# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--W # implementation = 2004--Zhou-X-W--W--LAMMPS--ipr2 # NOTE: These values only provide a look at the purely pair interaction # of the potential and therefore exclude multi-body interactions. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-05-24 r W W 0.02 3.020583785e+04 0.04 1.510149907e+04 0.06 1.006671948e+04 0.08 7.549329681e+03 0.10 6.038895803e+03 0.12 5.031939884e+03 0.14 4.312685657e+03 0.16 3.773244986e+03 0.18 3.353680020e+03 0.20 3.018028047e+03 0.22 2.743403705e+03 0.24 2.514550088e+03 0.26 2.320904719e+03 0.28 2.154922974e+03 0.30 2.011072128e+03 0.32 1.885202638e+03 0.34 1.774141324e+03 0.36 1.675420155e+03 0.38 1.587090689e+03 0.40 1.507594169e+03 0.42 1.435668746e+03 0.44 1.370281998e+03 0.46 1.310581054e+03 0.48 1.255855189e+03 0.50 1.205287351e+03 0.52 1.127159884e+03 0.54 1.053796825e+03 0.56 9.851031076e+02 0.58 9.207834953e+02 0.60 8.605613704e+02 0.62 8.041775624e+02 0.64 7.513892492e+02 0.66 7.019689267e+02 0.68 6.557034441e+02 0.70 6.123930998e+02 0.72 5.718507937e+02 0.74 5.339012333e+02 0.76 4.983801901e+02 0.78 4.651338017e+02 0.80 4.340179191e+02 0.82 4.048974945e+02 0.84 3.776460074e+02 0.86 3.521449274e+02 0.88 3.282832103e+02 0.90 3.059568265e+02 0.92 2.850683185e+02 0.94 2.655263865e+02 0.96 2.472455006e+02 0.98 2.301455365e+02 1.00 2.141514345e+02 1.02 1.991928808e+02 1.04 1.852040074e+02 1.06 1.721231121e+02 1.08 1.598923954e+02 1.10 1.484577148e+02 1.12 1.377683533e+02 1.14 1.277768039e+02 1.16 1.184385669e+02 1.18 1.097119597e+02 1.20 1.015579394e+02 1.22 9.393993606e+01 1.24 8.682369644e+01 1.26 8.017713786e+01 1.28 7.397021109e+01 1.30 6.817483756e+01 1.32 6.276519568e+01 1.34 5.771627610e+01 1.36 5.300447215e+01 1.38 4.860771548e+01 1.40 4.450537519e+01 1.42 4.067816378e+01 1.44 3.710804928e+01 1.46 3.377817323e+01 1.48 3.067287067e+01 1.50 2.777866763e+01 1.52 2.508358879e+01 1.54 2.257619312e+01 1.56 2.024555067e+01 1.58 1.808123496e+01 1.60 1.607331323e+01 1.62 1.421233502e+01 1.64 1.248931933e+01 1.66 1.089574080e+01 1.68 9.423514965e+00 1.70 8.064983008e+00 1.72 6.812896085e+00 1.74 5.660399421e+00 1.76 4.601016318e+00 1.78 3.628632192e+00 1.80 2.737478734e+00 1.82 1.922118284e+00 1.84 1.177428479e+00 1.86 4.985872416e-01 1.88 -1.189418544e-01 1.90 -6.794238050e-01 1.92 -1.186865951e+00 1.94 -1.645031292e+00 1.96 -2.057451328e+00 1.98 -2.427438409e+00 2.00 -2.758097600e+00 2.02 -3.052338059e+00 2.04 -3.312883924e+00 2.06 -3.542284722e+00 2.08 -3.742925305e+00 2.10 -3.917035322e+00 2.12 -4.066698244e+00 2.14 -4.193859937e+00 