# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Starikov-S-Grigorev-P-Lee-S-H-et-al--W-Mo-Nb-Zr-Ti-Ta # implementation = 2026--Starikov-S--W-Mo-Nb-Zr-Ti-Ta--LAMMPS--ipr1 # composition = W # 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 2025-12-17 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 nan nan nan 1.227966324e+02 nan 0.80 nan nan nan nan nan nan nan nan 1.131069493e+02 nan 0.82 nan nan nan nan nan nan nan nan 1.042605419e+02 nan 0.84 nan nan nan nan nan 8.122139932e+01 nan nan 9.571728100e+01 nan 0.86 nan nan nan nan nan 7.602628472e+01 nan nan 8.929476109e+01 nan 0.88 nan nan nan nan nan 7.084461383e+01 nan nan 8.231803777e+01 nan 0.90 nan nan nan nan nan 6.600046383e+01 nan nan 7.577448304e+01 nan 0.92 nan nan nan nan nan 6.175782110e+01 nan nan 6.966760404e+01 nan 0.94 nan nan nan 1.328477946e+02 1.325294218e+02 5.739529528e+01 nan nan 6.424939014e+01 9.056168831e+01 0.96 nan 8.511442846e+01 nan 1.243100842e+02 1.239805555e+02 5.299386975e+01 8.797396154e+01 nan 5.972880108e+01 8.377491230e+01 0.98 nan 7.890507315e+01 nan 1.160704712e+02 1.161168406e+02 4.919180546e+01 8.077879630e+01 nan 5.593524100e+01 7.731645054e+01 1.00 nan 7.373141678e+01 nan 1.084521025e+02 1.090807917e+02 4.578783053e+01 7.470010286e+01 nan 5.287757528e+01 7.175894406e+01 1.02 nan 6.963987660e+01 nan 1.019227333e+02 1.023885747e+02 4.272140765e+01 6.873140610e+01 nan 4.980760504e+01 6.716427059e+01 1.04 nan 6.537320326e+01 nan 9.600899434e+01 9.641881739e+01 3.992399377e+01 6.370886466e+01 nan 4.691481045e+01 6.314226545e+01 1.06 nan 6.115959050e+01 nan 9.042756367e+01 9.074854291e+01 3.725439934e+01 5.993744527e+01 8.482666548e+01 4.433372439e+01 5.975286233e+01 1.08 8.521989273e+01 5.715737302e+01 7.745324132e+01 8.526603840e+01 8.555946501e+01 3.483952760e+01 5.566496830e+01 8.053545034e+01 4.200364619e+01 5.656702038e+01 1.10 8.026389722e+01 5.346264814e+01 7.298041372e+01 8.014533974e+01 8.020653332e+01 3.268645005e+01 5.279802472e+01 7.689434167e+01 4.013618753e+01 5.324279551e+01 1.12 7.548932531e+01 4.992272958e+01 6.832898309e+01 7.523526902e+01 7.513565960e+01 3.063296546e+01 5.009063946e+01 7.055106152e+01 3.758132220e+01 5.031363230e+01 1.14 7.098856059e+01 4.668003010e+01 6.358891575e+01 7.084160579e+01 7.036315189e+01 2.849035281e+01 4.734795933e+01 6.673818098e+01 3.480615265e+01 4.773598058e+01 1.16 6.670942051e+01 4.330740638e+01 5.919099150e+01 6.641829887e+01 6.593784481e+01 2.637580211e+01 4.490906219e+01 6.330294323e+01 3.266685621e+01 4.514180516e+01 1.18 6.255753932e+01 4.018219686e+01 5.528585421e+01 6.258291876e+01 6.218333731e+01 2.452935827e+01 4.243083384e+01 5.831874815e+01 3.035592049e+01 4.273288724e+01 1.20 5.865952183e+01 3.757488398e+01 5.173340171e+01 5.899378395e+01 5.888081335e+01 2.279540707e+01 4.035024012e+01 5.458109297e+01 2.805034625e+01 4.046251050e+01 1.22 5.507897471e+01 3.541205653e+01 4.864093112e+01 5.546528267e+01 5.548286132e+01 2.118282439e+01 3.835643766e+01 5.095182469e+01 