# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1987--Ackland-G-J-Thetford-R--W # implementation = 1987--Ackland-G-J--W--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 6.027169039e+03 nan 0.62 nan nan nan nan nan nan nan nan 5.402876595e+03 nan 0.64 nan nan nan nan nan nan nan nan 4.855391525e+03 nan 0.66 nan nan nan nan nan 3.750863930e+03 nan nan 4.373667815e+03 nan 0.68 nan nan nan nan nan 3.384070013e+03 nan nan 3.948463237e+03 nan 0.70 nan nan nan nan nan 3.058916857e+03 nan nan 3.571869292e+03 nan 0.72 nan nan nan nan nan 2.770039550e+03 nan nan 3.237351999e+03 nan 0.74 nan nan nan 6.056342036e+03 6.056477054e+03 2.513191158e+03 nan nan 2.939360242e+03 nan 0.76 nan 3.734985638e+03 nan 5.539587976e+03 5.539620069e+03 2.284342510e+03 3.801921129e+03 nan 2.672945793e+03 3.746366531e+03 0.78 nan 3.410537397e+03 nan 5.075572803e+03 5.075504492e+03 2.079527951e+03 3.472692803e+03 nan 2.433962054e+03 3.422506783e+03 0.80 nan 3.118800622e+03 nan 4.657693736e+03 4.657521179e+03 1.895796442e+03 3.176843148e+03 nan 2.219180576e+03 3.131392412e+03 0.82 nan 2.855708580e+03 nan 4.280385015e+03 4.280250909e+03 1.730399825e+03 2.910393438e+03 nan 2.025839724e+03 2.868621103e+03 0.84 3.939020434e+03 2.618099125e+03 3.569099573e+03 3.939040920e+03 3.939047333e+03 1.581142601e+03 2.669553498e+03 3.679057454e+03 1.851375893e+03 2.630910283e+03 0.86 3.629234558e+03 2.402802231e+03 3.285519932e+03 3.629502207e+03 3.629653248e+03 1.446281945e+03 2.451293581e+03 3.387657411e+03 1.693617725e+03 2.415644081e+03 0.88 3.347621779e+03 2.207503236e+03 3.027912512e+03 3.348107065e+03 3.348351267e+03 1.324276075e+03 2.253221625e+03 3.123072539e+03 1.550781546e+03 2.220602579e+03 0.90 3.091579149e+03 2.030216358e+03 2.793502491e+03 3.091950774e+03 3.092182446e+03 1.213753888e+03 2.073104395e+03 2.882515701e+03 1.421211886e+03 2.043293547e+03 0.92 2.858409949e+03 1.868724609e+03 2.579826519e+03 2.858404649e+03 2.858537545e+03 1.113313036e+03 1.909087863e+03 2.663290185e+03 1.303594157e+03 1.881774818e+03 0.94 2.645333571e+03 1.721407461e+03 2.385011098e+03 2.645107056e+03 2.645113679e+03 1.021924907e+03 1.759531235e+03 2.463034777e+03 1.196638944e+03 1.734294689e+03 0.96 2.450300250e+03 1.586915105e+03 2.207245249e+03 2.450025422e+03 2.449932065e+03 9.387617044e+02 1.622896428e+03 2.279834986e+03 1.099280691e+03 1.599493398e+03 0.98 2.271514133e+03 1.463958429e+03 2.044301117e+03 2.271261916e+03 2.271086967e+03 8.628556114e+02 1.497692775e+03 2.111960355e+03 1.010459149e+03 1.476227322e+03 1.00 2.107376152e+03 1.351189229e+03 1.894648764e+03 2.107182135e+03 2.106954575e+03 7.934893897e+02 1.382879852e+03 1.957811733e+03 9.293322257e+02 1.363396834e+03 1.02 1.956420549e+03 1.247609645e+03 1.756972839e+03 1.956369824e+03 1.956154707e+03 7.299909717e+02 1.277581770e+03 1.816109340e+03 8.551788802e+02 1.259976983e+03 1.04 1.817490795e+03 1.152432938e+03 1.630141173e+03 1.817554092e+03 1.817440187e+03 6.718073886e+02 1.180936593e+03 1.685724463e+03 7.872528378e+02 1.165177257e+03 1.06 1.689363411e+03 1.064991176e+03 