2.16 -4.300336825e+00 2.18 -4.387823628e+00 2.20 -4.457900705e+00 2.22 -4.512041016e+00 2.24 -4.551616709e+00 2.26 -4.577905360e+00 2.28 -4.592095865e+00 2.30 -4.595294008e+00 2.32 -4.588527724e+00 2.34 -4.572752051e+00 2.36 -4.548853806e+00 2.38 -4.517655983e+00 2.40 -4.479921888e+00 2.42 -4.436359030e+00 2.44 -4.387622760e+00 2.46 -4.334319686e+00 2.48 -4.277010863e+00 2.50 -4.216214762e+00 2.52 -4.152410033e+00 2.54 -4.086038051e+00 2.56 -4.017505273e+00 2.58 -3.947185373e+00 2.60 -3.875421185e+00 2.62 -3.802526432e+00 2.64 -3.728787251e+00 2.66 -3.654463493e+00 2.68 -3.579789808e+00 2.70 -3.504976497e+00 2.72 -3.430210130e+00 2.74 -3.355653936e+00 2.76 -3.281447956e+00 2.78 -3.207708983e+00 2.80 -3.134530310e+00 2.82 -3.061981333e+00 2.84 -2.990107070e+00 2.86 -2.918927690e+00 2.88 -2.848438159e+00 2.90 -2.778608155e+00 2.92 -2.709382397e+00 2.94 -2.640681547e+00 2.96 -2.572403846e+00 2.98 -2.504427573e+00 3.00 -2.436614381e+00 3.02 -2.368813467e+00 3.04 -2.300866455e+00 3.06 -2.232612756e+00 3.08 -2.163895149e+00 3.10 -2.094565283e+00 3.12 -2.024488864e+00 3.14 -1.953550357e+00 3.16 -1.881657186e+00 3.18 -1.808743524e+00 3.20 -1.734773876e+00 3.22 -1.659746674e+00 3.24 -1.583698107e+00 3.26 -1.506706222e+00 3.28 -1.428895198e+00 3.30 -1.350439419e+00 3.32 -1.271566759e+00 3.34 -1.192560287e+00 3.36 -1.113757540e+00 3.38 -1.035546531e+00 3.40 -9.583579192e-01 3.42 -8.826531307e-01 3.44 -8.089087554e-01 3.46 -7.375980979e-01 3.48 -6.691712751e-01 3.50 -6.040355904e-01 3.52 -5.425380014e-01 3.54 -4.849513044e-01 3.56 -4.314652005e-01 3.58 -3.821828049e-01 3.60 -3.371224897e-01 3.62 -2.962243878e-01 3.64 -2.593604632e-01 3.66 -2.263468628e-01 3.68 -1.969572668e-01 3.70 -1.709360967e-01 3.72 -1.480107132e-01 3.74 -1.279020740e-01 3.76 -1.103334838e-01 3.78 -9.503463972e-02 3.80 -8.175124821e-02 3.82 -7.025037556e-02 3.84 -6.031666537e-02 3.86 -5.175382959e-02 3.88 -4.438504133e-02 3.90 -3.805252854e-02 3.92 -3.261663355e-02 3.94 -2.795454608e-02 3.96 -2.395886214e-02 3.98 -2.053608094e-02 4.00 -1.760511541e-02 4.02 -1.509586770e-02 4.04 -1.294789974e-02 4.06 -1.110921585e-02 4.08 -9.535163668e-03 4.10 -8.187453003e-03 4.12 -7.033287916e-03 4.14 -6.044604414e-03 4.16 -5.197404953e-03 4.18 -4.471180170e-03 4.20 -3.848408522e-03 4.22 -3.314124622e-03 4.24 -2.855547977e-03 4.26 -2.461764239e-03 4.28 -2.123452177e-03 4.30 -1.832650013e-03 4.32 -1.582555806e-03 4.34 -1.367356971e-03 4.36 -1.182084873e-03 4.38 -1.022490804e-03 4.40 -8.849402879e-04 4.42 -7.663229913e-04 4.44 -6.639759734e-04 4.46 -5.756182786e-04 4.48 -4.992952099e-04 4.50 -4.333308323e-04 4.52 -3.762874902e-04 4.54 -3.269312909e-04 4.56 -2.842026663e-04 4.58 -2.471912599e-04 4.60 -2.151144918e-04 4.62 -1.872992598e-04 4.64 -1.631663069e-04 4.66 -1.422168652e-04 4.68 -1.240212347e-04 4.70 -1.082090166e-04 4.72 -9.446075308e-05 4.74 -8.250077093e-05 4.76 -7.209104979e-05 4.78 -6.302596779e-05 4.80 -5.512779455e-05 4.82 -4.824282523e-05 4.84 -4.223806092e-05 4.86 -3.699835794e-05 4.88 -3.242397762e-05 4.90 -2.842847967e-05 4.92 -2.493690972e-05 4.94 -2.188423923e-05 4.96 -1.921402185e-05 4.98 -1.687723560e-05 5.00 -1.483128466e-05 5.02 -1.303913819e-05 5.04 -1.146858718e-05 5.06 -1.009160258e-05 5.08 -8.883780878e-06 5.10 -7.823864610e-06 5.12 -6.893327871e-06 5.14 -6.076017472e-06 5.16 -5.357842356e-06 5.18 -4.726504485e-06 5.20 -4.171265672e-06 5.22 -3.682745334e-06 5.24 -3.252745089e-06 5.26 -2.874096467e-06 5.28 -2.540528694e-06 5.30 -2.246553790e-06 5.32 -1.987366718e-06 5.34 -1.758758524e-06 5.36 -1.557040776e-06 5.38 -1.378979781e-06 5.40 -1.221739301e-06 5.42 -1.082830632e-06 5.44 -9.600690941e-07 5.46 -8.515360868e-07 5.48 -7.555459747e-07 5.50 -6.706171910e-07 5.52 -5.954469945e-07 5.54 -5.288894219e-07 5.56 -4.699360111e-07 5.58 -4.176989500e-07 5.60 -3.713963298e-07 5.62 -3.303392428e-07 5.64 -2.939204828e-07 5.66 -2.616046492e-07 5.68 -2.329194734e-07 5.70 -2.074482168e-07 5.72 -1.848230018e-07 5.74 -1.647189619e-07 5.76 -1.468491060e-07 5.78 -1.309598093e-07 5.80 -1.168268520e-07 5.82 -1.042519380e-07 5.84 -9.305963507e-08 5.86 -8.309468252e-08 5.88 -7.421962368e-08 5.90 -6.631272117e-08 5.92 -5.926612194e-08 5.94 -5.298424039e-08 5.96 -4.738233424e-08 5.98 -4.238524864e-08 6.00 -3.792630913e-08 6.02 -3.394634469e-08 6.04 -3.039282606e-08 6.06 -2.721910461e-08 6.08 -2.438374057e-08 6.10 -2.184990937e-08 6.12 -1.958487707e-08 6.14 0.000000000e+00 6.16 0.000000000e+00 6.18 0.000000000e+00 6.20 0.000000000e+00 6.22 0.000000000e+00 6.24 0.000000000e+00 6.26 0.000000000e+00 6.28 0.000000000e+00 6.30 0.000000000e+00 6.32 0.000000000e+00 6.34 0.000000000e+00 6.36 0.000000000e+00 6.38 0.000000000e+00 6.40 0.000000000e+00 6.42 0.000000000e+00 6.44 0.000000000e+00 6.46 0.000000000e+00 6.48 0.000000000e+00 6.50 0.000000000e+00 6.52 0.000000000e+00 6.54 0.000000000e+00 6.56 0.000000000e+00 6.58 0.000000000e+00 6.60 0.000000000e+00 6.62 0.000000000e+00 6.64 0.000000000e+00 6.66 0.000000000e+00 6.68 0.000000000e+00 6.70 0.000000000e+00 6.72 0.000000000e+00 6.74 0.000000000e+00 6.76 0.000000000e+00 6.78 0.000000000e+00 6.80 0.000000000e+00 6.82 0.000000000e+00 6.84 