# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Sharifi-H-Wick-C-D--Cr-Ni-Co # implementation = 2025--Sharifi-H--Cr-Ni-Co--LAMMPS--ipr1 # composition = Cr # 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 2025-07-01 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 nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan nan nan nan nan nan nan 0.74 nan nan nan nan nan nan nan nan nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan 1.070471272e+02 nan nan nan nan 0.80 nan nan nan nan nan 1.002744702e+02 nan nan nan nan 0.82 nan nan nan nan nan 9.391212604e+01 nan nan 1.274935619e+02 nan 0.84 nan nan nan nan nan 8.793593282e+01 nan nan 1.187618644e+02 nan 0.86 nan nan nan nan nan 8.232304417e+01 nan nan 1.105917544e+02 nan 0.88 nan nan nan nan nan 7.705188390e+01 nan nan 1.031313364e+02 nan 0.90 nan 2.256620736e+02 nan nan nan 7.210209390e+01 nan nan 9.638263079e+01 1.372967640e+02 0.92 nan 2.112435627e+02 nan nan nan 6.745448152e+01 1.693845487e+02 nan 9.018153689e+01 1.286344727e+02 0.94 nan 1.978635640e+02 nan nan nan 6.309096796e+01 1.587707798e+02 nan 8.441514015e+01 1.204675057e+02 0.96 nan 1.855073542e+02 nan nan nan 5.899453559e+01 1.487666975e+02 nan 7.900643067e+01 1.127714900e+02 0.98 nan 1.743259024e+02 2.299168499e+02 nan nan 5.514917458e+01 1.393131296e+02 nan 7.390356895e+01 1.055237230e+02 1.00 nan 1.640207932e+02 2.163890238e+02 nan 2.144462288e+02 5.153982828e+01 1.303713182e+02 2.016973660e+02 6.907206056e+01 9.870260278e+01 1.02 2.014894495e+02 1.543717263e+02 2.036546993e+02 2.014843019e+02 2.014791544e+02 4.815233958e+01 1.220187368e+02 1.892302093e+02 6.448910682e+01 9.228729252e+01 1.04 1.892787950e+02 1.452332368e+02 1.916143157e+02 1.892735670e+02 1.892683389e+02 4.497340393e+01 1.142293047e+02 1.776924659e+02 6.013955825e+01 8.625754937e+01 1.06 1.777956798e+02 1.365145107e+02 1.802066991e+02 1.777903705e+02 1.777850612e+02 4.199529690e+01 1.069292758e+02 1.673726694e+02 5.601663572e+01 8.060083108e+01 1.08 1.675711942e+02 1.282309861e+02 1.697625467e+02 1.675658031e+02 1.675604119e+02 3.939684866e+01 1.002522977e+02 1.581917206e+02 5.225572239e+01 7.558382054e+01 1.10 1.585927629e+02 1.203544839e+02 1.602625596e+02 1.585872893e+02 1.585818157e+02 3.717561376e+01 9.416536990e+01 1.499387811e+02 4.885719694e+01 7.120077640e+01 1.12 1.505112978e+02 1.128304558e+02 1.514710196e+02 1.505057411e+02 1.505001845e+02 3.521691911e+01 8.853341155e+01 1.423509496e+02 4.573738744e+01 6.727720895e+01 1.14 1.430748839e+02 1.056260030e+02 1.432216848e+02 1.430692435e+02 1.430636032e+02 3.343842518e+01 8.326054670e+01 1.352427768e+02 4.283647788e+01 6.368682265e+01 1.16 1.361043152e+02 9.872246293e+01 1.353992203e+02 1.360985906e+02 1.360928660e+02 3.178197303e+01 7.827955584e+01 1.284864464e+02 4.011210377e+01 6.033937828e+01 1.18 1.294751915e+02 9.211016901e+01 1.279257202e+02 1.294693821e+02 1.294635727e+02 3.020761426e+01 7.354423545e+01 1.219968174e+02 3.753473678e+01 5.717183426e+01 1.20 1.231039500e+02 8.578476272e+01 1.207503849e+02 