2.603050486e+01 3.822402760e+01 1.24 5.175125058e+01 3.349655547e+01 4.584056785e+01 5.199250393e+01 5.208453926e+01 1.970732505e+01 3.645066527e+01 4.782306532e+01 2.423552659e+01 3.607074677e+01 1.26 4.849487427e+01 3.176079846e+01 4.324915276e+01 4.856467072e+01 4.887150445e+01 1.827565360e+01 3.514918943e+01 4.527663465e+01 2.280778014e+01 3.396407017e+01 1.28 4.528827982e+01 3.002776921e+01 4.093736247e+01 4.551903146e+01 4.598278850e+01 1.685521808e+01 3.397649350e+01 4.312167093e+01 2.139835675e+01 3.176233633e+01 1.30 4.253340179e+01 2.845808900e+01 3.898878805e+01 4.306184686e+01 4.345734105e+01 1.558749764e+01 3.187384798e+01 3.988168880e+01 2.019184178e+01 2.976188766e+01 1.32 4.032857087e+01 2.718944990e+01 3.710185635e+01 4.061971171e+01 4.059067652e+01 1.443014747e+01 2.961537372e+01 3.782389921e+01 1.866578373e+01 2.804617719e+01 1.34 3.841850810e+01 2.599565392e+01 3.518261601e+01 3.837570592e+01 3.827859161e+01 1.324341846e+01 2.824864267e+01 3.659150273e+01 1.701515841e+01 2.645321755e+01 1.36 3.658310129e+01 2.484773628e+01 3.321356912e+01 3.656767157e+01 3.652269906e+01 1.193101526e+01 2.731575409e+01 3.574970732e+01 1.569822557e+01 2.480111149e+01 1.38 3.498573496e+01 2.392348047e+01 3.158925006e+01 3.513910008e+01 3.503353172e+01 1.079914865e+01 2.492695610e+01 3.370738860e+01 1.473626659e+01 2.319185272e+01 1.40 3.371323899e+01 2.296718073e+01 3.021932928e+01 3.389858095e+01 3.368170827e+01 9.831817686e+00 2.262395846e+01 3.198320369e+01 1.392235826e+01 2.167036102e+01 1.42 3.254096390e+01 2.182817440e+01 2.900164087e+01 3.269290806e+01 3.243987480e+01 8.963811321e+00 2.096735938e+01 3.068212746e+01 1.334796823e+01 2.019201897e+01 1.44 3.119764748e+01 2.064649698e+01 2.791647136e+01 3.112830519e+01 3.091413050e+01 8.113274041e+00 1.954806647e+01 2.934728989e+01 1.262868562e+01 1.877918082e+01 1.46 2.975262109e+01 1.953782667e+01 2.691945824e+01 2.977351114e+01 2.968802144e+01 7.299010046e+00 1.819859879e+01 2.799972395e+01 1.184075586e+01 1.750811479e+01 1.48 2.832881932e+01 1.849775352e+01 2.597048545e+01 2.874788484e+01 2.894394152e+01 6.557770821e+00 1.689770521e+01 2.643405028e+01 1.106715531e+01 1.638310016e+01 1.50 2.696704442e+01 1.737388713e+01 2.496153940e+01 2.749839698e+01 2.789962027e+01 5.863814489e+00 1.563743797e+01 2.487276727e+01 1.053681333e+01 1.543088917e+01 1.52 2.552874567e+01 1.619133005e+01 2.379923139e+01 2.603272604e+01 2.644932121e+01 5.167082694e+00 1.456409919e+01 2.369893739e+01 1.012638072e+01 1.458976211e+01 1.54 2.405062069e+01 1.506117348e+01 2.253183446e+01 2.433668023e+01 2.460441784e+01 4.498406941e+00 1.373397636e+01 2.217752864e+01 9.495547784e+00 1.384239330e+01 1.56 2.258698450e+01 1.408767324e+01 2.122857751e+01 2.292566346e+01 2.319617931e+01 3.885361844e+00 1.303180089e+01 2.082738056e+01 8.602675148e+00 1.306626879e+01 1.58 2.129385180e+01 1.329775523e+01 1.999093896e+01 2.178607636e+01 2.210226688e+01 3.367847881e+00 1.252575571e+01 1.992968823e+01 7.763025211e+00 