1.513204646e+03 1.689559810e+03 1.689619416e+03 6.184984953e+02 1.092198865e+03 1.565550459e+03 7.249024126e+02 1.078090907e+03 1.08 1.571172838e+03 9.845449977e+02 1.405363690e+03 1.571391203e+03 1.571572654e+03 5.696857249e+02 1.010598390e+03 1.454690091e+03 6.676133582e+02 9.980873997e+02 1.10 1.462052063e+03 9.104055404e+02 1.305834335e+03 1.462196494e+03 1.462437058e+03 5.249937278e+02 9.355297343e+02 1.352278435e+03 6.149377835e+02 9.245239276e+02 1.12 1.360999768e+03 8.420112950e+02 1.213738535e+03 1.361123760e+03 1.361393412e+03 4.840040762e+02 8.664243823e+02 1.257489057e+03 5.664377879e+02 8.566446139e+02 1.14 1.267344734e+03 7.789398752e+02 1.128509209e+03 1.267505515e+03 1.267769398e+03 4.464585524e+02 8.027623205e+02 1.169713442e+03 5.217411635e+02 7.939651078e+02 1.16 1.180514605e+03 7.207983704e+02 1.049623648e+03 1.180677275e+03 1.180893055e+03 4.121019608e+02 7.439929233e+02 1.088432050e+03 4.805006719e+02 7.360385357e+02 1.18 1.099959078e+03 6.671442613e+02 9.764413238e+02 1.100104824e+03 1.100251116e+03 3.805177209e+02 6.896303549e+02 1.013167322e+03 4.424526638e+02 6.823701141e+02 1.20 1.025226941e+03 6.176292999e+02 9.085090082e+02 1.025343901e+03 1.025405339e+03 3.514498560e+02 6.392986085e+02 9.434699063e+02 4.073803671e+02 6.325893457e+02 1.22 9.559444998e+02 5.718552504e+02 8.454648687e+02 9.559902916e+02 9.559533751e+02 3.246941327e+02 5.926351974e+02 8.788672259e+02 3.750712054e+02 5.863701142e+02 1.24 8.917405443e+02 5.294161709e+02 7.870091986e+02 8.916430927e+02 8.915043095e+02 3.000767096e+02 5.493328728e+02 8.188776516e+02 3.452552904e+02 5.434229411e+02 1.26 8.319878571e+02 4.900321855e+02 7.328693545e+02 8.317952624e+02 8.316014427e+02 2.774339769e+02 5.091277857e+02 7.630670708e+02 3.177206792e+02 5.035067215e+02 1.28 7.763208560e+02 4.534580259e+02 6.826861772e+02 7.760906152e+02 7.758769531e+02 2.566211950e+02 4.717761385e+02 7.111235478e+02 2.922815180e+02 4.664127559e+02 1.30 7.244417093e+02 4.194742150e+02 6.361163187e+02 7.242162573e+02 7.239978691e+02 2.375049136e+02 4.370367965e+02 6.627678607e+02 2.687802274e+02 4.319646560e+02 1.32 6.760765668e+02 3.878855859e+02 5.927776322e+02 6.758736182e+02 6.756714390e+02 2.198958591e+02 4.046730164e+02 6.177162109e+02 2.470986899e+02 4.000125430e+02 1.34 6.309660091e+02 3.585237310e+02 5.523869152e+02 6.308018631e+02 6.306419871e+02 2.036529439e+02 3.745081023e+02 5.756995083e+02 2.271239098e+02 3.703908369e+02 1.36 5.888382951e+02 3.312356011e+02 5.147135249e+02 5.887432177e+02 5.886568625e+02 1.886627307e+02 3.463894767e+02 5.365061219e+02 2.087134274e+02 3.428311639e+02 1.38 5.494763848e+02 3.058848322e+02 4.795498495e+02 5.494759070e+02 5.494873637e+02 1.748268100e+02 3.201833286e+02 4.999477085e+02 1.917317414e+02 3.171865008e+02 1.40 5.126933717e+02 2.823437801e+02 4.467062814e+02 5.127809321e+02 5.128788831e+02 1.620523029e+02 2.957768604e+02 4.658225425e+02 1.760801340e+02 2.933394025e+02 1.42 4.783338013e+02 2.604758539e+02 4.160035249e+02 4.784891174e+02 4.786514447e+02 1.502462598e+02 2.730703907e+02 4.339533621e+02 