1.230980554e+02 1.230921607e+02 2.868895324e+01 6.902357190e+01 1.157198864e+02 3.508419263e+01 5.414142412e+01 1.22 1.169370281e+02 7.974463053e+01 1.138416678e+02 1.169310477e+02 1.169250673e+02 2.720953548e+01 6.469732168e+01 1.096239527e+02 3.274697654e+01 5.122028932e+01 1.24 1.109425253e+02 7.398915565e+01 1.071813512e+02 1.109364588e+02 1.109303923e+02 2.576006966e+01 6.055270117e+01 1.036928863e+02 3.051428382e+01 4.839136072e+01 1.26 1.051038255e+02 6.851758169e+01 1.007601244e+02 1.050976725e+02 1.050915194e+02 2.433630284e+01 5.658192812e+01 9.792105854e+01 2.838050813e+01 4.564520964e+01 1.28 9.941473563e+01 6.332830411e+01 9.457434509e+01 9.940849562e+01 9.940225560e+01 2.293740163e+01 5.278041041e+01 9.230956255e+01 2.634213110e+01 4.297764845e+01 1.30 9.387584640e+01 5.841848376e+01 8.862367555e+01 9.386951914e+01 9.386319188e+01 2.156474068e+01 4.914543832e+01 8.686344197e+01 2.439692012e+01 4.038793421e+01 1.32 8.849183964e+01 5.378391852e+01 8.290939809e+01 8.848542486e+01 8.847901008e+01 2.022100626e+01 4.567526825e+01 8.158969509e+01 2.254336192e+01 3.787743853e+01 1.34 8.326953050e+01 4.941904767e+01 7.743324945e+01 8.326302797e+01 8.325652543e+01 1.890954336e+01 4.236850771e+01 7.649587323e+01 2.078027401e+01 3.544867789e+01 1.36 7.821647485e+01 4.531707283e+01 7.219664456e+01 7.820988437e+01 7.820329390e+01 1.763389619e+01 3.922366405e+01 7.158912903e+01 1.910654912e+01 3.310461443e+01 1.38 7.334001082e+01 4.147006943e+01 6.720019006e+01 7.333333227e+01 7.332665372e+01 1.639749145e+01 3.623888882e+01 6.687559925e+01 1.752095914e+01 3.084819187e+01 1.40 6.864662775e+01 3.786914943e+01 6.244341002e+01 6.863986105e+01 6.863309434e+01 1.520342928e+01 3.341183884e+01 6.236002240e+01 1.602204709e+01 2.868202524e+01 1.42 6.414157369e+01 3.450465496e+01 5.792462508e+01 6.413471881e+01 6.412786392e+01 1.405435412e+01 3.073960806e+01 5.804558432e+01 1.460807677e+01 2.660820163e+01 1.44 5.982861901e+01 3.136634736e+01 5.364094257e+01 5.982167598e+01 5.981473294e+01 1.295237744e+01 2.821870897e+01 5.393387097e+01 1.327701390e+01 2.462815747e+01 1.46 5.571001133e+01 2.844359492e+01 4.958830457e+01 5.570298024e+01 5.569594915e+01 1.189906448e+01 2.584511734e+01 5.002492068e+01 1.202654701e+01 2.274264504e+01 1.48 5.178651073e+01 2.572556465e+01 4.576158987e+01 5.177939174e+01 5.177227275e+01 1.089544781e+01 2.361433773e+01 4.631733160e+01 1.085412359e+01 2.095173349e+01 1.50 4.805746955e+01 2.320136083e+01 4.215474754e+01 4.805026289e+01 4.804305624e+01 9.942055541e+00 2.152147980e+01 4.280840055e+01 9.756984302e+00 1.925484031e+01 1.52 4.452095107e+01 2.086012893e+01 3.876094292e+01 4.451365706e+01 4.450636304e+01 9.038952436e+00 1.956133051e+01 3.949428168e+01 8.732201683e+00 1.765078456e+01 1.54 4.117387170e+01 1.869116372e+01 3.557270651e+01 4.116649069e+01 4.115910968e+01 8.185788823e+00 1.772841509e+01 3.637015319e+01 7.776718580e+00 1.613785327e+01 1.56 3.801215416e+01 1.668397320e+01 3.258207883e+01 3.800468661e+01 3.799721907e+01 7.381852953e+00 1.601710603e+01 