1.228254773e+01 1.60 2.017617063e+01 1.263928057e+01 1.883279859e+01 2.056709733e+01 2.096104957e+01 2.929191668e+00 1.219657494e+01 1.875997068e+01 7.100495571e+00 1.166650140e+01 1.62 1.910950165e+01 1.210384511e+01 1.770700740e+01 1.938759012e+01 1.973817844e+01 2.544498351e+00 1.177328927e+01 1.779143932e+01 6.543894106e+00 1.118368119e+01 1.64 1.819798184e+01 1.158917411e+01 1.660919554e+01 1.844922803e+01 1.863811238e+01 2.194248358e+00 1.119215336e+01 1.729533129e+01 5.827529937e+00 1.083663347e+01 1.66 1.745769746e+01 1.097357878e+01 1.561899793e+01 1.782170158e+01 1.776969819e+01 1.897516614e+00 1.056838187e+01 1.665416548e+01 5.117639794e+00 1.049171545e+01 1.68 1.678706545e+01 1.025232261e+01 1.474659154e+01 1.696993144e+01 1.688257581e+01 1.673950005e+00 1.003744473e+01 1.567998261e+01 4.444044759e+00 1.006055120e+01 1.70 1.613404549e+01 9.502805346e+00 1.389103685e+01 1.613274123e+01 1.613650869e+01 1.460069486e+00 9.692427250e+00 1.477862954e+01 3.819817903e+00 9.548627007e+00 1.72 1.542363716e+01 8.812826302e+00 1.303889670e+01 1.551575092e+01 1.546107906e+01 1.245066047e+00 9.348130418e+00 1.409671425e+01 3.233783683e+00 8.951500291e+00 1.74 1.466165288e+01 8.135442916e+00 1.225738396e+01 1.468656153e+01 1.454284249e+01 1.068328409e+00 8.851093129e+00 1.341037610e+01 2.599545054e+00 8.287926960e+00 1.76 1.391107981e+01 7.439060026e+00 1.155990115e+01 1.387960021e+01 1.366231741e+01 9.212778486e-01 8.258196063e+00 1.280041477e+01 1.979608261e+00 7.576743211e+00 1.78 1.318154838e+01 6.724318660e+00 1.092009673e+01 1.310790418e+01 1.284615322e+01 7.835189685e-01 7.732167510e+00 1.215435201e+01 1.402614500e+00 6.845272060e+00 1.80 1.249610324e+01 6.026152071e+00 1.029583139e+01 1.231377023e+01 1.206163559e+01 6.502013727e-01 7.229820594e+00 1.156726997e+01 8.813587169e-01 6.134840691e+00 1.82 1.190514898e+01 5.373574153e+00 9.670125936e+00 1.170965668e+01 1.145106631e+01 5.060297656e-01 6.684803244e+00 1.106298207e+01 4.154430168e-01 5.474871303e+00 1.84 1.139430950e+01 4.787708705e+00 9.076825248e+00 1.117626608e+01 1.092154383e+01 3.698003888e-01 6.104240719e+00 1.054847812e+01 1.151935108e-02 4.849860453e+00 1.86 1.090789773e+01 4.260003756e+00 8.534561563e+00 1.068785153e+01 1.044160218e+01 2.592257763e-01 5.495959144e+00 9.997392798e+00 -3.150222514e-01 4.224866957e+00 1.88 1.039802642e+01 3.760296616e+00 8.058577793e+00 1.017945699e+01 9.975720687e+00 1.913267403e-01 4.870862048e+00 9.457729839e+00 -5.328690818e-01 3.590145137e+00 1.90 9.880013543e+00 3.269877594e+00 7.659363906e+00 9.810242341e+00 9.678809394e+00 1.754215209e-01 4.258735034e+00 8.915713393e+00 -7.148913926e-01 2.997960288e+00 1.92 9.360925670e+00 2.789678854e+00 7.351786205e+00 9.500644820e+00 9.463264036e+00 2.183304451e-01 3.662247099e+00 8.363902593e+00 -8.547020982e-01 2.464236707e+00 1.94 8.840119481e+00 2.325960454e+00 7.130375476e+00 8.976021361e+00 9.011150029e+00 2.962694815e-01 3.024931426e+00 7.785754292e+00 -9.621760669e-01 1.974800635e+00 1.96 