1.616393941e+02 2.711977513e+02 1.44 4.462571319e+02 2.401332056e+02 3.872484632e+02 4.464520279e+02 4.466494497e+02 1.392945205e+02 2.519382312e+02 4.042005479e+02 1.483197553e+02 2.506780138e+02 1.46 4.163315953e+02 2.211834844e+02 3.602923663e+02 4.165315017e+02 4.167282770e+02 1.291176549e+02 2.322905736e+02 3.764207012e+02 1.360407084e+02 2.317001455e+02 1.48 3.883199951e+02 2.035044176e+02 3.350111251e+02 3.885129146e+02 3.886968758e+02 1.196506689e+02 2.140595870e+02 3.504152788e+02 1.247244435e+02 2.140738864e+02 1.50 3.620627679e+02 1.870000112e+02 3.112990885e+02 3.622408079e+02 3.624074790e+02 1.108394277e+02 1.971553395e+02 3.260515607e+02 1.142746786e+02 1.976819882e+02 1.52 3.374373813e+02 1.715900909e+02 2.890525853e+02 3.375924859e+02 3.377377460e+02 1.026287897e+02 1.814674017e+02 3.032159474e+02 1.046191964e+02 1.824397693e+02 1.54 3.143310865e+02 1.572018435e+02 2.681775151e+02 3.144568750e+02 3.145770550e+02 9.496813304e+01 1.669208317e+02 2.818061278e+02 9.569671014e+01 1.682680129e+02 1.56 2.926414108e+02 1.437711927e+02 2.485901059e+02 2.927350079e+02 2.928268444e+02 8.781208646e+01 1.534489939e+02 2.617325701e+02 8.745111387e+01 1.550936664e+02 1.58 2.722773092e+02 1.312446568e+02 2.302229721e+02 2.723356169e+02 2.723954764e+02 8.112950307e+01 1.409424099e+02 2.429167290e+02 7.982956430e+01 1.428532126e+02 1.60 2.531576157e+02 1.195732570e+02 2.130152965e+02 2.531774610e+02 2.532015942e+02 7.488933528e+01 1.293259410e+02 2.252597795e+02 7.278331024e+01 1.314873048e+02 1.62 2.352156092e+02 1.087141469e+02 1.969128200e+02 2.351933903e+02 2.351775770e+02 6.906077302e+01 1.185410733e+02 2.086821616e+02 6.626755126e+01 1.209422744e+02 1.64 2.183747410e+02 9.862401066e+01 1.818574413e+02 2.183119596e+02 2.182563746e+02 6.361745044e+01 1.085345906e+02 1.931193946e+02 6.024234428e+01 1.111601141e+02 1.66 2.025283901e+02 8.924871003e+01 1.677752998e+02 2.024422324e+02 2.023610274e+02 5.853733954e+01 9.925632832e+01 1.785018991e+02 5.467373213e+01 1.020687018e+02 1.68 1.876202020e+02 8.055427542e+01 1.546258658e+02 1.875307207e+02 1.874423128e+02 5.380265112e+01 9.065947590e+01 1.647797101e+02 4.953336845e+01 9.361861629e+01 1.70 1.736063885e+02 7.251019560e+01 1.423769948e+02 1.735343696e+02 1.734607961e+02 4.939999305e+01 8.269554051e+01 1.519050670e+02 4.478363768e+01 8.576467027e+01 1.72 1.604369198e+02 6.509038452e+01 1.309281367e+02 1.603894417e+02 1.603391658e+02 4.528194904e+01 7.530853533e+01 1.398333116e+02 4.039079793e+01 7.846479245e+01 1.74 1.480662282e+02 5.827253303e+01 1.201990391e+02 1.480407803e+02 1.480127576e+02 4.140984460e+01 6.845829588e+01 1.285247119e+02 3.632857483e+01 7.167993133e+01 1.76 1.364533447e+02 5.199987959e+01 1.101500167e+02 1.364471351e+02 1.364397493e+02 3.776876549e+01 6.210877847e+01 1.179443761e+02 3.257038753e+01 6.537396521e+01 1.78 1.255618185e+02 4.622496081e+01 1.007493384e+02 1.255728362e+02 1.255836109e+02 3.434938767e+01 5.622571266e+01 1.080637155e+02 2.909428002e+01 5.951361848e+01 1.80 1.153596881e+02 4.092281481e+01 9.196184009e+01 