3.343038394e+01 6.887374622e+00 1.471388188e+01 1.58 3.503088186e+01 1.482837296e+01 2.978074636e+01 3.502332832e+01 3.501577478e+01 6.626123979e+00 1.442169305e+01 3.066869277e+01 6.060965195e+00 1.337632122e+01 1.60 3.222444940e+01 1.311457172e+01 2.716016649e+01 3.221681049e+01 3.220917157e+01 5.917323652e+00 1.293643994e+01 2.807831690e+01 5.294284565e+00 1.212230103e+01 1.62 2.958670514e+01 1.153321371e+01 2.471167927e+01 2.957898157e+01 2.957125800e+01 5.253965166e+00 1.155564075e+01 2.565214740e+01 4.584155701e+00 1.094869855e+01 1.64 2.711109426e+01 1.007540958e+01 2.242660545e+01 2.710328685e+01 2.709547944e+01 4.634402110e+00 1.027366818e+01 2.338282422e+01 3.927458905e+00 9.852207829e+00 1.66 2.479080952e+01 8.732758949e+00 2.029633091e+01 2.478291917e+01 2.477502883e+01 4.056879931e+00 9.085007339e+00 2.126285401e+01 3.321160285e+00 8.829413026e+00 1.68 2.261885273e+01 7.497340820e+00 1.831238072e+01 2.261088047e+01 2.260290821e+01 3.519557639e+00 7.984266140e+00 1.928469035e+01 2.762306919e+00 7.876817365e+00 1.70 2.058811585e+01 6.361671192e+00 1.646647862e+01 2.058006280e+01 2.057200976e+01 3.020535957e+00 6.966198122e+00 1.744081134e+01 2.248024832e+00 6.990881938e+00 1.72 1.869146440e+01 5.318689124e+00 1.475059516e+01 1.868333182e+01 1.867519923e+01 2.557886258e+00 6.025724740e+00 1.572378935e+01 1.775530591e+00 6.168065915e+00 1.74 1.692180888e+01 4.361777292e+00 1.315698596e+01 1.691359812e+01 1.690538735e+01 2.129675427e+00 5.157949086e+00 1.412634888e+01 1.342143629e+00 5.404860844e+00 1.76 1.527216496e+01 3.484751575e+00 1.167822080e+01 1.526387750e+01 1.525559004e+01 1.733986976e+00 4.358191459e+00 1.264141374e+01 9.452932382e-01 4.697819493e+00 1.78 1.373570318e+01 2.681850545e+00 1.030719444e+01 1.372734065e+01 1.371897812e+01 1.368938645e+00 3.621993436e+00 1.126214432e+01 5.825308851e-01 4.043578181e+00 1.80 1.230578888e+01 1.947746001e+00 9.037120388e+00 1.229735304e+01 1.228891719e+01 1.032696841e+00 2.945101225e+00 9.981965731e+00 2.515406603e-01 3.438867573e+00 1.82 1.097601469e+01 1.277497586e+00 7.861534447e+00 1.096750743e+01 1.095900016e+01 7.234882482e-01 2.323476459e+00 8.794589744e+00 -4.987721052e-02 2.880536206e+00 1.84 9.740225274e+00 6.665063762e-01 6.774298126e+00 9.731648645e+00 9.723072016e+00 4.396089153e-01 1.753302128e+00 7.694015395e+00 -3.238076197e-01 2.365566911e+00 1.86 8.592535333e+00 1.104809524e-01 5.769598747e+00 8.583891543e+00 8.575247754e+00 1.794311439e-01 1.230981694e+00 6.674528569e+00 -5.722201190e-01 1.891084417e+00 1.88 7.527340910e+00 -3.945828309e-01 4.841946753e+00 7.518632329e+00 7.509923748e+00 -5.859186232e-02 7.531359739e-01 5.730737927e+00 -7.969698134e-01 1.454359770e+00 1.90 6.539299097e+00 -8.524224377e-01 3.986170690e+00 6.530528263e+00 6.521757429e+00 -2.759319180e-01 3.165895330e-01 4.857568447e+00 -9.998058701e-01 1.052799095e+00 1.92 5.623335815e+00 -1.266524379e+00 3.197410227e+00 5.614505444e+00 5.605675073e+00 -4.739824458e-01 -8.163375567e-02 4.050258449e+00 -1.182372745e+00 6.839465245e-01 