# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2014--Bonny-G-Grigorev-P-Terentyev-D--W-H-He-1 # implementation = 2014--Bonny-G--W-H-He-1--LAMMPS--ipr1 # composition = He # 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 2022-05-24 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 -9.592277590e+00 nan 0.72 nan nan nan nan nan nan nan nan -9.014823605e+00 nan 0.74 nan nan nan nan nan nan nan nan -8.485759946e+00 nan 0.76 nan nan nan nan nan -7.114035165e+00 nan nan -8.006606884e+00 nan 0.78 nan nan nan nan nan -6.766371100e+00 nan nan -7.574589575e+00 nan 0.80 nan nan nan nan nan -6.455357691e+00 nan nan -7.185130490e+00 nan 0.82 nan nan nan nan nan -6.175412818e+00 nan nan -6.833611735e+00 nan 0.84 nan nan nan nan nan -5.917807764e+00 nan nan -6.518154443e+00 nan 0.86 nan -7.752921189e+00 nan -9.810840041e+00 -9.798887500e+00 -5.677417748e+00 nan nan -6.234455344e+00 -7.583413974e+00 0.88 nan -7.399795713e+00 nan -9.363279468e+00 -9.360097207e+00 -5.450206775e+00 -7.376396375e+00 nan -5.977672025e+00 -7.222981431e+00 0.90 nan -7.073091662e+00 nan -8.949018202e+00 -8.954516491e+00 -5.231016564e+00 -7.021511677e+00 nan -5.742780158e+00 -6.902245953e+00 0.92 nan -6.768926514e+00 nan -8.565015982e+00 -8.576823203e+00 -5.016743601e+00 -6.700136292e+00 nan -5.526739014e+00 -6.618642360e+00 0.94 nan -6.484715650e+00 nan -8.205154112e+00 -8.220446070e+00 -4.805374680e+00 -6.413723252e+00 nan -5.325305606e+00 -6.364370295e+00 0.96 nan -6.218243036e+00 nan -7.864683356e+00 -7.880220765e+00 -4.596368776e+00 -6.159615094e+00 nan -5.134852670e+00 -6.132300171e+00 0.98 -7.531536825e+00 -5.967312251e+00 -7.113273966e+00 -7.541309368e+00 -7.553574372e+00 -4.389481163e+00 -5.933483136e+00 -7.236785720e+00 -4.953480485e+00 -5.917408238e+00 1.00 -7.231038339e+00 -5.730813423e+00 -6.806808685e+00 -7.234902073e+00 -7.241276790e+00 -4.184467110e+00 -5.729088001e+00 -6.947110506e+00 -4.779940139e+00 -5.716436266e+00 1.02 -6.947531122e+00 -5.509543661e+00 -6.520376109e+00 -6.945781991e+00 -6.945205688e+00 -3.981465099e+00 -5.541500752e+00 -6.673977916e+00 -4.613092211e+00 -5.526495168e+00 1.04 -6.679894910e+00 -5.303863661e+00 -6.256656448e+00 -6.673571984e+00 -6.666779911e+00 -3.782146440e+00 -5.367014043e+00 -6.416446729e+00 -4.452329533e+00 -5.345952036e+00 1.06 -6.427062714e+00 -5.113914170e+00 -6.017891712e+00 -6.417839706e+00 -6.407255305e+00 -3.588232996e+00 -5.202961926e+00 -6.173669016e+00 -4.297116397e+00 -5.173488008e+00 1.08 -6.188076439e+00 -4.939944908e+00 -5.801457180e+00 -6.177903737e+00 -6.166258611e+00 -3.399231049e+00 -5.047287041e+00 -5.944869445e+00 -4.146698659e+00 -5.008002009e+00 1.10 -5.962458938e+00 -4.781150435e+00 -5.604115845e+00 -5.952916744e+00 -5.942376170e+00 -3.215302636e+00 -4.898761061e+00 -5.729621036e+00 -4.000100113e+00 -4.849354862e+00 1.12 -5.749865803e+00 -4.635565742e+00 -5.423145837e+00 -5.742117665e+00 -5.734210266e+00 -3.037132838e+00 -4.756295329e+00 -5.528330823e+00 -3.856316166e+00 -4.697672864e+00 1.14 -5.549975076e+00 -4.501734757e+00 -5.255825305e+00 -5.545104191e+00 -5.540719133e+00 -2.865406754e+00 -4.619089066e+00 -5.341739650e+00 -3.714442794e+00 -4.553082321e+00 1.16 -5.364109339e+00 -4.378593621e+00 -5.099432399e+00 -5.362756234e+00 -5.361937653e+00 -2.700809480e+00 -4.486413851e+00 -5.170899379e+00 -3.574099789e+00 -4.415703020e+00 1.18 -5.194322827e+00 -4.264987880e+00 -4.951517117e+00 -5.195973055e+00 -5.197896571e+00 -2.544026115e+00 -4.357563960e+00 -5.014819346e+00 -3.435330754e+00 -4.284971794e+00 1.20 -5.039114774e+00 -4.159444801e+00 -4.811097570e+00 -5.042844235e+00 -5.046623078e+00 -2.395752296e+00 -4.232097233e+00 -4.871461924e+00 -3.298549507e+00 -4.159052358e+00 1.22 -4.896567119e+00 -4.060456874e+00 -4.678510337e+00 -4.901423836e+00 -4.906280901e+00 -2.257103116e+00 -4.110111204e+00 -4.738898263e+00 -3.164253109e+00 -4.035969329e+00 1.24 -4.764808081e+00 -3.966516592e+00 -4.554998089e+00 -4.770059722e+00 -4.775311363e+00 -2.129548854e+00 -3.991780513e+00 -4.615643039e+00 -3.032900432e+00 -3.913886173e+00 1.26 -4.642352022e+00 -3.876116446e+00 -4.440247984e+00 -4.647272197e+00 -4.652192371e+00 -2.012966903e+00 -3.876687955e+00 -4.500321810e+00 -2.904500051e+00 -3.792124780e+00 1.28 -4.527905263e+00 -3.787748931e+00 -4.333136742e+00 -4.531727108e+00 -4.535548954e+00 -1.906424214e+00 -3.764267540e+00 -4.391566101e+00 -2.779002177e+00 -3.670582917e+00 1.30 -4.420175515e+00 -3.699983702e+00 -4.232535211e+00 -4.422377973e+00 -4.424580432e+00 -1.808981869e+00 -3.653953274e+00 -4.288239111e+00 -2.656540295e+00 -3.549162527e+00 1.32 -4.317870492e+00 -3.611683944e+00 -4.137389681e+00 -4.318252851e+00 -4.318635209e+00 -1.719776391e+00 -3.545212465e+00 -4.189504898e+00 -2.537510766e+00 -3.427765557e+00 1.34 -4.219697908e+00 -3.522158142e+00 -4.046907774e+00 -4.218379800e+00 -4.217061692e+00 -1.638205636e+00 -3.437824006e+00 -4.094548503e+00 -2.422419905e+00 -3.306293951e+00 1.36 -4.124549590e+00 -3.431112101e+00 -3.960353654e+00 -4.121924967e+00 -4.119300344e+00 -1.563723999e+00 -3.331736949e+00 -4.002669571e+00 -2.311604498e+00 -3.184833770e+00 1.38 -4.032260238e+00 -3.338500250e+00 -3.876991486e+00 -4.028761650e+00 -4.025263063e+00 -1.495785879e+00 -3.226889269e+00 -3.913564546e+00 -2.204844071e+00 -3.064413943e+00 1.40 -3.942965564e+00 -3.244352271e+00 -3.796085433e+00 -3.938988910e+00 -3.935012255e+00 -1.433845672e+00 -3.122856035e+00 -3.827037308e+00 -2.102003503e+00 -2.946364417e+00 1.42 -3.856797952e+00 -3.148697879e+00 -3.716899661e+00 -3.852702440e+00 -3.848606929e+00 -1.377357776e+00 -3.019135993e+00 -3.742889473e+00 -2.002981969e+00 -2.832008342e+00 1.44 -3.773597138e+00 -3.051566788e+00 -3.638698332e+00 -3.769705294e+00 -3.765813449e+00 -1.325776588e+00 -2.915343735e+00 -3.660727559e+00 -1.907678640e+00 -2.722083581e+00 1.46 -3.692692288e+00 -2.952988715e+00 -3.560745613e+00 -3.689289947e+00 -3.685887606e+00 -1.278556506e+00 -2.811385960e+00 -3.579818556e+00 -1.815992692e+00 -2.616306848e+00 1.48 -3.613361234e+00 -2.852993373e+00 -3.482305665e+00 -3.610697547e+00 -3.608033860e+00 -1.235151927e+00 -2.707500027e+00 -3.499510173e+00 -1.727823297e+00 -2.514292198e+00 1.50 -3.534881812e+00 -2.751610477e+00 -3.402642655e+00 -3.533169242e+00 -3.531456672e+00 -1.195017247e+00 -2.603948410e+00 -3.419380016e+00 -1.643069628e+00 -2.415653687e+00 1.52 -3.456617013e+00 -2.648912322e+00 -3.321077518e+00 -3.456010047e+00 -3.455403081e+00 -1.157606865e+00 -2.500993582e+00 -3.339061445e+00 -1.561630860e+00 -2.320047947e+00 1.54 -3.378270458e+00 -2.545141515e+00 -3.237158276e+00 -3.378780449e+00 -3.379290441e+00 -1.122375177e+00 -2.398898018e+00 -3.258301363e+00 -1.483406165e+00 -2.227301928e+00 1.56 -3.299630925e+00 -2.440583244e+00 -3.150489722e+00 -3.301104806e+00 -3.302578686e+00 -1.088776581e+00 -2.297924446e+00 -3.176875058e+00 -1.408297004e+00 -2.137285157e+00 1.58 -3.220487193e+00 -2.335522695e+00 -3.060720619e+00 -3.222618463e+00 -3.224749733e+00 -1.056287459e+00 -2.198380296e+00 -3.094557820e+00 -1.336259656e+00 -2.049867161e+00 1.60 -3.140628041e+00 -2.230245056e+00 -2.968013864e+00 -3.143085303e+00 -3.145542566e+00 -1.024641259e+00 -2.100668442e+00 -3.011124937e+00 -1.267307702e+00 -1.964917469e+00 1.62 -3.059842247e+00 -2.125074173e+00 -2.872865486e+00 -3.062352491e+00 -3.064862735e+00 -9.937379959e-01 -2.005138382e+00 -2.926351697e+00 -1.201476357e+00 -1.882305607e+00 1.64 -2.977918589e+00 -2.020596581e+00 -2.775777130e+00 -2.980268594e+00 -2.982618600e+00 -9.634804932e-01 -1.911876301e+00 -2.840013391e+00 -1.138799368e+00 -1.801901102e+00 1.66 -2.894645846e+00 -1.917298555e+00 -2.677250441e+00 -2.896682182e+00 -2.898718518e+00 -9.337715736e-01 -1.820902367e+00 -2.751885306e+00 -1.079143401e+00 -1.723573482e+00 1.68 -2.809812797e+00 -1.815367324e+00 -2.577787063e+00 -2.811441823e+00 -2.813070849e+00 -9.045140603e-01 -1.732236749e+00 -2.661763620e+00 -1.022280869e+00 -1.647192275e+00 1.70 -2.723208219e+00 -1.715082324e+00 -2.477888644e+00 -2.724396085e+00 -2.725583951e+00 -8.756107762e-01 -1.645899618e+00 -2.569601413e+00 -9.680310864e-01 -1.572627007e+00 1.72 -2.634620891e+00 -1.616776483e+00 -2.378056826e+00 -2.635393537e+00 -2.636166183e+00 -8.469645445e-01 -1.561911143e+00 -2.475424857e+00 -9.162539999e-01 -1.499747206e+00 1.74 -2.543846538e+00 -1.520783575e+00 -2.278788369e+00 -2.544288825e+00 -2.544731112e+00 -8.184781880e-01 -1.480291493e+00 -2.379415055e+00 -8.668108318e-01 -1.428424715e+00 1.76 -2.450955000e+00 -1.427460218e+00 -2.180387146e+00 -2.451176447e+00 -2.451397894e+00 -7.900545300e-01 -1.401060838e+00 -2.282025435e+00 -8.195628049e-01 -1.358622748e+00 1.78 -2.356374592e+00 -1.337192902e+00 -2.082904790e+00 -2.356464566e+00 -2.356554540e+00 -7.615963933e-01 -1.324239347e+00 -2.183737144e+00 -7.743711420e-01 -1.290424011e+00 1.80 -2.260557827e+00 -1.250357907e+00 -1.986375902e+00 -2.260582518e+00 -2.260607209e+00 -7.330066011e-01 -1.249847190e+00 -2.085031332e+00 -7.310970659e-01 -1.223919278e+00 1.82 -2.163957221e+00 -1.167113578e+00 -1.890835086e+00 -2.163959642e+00 -2.163962064e+00 -7.041879763e-01 -1.177904537e+00 -1.986389146e+00 -6.896017994e-01 -1.159199320e+00 1.84 -2.067025287e+00 -1.087430606e+00 -1.796317084e+00 -2.067025287e+00 -2.067025287e+00 -6.750434808e-01 -1.108433498e+00 -1.888291734e+00 -6.497465652e-01 -1.096354911e+00 1.86 -1.970214541e+00 -1.011273550e+00 -1.702925509e+00 -1.970214541e+00 -1.970214541e+00 -6.455449464e-01 -1.041501070e+00 -1.791220245e+00 -6.114136292e-01 -1.035476822e+00 1.88 -1.873977495e+00 -9.386069692e-01 -1.610944025e+00 -1.873977495e+00 -1.873977495e+00 -6.158442585e-01 -9.772192453e-01 -1.695655828e+00 -5.745773189e-01 -9.766558275e-01 1.90 -1.778766666e+00 -8.693954221e-01 -1.520685359e+00 -1.778766666e+00 -1.778766666e+00 -5.861223627e-01 -9.156946024e-01 -1.602079630e+00 -5.392371306e-01 -9.199826992e-01 1.92 -1.685034566e+00 -8.036034681e-01 -1.432462236e+00 -1.685034566e+00 -1.685034566e+00 -5.565602050e-01 -8.569616341e-01 -1.510972800e+00 -5.053925612e-01 -8.655482098e-01 1.94 -1.593233711e+00 -7.411956661e-01 -1.346587382e+00 -1.593233711e+00 -1.593233711e+00 -5.273387310e-01 -8.010141146e-01 -1.422816486e+00 -4.730431077e-01 -8.134431321e-01 1.96 -1.503816614e+00 -6.821365751e-01 -1.263373524e+00 -1.503816614e+00 -1.503816614e+00 -4.986388866e-01 -7.478453577e-01 -1.338021118e+00 -4.421882671e-01 -7.637582386e-01 1.98 -1.417235790e+00 -6.263907541e-01 -1.183133387e+00 -1.417235790e+00 -1.417235790e+00 -4.706416175e-01 -6.974486772e-01 -1.256701900e+00 -4.128275363e-01 -7.165843020e-01 2.00 -1.333943755e+00 -5.739227624e-01 -1.106179698e+00 -1.333943755e+00 -1.333943755e+00 -4.435278699e-01 -6.498173873e-01 -1.178897004e+00 -3.849604126e-01 -6.720120955e-01 2.02 -1.254291901e+00 -5.246845187e-01 -1.032757769e+00 -1.254291901e+00 -1.254291901e+00 -4.174448826e-01 -6.049110948e-01 -1.104616883e+00 -3.585649308e-01 -6.300818313e-01 2.04 -1.178227159e+00 -4.785773842e-01 -9.628432693e-01 -1.178227159e+00 -1.178227159e+00 -3.924050732e-01 -5.625545855e-01 -1.033761120e+00 -3.335753247e-01 -5.906314898e-01 2.06 -1.105595337e+00 -4.354900794e-01 -8.963444544e-01 -1.105595337e+00 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