8.294322112e+00 1.884522227e+00 6.912901659e+00 8.490632030e+00 8.600741196e+00 3.674581451e-01 2.371248952e+00 7.243674653e+00 -1.041322777e+00 1.493396022e+00 1.98 7.724605641e+00 1.478097708e+00 6.652244274e+00 7.994740690e+00 8.162548202e+00 4.081556437e-01 1.779098655e+00 6.745006470e+00 -1.113195878e+00 1.021797258e+00 2.00 7.153586602e+00 1.146907324e+00 6.328666025e+00 7.431817231e+00 7.640669308e+00 4.161737948e-01 1.166956901e+00 6.227316886e+00 -1.223021190e+00 5.900068525e-01 2.02 6.591087567e+00 8.529257881e-01 5.962117046e+00 6.820632979e+00 7.030555411e+00 4.110426211e-01 5.401269691e-01 5.610882038e+00 -1.374992707e+00 2.019333972e-01 2.04 6.045232708e+00 5.889882949e-01 5.561121201e+00 6.304380794e+00 6.482717657e+00 3.931027781e-01 -5.302904586e-02 4.957623808e+00 -1.526323444e+00 -1.535624827e-01 2.06 5.492805833e+00 3.185575266e-01 5.095404486e+00 5.918980099e+00 6.088660018e+00 3.369372037e-01 -5.916307737e-01 4.413969194e+00 -1.628781679e+00 -5.141965647e-01 2.08 4.917539029e+00 2.501658897e-02 4.543981386e+00 5.440706321e+00 5.641699252e+00 2.262285661e-01 -1.102227300e+00 3.902906771e+00 -1.757157344e+00 -8.929101261e-01 2.10 4.361492396e+00 -2.802124985e-01 3.945047261e+00 4.863593411e+00 5.093468839e+00 8.137185429e-02 -1.589566242e+00 3.418989192e+00 -1.902290644e+00 -1.246866492e+00 2.12 3.852259821e+00 -5.867862407e-01 3.311776185e+00 4.196853186e+00 4.424225146e+00 -8.723124978e-02 -1.990747000e+00 2.953556354e+00 -2.158545111e+00 -1.560392733e+00 2.14 3.404593632e+00 -1.183865476e+00 2.654922361e+00 3.644884430e+00 3.833958748e+00 -2.696900355e-01 -2.306426253e+00 2.521675381e+00 -2.612755013e+00 -1.833318015e+00 2.16 3.008384745e+00 -2.039950256e+00 1.990140394e+00 3.163888469e+00 3.295407089e+00 -6.927284477e-01 -2.582436291e+00 2.086184505e+00 -3.002542534e+00 -2.071611769e+00 2.18 2.611243625e+00 -2.891535859e+00 1.320668494e+00 2.676122909e+00 2.737881733e+00 -1.168277971e+00 -2.881891285e+00 1.667555278e+00 -3.343733180e+00 -2.288316142e+00 2.20 2.144359356e+00 -3.766621419e+00 6.455717840e-01 2.149412929e+00 2.146846704e+00 -1.639883108e+00 -3.171572859e+00 1.200740240e+00 -3.660042409e+00 -2.502175147e+00 2.22 1.656614445e+00 -4.580794769e+00 3.833103119e-02 1.654843881e+00 1.604118015e+00 -2.072715852e+00 -3.400583800e+00 8.139235507e-01 -3.966176077e+00 -2.678594638e+00 2.24 1.209729834e+00 -5.319965128e+00 -4.558553250e-01 1.258813967e+00 1.180889293e+00 -2.474151273e+00 -3.535832970e+00 6.005098613e-01 -4.256484691e+00 -2.801707347e+00 2.26 8.052392087e-01 -5.959384903e+00 -8.470793793e-01 9.648894346e-01 8.811915104e-01 -2.874683967e+00 -3.583698729e+00 2.893074205e-01 -4.484921279e+00 -2.888458730e+00 2.28 4.497635549e-01 -6.493122873e+00 -1.158615894e+00 6.086242600e-01 5.343611355e-01 -3.265079942e+00 -3.747179474e+00 -9.860996645e-02 -4.660766686e+00 -3.023264956e+00 2.30 1.451051292e-01 -6.932296264e+00 -1.427605549e+00 1.489718143e-01 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