1.94 4.774682996e+00 -1.640134651e+00 2.471107655e+00 4.765795989e+00 4.756908983e+00 -6.540452980e-01 -4.443087336e-01 3.304365148e+00 -1.346203816e+00 3.455019547e-01 1.96 3.988875501e+00 -1.976257608e+00 1.802998191e+00 3.979934954e+00 3.970994407e+00 -8.173310308e-01 -7.740206580e-01 2.615755822e+00 -1.492724853e+00 3.531876856e-02 1.98 3.261743792e+00 -2.277668901e+00 1.189099323e+00 3.252752999e+00 3.243762207e+00 -9.649606374e-01 -1.073174491e+00 1.980594011e+00 -1.623258343e+00 -2.486004703e-01 2.00 2.589405036e+00 -2.546953583e+00 6.256994744e-01 2.580367504e+00 2.571329972e+00 -1.097967844e+00 -1.344003898e+00 1.395310404e+00 -1.739028015e+00 -5.081090186e-01 2.02 1.968253062e+00 -2.786519228e+00 1.093462423e-01 1.959172514e+00 1.950091966e+00 -1.217301850e+00 -1.588588938e+00 8.565786478e-01 -1.841163474e+00 -7.449214614e-01 2.04 1.394943743e+00 -2.998607063e+00 -3.631680991e-01 1.385824130e+00 1.376704518e+00 -1.323831659e+00 -1.808873728e+00 3.612996220e-01 -1.930706675e+00 -9.606214362e-01 2.06 8.663608083e-01 -3.185316981e+00 -7.948338429e-01 8.572063209e-01 8.480518334e-01 -1.418357027e+00 -2.006659218e+00 -9.341960192e-02 -2.008634070e+00 -1.156679087e+00 2.08 3.795884231e-01 -3.348634130e+00 -1.188446305e+00 3.704034968e-01 3.612185705e-01 -1.501617258e+00 -2.183611053e+00 -5.102838284e-01 -2.075858899e+00 -1.334465081e+00 2.10 -6.810287914e-02 -3.490406237e+00 -1.546619117e+00 -7.731355039e-02 -8.652422163e-02 -1.574295701e+00 -2.341277070e+00 -8.918226387e-01 -2.133225043e+00 -1.495257907e+00 2.12 -4.792686647e-01 -3.612348088e+00 -1.871796203e+00 -4.885001188e-01 -4.977315730e-01 -1.637023887e+00 -2.481097076e+00 -1.240390165e+00 -2.181512021e+00 -1.640250325e+00 2.14 -8.563021773e-01 -3.716051062e+00 -2.166262943e+00 -8.655491730e-01 -8.747961687e-01 -1.690385596e+00 -2.604410564e+00 -1.558164658e+00 -2.221439857e+00 -1.770555346e+00 2.16 -1.201445095e+00 -3.802991957e+00 -2.432156559e+00 -1.210702100e+00 -1.219959105e+00 -1.734920935e+00 -2.712463844e+00 -1.847187088e+00 -2.253673571e+00 -1.887211762e+00 2.18 -1.516788367e+00 -3.874540024e+00 -2.671475796e+00 -1.526049546e+00 -1.535310726e+00 -1.771127452e+00 -2.806413590e+00 -2.109370554e+00 -2.278825002e+00 -1.991184692e+00 2.20 -1.804254301e+00 -3.931961140e+00 -2.886089923e+00 -1.813513504e+00 -1.822772708e+00 -1.799455420e+00 -2.887323870e+00 -2.346498791e+00 -2.297449793e+00 -2.083356726e+00 2.22 -2.065641642e+00 -3.976429384e+00 -3.077747155e+00 -2.074892391e+00 -2.084143140e+00 -1.820324614e+00 -2.956183956e+00 -2.560245410e+00 -2.310059989e+00 -2.164550544e+00 2.24 -2.302644516e+00 -4.009035388e+00 -3.248082477e+00 -2.311879991e+00 -2.321115465e+00 -1.834132953e+00 -3.013917182e+00 -2.752184191e+00 -2.317129957e+00 -2.235538450e+00 2.26 -2.516858268e+00 -4.030807425e+00 -3.398624959e+00 -2.526071292e+00 -2.535284317e+00 -1.841261422e+00 -3.061385255e+00 -2.923794778e+00 -2.319098936e+00 -2.297045338e+00 2.28 -2.709784985e+00 -4.042716045e+00 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