1.153850469e+02 1.154104058e+02 3.113948925e+01 5.077558539e+01 9.885896529e+01 2.588046475e+01 5.406856061e+01 1.82 1.058212616e+02 3.606018300e+01 8.375392898e+01 1.058562889e+02 1.058913163e+02 2.812763501e+01 4.572706761e+01 9.029529223e+01 2.291029721e+01 4.901812211e+01 1.84 9.692433252e+01 3.159530060e+01 7.609435833e+01 9.696253365e+01 9.700073477e+01 2.530377024e+01 4.105094065e+01 8.232805589e+01 2.015888085e+01 4.434127653e+01 1.86 8.864995902e+01 2.750292143e+01 6.895417462e+01 8.868338787e+01 8.871681671e+01 2.265920579e+01 3.672002699e+01 7.493574267e+01 1.761143863e+01 4.001599828e+01 1.88 8.098173076e+01 2.375937240e+01 6.230666672e+01 8.100227872e+01 8.102282669e+01 2.018660374e+01 3.270913679e+01 6.805644317e+01 1.525459083e+01 3.602220831e+01 1.90 7.383874794e+01 2.033834662e+01 5.612731728e+01 7.384510436e+01 7.385146077e+01 1.787996356e+01 2.899569859e+01 6.163998019e+01 1.307745888e+01 3.231939268e+01 1.92 6.716048982e+01 1.721545430e+01 5.039437115e+01 6.715567177e+01 6.715085371e+01 1.573552872e+01 2.556010269e+01 5.565907773e+01 1.107130164e+01 2.887485373e+01 1.94 6.091939334e+01 1.437169700e+01 4.508922002e+01 6.090688991e+01 6.089438648e+01 1.375242789e+01 2.238677143e+01 5.008770974e+01 9.226880417e+00 2.566786763e+01 1.96 5.508953672e+01 1.178949649e+01 4.019386677e+01 5.507339615e+01 5.505725559e+01 1.192893487e+01 1.946028684e+01 4.490143310e+01 7.536353362e+00 2.267968345e+01 1.98 4.964871338e+01 9.450054593e+00 3.569225782e+01 4.963322884e+01 4.961774430e+01 1.026450068e+01 1.676579204e+01 4.008013115e+01 5.993453004e+00 1.989646874e+01 2.00 4.458097153e+01 7.337041728e+00 3.156485832e+01 4.456906560e+01 4.455715966e+01 8.754395975e+00 1.428390277e+01 3.560567283e+01 4.592216800e+00 1.731178075e+01 2.02 3.986594228e+01 5.433359586e+00 2.776194841e+01 3.985794996e+01 3.984995763e+01 7.363033489e+00 1.199312229e+01 3.145824337e+01 3.313719149e+00 1.491344682e+01 2.04 3.548364686e+01 3.722583082e+00 2.425809853e+01 3.547942895e+01 3.547521105e+01 6.078468192e+00 9.882100378e+00 2.761887417e+01 2.145832960e+00 1.268945109e+01 2.06 3.141512211e+01 2.189126863e+00 2.103430434e+01 3.141452884e+01 3.141393556e+01 4.894555801e+00 7.940698569e+00 2.406963933e+01 1.081909530e+00 1.062871709e+01 2.08 2.764239321e+01 8.182134765e-01 1.807238279e+01 2.764526348e+01 2.764813375e+01 3.805371152e+00 6.157620951e+00 2.079362813e+01 1.160146648e-01 8.721093962e+00 2.10 2.414844755e+01 -4.041568211e-01 1.535494148e+01 2.415460826e+01 2.416076897e+01 2.805198608e+00 4.523028464e+00 1.777491876e+01 -7.570848561e-01 6.957343154e+00 2.12 2.091720976e+01 -1.491234670e+00 1.286534958e+01 2.092647505e+01 2.093574033e+01 1.888522888e+00 3.030011742e+00 1.499855325e+01 -1.541934228e+00 5.329125747e+00 2.14 1.793351783e+01 -2.455548661e+00 1.058771034e+01 1.794568833e+01 1.795785883e+01 1.050020330e+00 1.673123780e+00 1.245062674e+01 -2.242403000e+00 3.828990221e+00 2.16 1.518310027e+01 -3.308930867e+00 8.506835300e+00 1.519796242e+01 1.521282457e+01 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