963888397e+01 1.714859815e+01 2.490180560e+01 2.785358029e+01 3.176042338e+01 4.903170464e+01 2.027142599e+01 3.875086758e+01 6.170641151e+00 1.64 2.076611765e+01 2.746357501e+01 1.614948219e+01 2.346660946e+01 2.616710127e+01 3.028454584e+01 4.567002515e+01 1.913256419e+01 3.632808566e+01 5.627760775e+00 1.66 1.963232942e+01 2.542371915e+01 1.519399862e+01 2.210272454e+01 2.457311965e+01 2.886666587e+01 4.246213180e+01 1.804333034e+01 3.399983945e+01 5.111115180e+00 1.68 1.854672856e+01 2.351180804e+01 1.428042647e+01 2.080644255e+01 2.306615653e+01 2.750459103e+01 3.940798797e+01 1.700175611e+01 3.176541703e+01 4.619622638e+00 1.70 1.750744883e+01 2.172061178e+01 1.340710927e+01 1.957427315e+01 2.164109747e+01 2.619617273e+01 3.650678630e+01 1.600594742e+01 2.962409771e+01 4.152242889e+00 1.72 1.651269289e+01 2.004319170e+01 1.257245274e+01 1.840292948e+01 2.029316607e+01 2.493929527e+01 3.375695888e+01 1.505408170e+01 2.757510265e+01 3.707975614e+00 1.74 1.556072985e+01 1.847290869e+01 1.177492248e+01 1.728931466e+01 1.901789947e+01 2.373186439e+01 3.115621044e+01 1.414440534e+01 2.561755209e+01 3.285858968e+00 1.76 1.464989284e+01 1.700342741e+01 1.101304183e+01 1.623050932e+01 1.781112580e+01 2.257179601e+01 2.870157020e+01 1.327523114e+01 2.375043006e+01 2.884968165e+00 1.78 1.377857679e+01 1.562871719e+01 1.028538976e+01 1.522376001e+01 1.666894322e+01 2.145700596e+01 2.638945785e+01 1.244493587e+01 2.197255709e+01 2.504414117e+00 1.80 1.294523614e+01 1.434304990e+01 9.590598838e+00 1.426646837e+01 1.558770060e+01 2.038540173e+01 2.421575924e+01 1.165195800e+01 2.028257097e+01 2.143342113e+00 1.82 1.214838275e+01 1.314099557e+01 8.927353275e+00 1.335618118e+01 1.456397961e+01 1.935487718e+01 2.217590771e+01 1.089479537e+01 1.867891550e+01 1.800930551e+00 1.84 1.138658379e+01 1.201741587e+01 8.294387039e+00 1.249058101e+01 1.359457823e+01 1.836331124e+01 2.026496750e+01 1.017200305e+01 1.715983664e+01 1.476389719e+00 1.86 1.065845980e+01 1.096745617e+01 7.690482044e+00 1.166747761e+01 1.267649542e+01 1.740857145e+01 1.847771618e+01 9.482191266e+00 1.572338550e+01 1.168960609e+00 1.88 9.962682736e+00 9.986536281e+00 7.114466391e+00 1.088479986e+01 1.180691699e+01 1.648852296e+01 1.680872371e+01 8.824023306e+00 1.436742721e+01 8.779137808e-01 1.90 9.297974131e+00 9.070340327e+00 6.565212677e+00 1.014058834e+01 1.098320254e+01 1.560104322e+01 1.525242631e+01 8.196213629e+00 1.308965479e+01 6.025482687e-01 1.92 8.663103292e+00 8.214805995e+00 6.041636369e+00 9.432988346e+00 1.020287340e+01 1.474404222e+01 1.380319383e+01 7.597525953e+00 1.188760691e+01 3.421905201e-01 1.94 8.056885585e+00 7.416113339e+00 5.542694226e+00 8.760243482e+00 9.463601378e+00 1.391548782e+01 1.245538988e+01 7.026771447e+00 1.075868858e+01 9.619337711e-02 1.96 7.478180769e+00 6.670673381e+00 5.067382789e+00 8.120689623e+00 8.763198476e+00 1.311343502e+01 1.120342431e+01 6.482806973e+00 9.700193847e+00 -1.360649058e-01 1.98 6.925891384e+00 5.975116637e+00 4.614736913e+00 7.512749340e+00 8.099607295e+00 1.233605785e+01 1.004179801e+01 5.964533402e+00 8.709329398e+00 -3.551816106e-01 2.00 6.398961209e+00 5.326281722e+00 4.183828366e+00 6.934926697e+00 7.470892186e+00 1.158168214e+01 8.965140286e+00 5.470893982e+00 7.783238545e+00 -5.617304677e-01 2.02 5.896373759e+00 4.721204124e+00 3.773764460e+00 6.385802399e+00 6.875231039e+00 1.084881720e+01 7.968239136e+00 5.000872767e+00 6.919024676e+00 -7.562625379e-01 2.04 5.417150852e+00 4.157105230e+00 3.383686750e+00 5.864029277e+00 6.310907703e+00 1.013618424e+01 7.046065099e+00 4.553493104e+00 6.113773733e+00 -9.393070600e-01 2.06 4.960351209e+00 3.631381678e+00 3.012769765e+00 5.368328074e+00 5.776304940e+00 9.442739642e+00 6.193789178e+00 4.127816172e+00 5.364575244e+00 -1.111372270e+00 2.08 4.525069118e+00 3.141595085e+00 2.660219792e+00 4.897483518e+00 5.269897917e+00 8.767691159e+00 5.406795578e+00 3.722939573e+00 4.668541589e+00 -1.272946188e+00 2.10 4.110433136e+00 2.685462165e+00 2.325273703e+00 4.450340649e+00 4.790248161e+00 8.110505561e+00 4.680689890e+00 3.337995979e+00 4.022825289e+00 -1.424497381e+00 2.12 3.715604844e+00 2.260845290e+00 2.007197823e+00 4.025801401e+00 4.335997958e+00 7.470906775e+00 4.011303377e+00 2.972151816e+00 3.424634187e+00 -1.566475693e+00 2.14 3.339777640e+00 1.865743486e+00 1.705286836e+00 3.622821400e+00 3.905865159e+00 6.848864100e+00 3.394693987e+00 2.624606013e+00 2.871244503e+00 -1.699312950e+00 2.16 2.982175577e+00 1.498283879e+00 1.418862738e+00 3.240406967e+00 3.498638357e+00 6.244570756e+00 2.827144626e+00 2.294588778e+00 2.360011760e+00 -1.823423643e+00 2.18 2.642052246e+00 1.156713594e+00 1.147273820e+00 2.877612330e+00 3.113172414e+00 5.658413681e+00 2.305159249e+00 1.981360430e+00 1.888379683e+00 -1.939205583e+00 2.20 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