0.000000000e+00 6.86 0.000000000e+00 6.88 0.000000000e+00 6.90 0.000000000e+00 6.92 0.000000000e+00 6.94 0.000000000e+00 6.96 0.000000000e+00 6.98 0.000000000e+00 7.00 0.000000000e+00 7.02 0.000000000e+00 7.04 0.000000000e+00 7.06 0.000000000e+00 7.08 0.000000000e+00 7.10 0.000000000e+00 7.12 0.000000000e+00 7.14 0.000000000e+00 7.16 0.000000000e+00 7.18 0.000000000e+00 7.20 0.000000000e+00 7.22 0.000000000e+00 7.24 0.000000000e+00 7.26 0.000000000e+00 7.28 0.000000000e+00 7.30 0.000000000e+00 7.32 0.000000000e+00 7.34 0.000000000e+00 7.36 0.000000000e+00 7.38 0.000000000e+00 7.40 0.000000000e+00 7.42 0.000000000e+00 7.44 0.000000000e+00 7.46 0.000000000e+00 7.48 0.000000000e+00 7.50 0.000000000e+00 7.52 0.000000000e+00 7.54 0.000000000e+00 7.56 0.000000000e+00 7.58 0.000000000e+00 7.60 0.000000000e+00 7.62 0.000000000e+00 7.64 0.000000000e+00 7.66 0.000000000e+00 7.68 0.000000000e+00 7.70 0.000000000e+00 7.72 0.000000000e+00 7.74 0.000000000e+00 7.76 0.000000000e+00 7.78 0.000000000e+00 7.80 0.000000000e+00 7.82 0.000000000e+00 7.84 0.000000000e+00 7.86 0.000000000e+00 7.88 0.000000000e+00 7.90 0.000000000e+00 7.92 0.000000000e+00 7.94 0.000000000e+00 7.96 0.000000000e+00 7.98 0.000000000e+00 8.00 0.000000000e+00 8.02 0.000000000e+00 8.04 0.000000000e+00 8.06 0.000000000e+00 8.08 0.000000000e+00 8.10 0.000000000e+00 8.12 0.000000000e+00 8.14 0.000000000e+00 8.16 0.000000000e+00 8.18 0.000000000e+00 8.20 0.000000000e+00 8.22 0.000000000e+00 8.24 0.000000000e+00 8.26 0.000000000e+00 8.28 0.000000000e+00 8.30 0.000000000e+00 8.32 0.000000000e+00 8.34 0.000000000e+00 8.36 0.000000000e+00 8.38 0.000000000e+00 8.40 0.000000000e+00 8.42 0.000000000e+00 8.44 0.000000000e+00 8.46 0.000000000e+00 8.48 0.000000000e+00 8.50 0.000000000e+00 8.52 0.000000000e+00 8.54 0.000000000e+00 8.56 0.000000000e+00 8.58 0.000000000e+00 8.60 0.000000000e+00 8.62 0.000000000e+00 8.64 0.000000000e+00 8.66 0.000000000e+00 8.68 0.000000000e+00 8.70 0.000000000e+00 8.72 0.000000000e+00 8.74 0.000000000e+00 8.76 0.000000000e+00 8.78 0.000000000e+00 8.80 0.000000000e+00 8.82 0.000000000e+00 8.84 0.000000000e+00 8.86 0.000000000e+00 8.88 0.000000000e+00 8.90 0.000000000e+00 8.92 0.000000000e+00 8.94 0.000000000e+00 8.96 0.000000000e+00 8.98 0.000000000e+00 9.00 0.000000000e+00 9.02 0.000000000e+00 9.04 0.000000000e+00 9.06 0.000000000e+00 9.08 0.000000000e+00 9.10 0.000000000e+00 9.12 0.000000000e+00 9.14 0.000000000e+00 9.16 0.000000000e+00 9.18 0.000000000e+00 9.20 0.000000000e+00 9.22 0.000000000e+00 9.24 0.000000000e+00 9.26 0.000000000e+00 9.28 0.000000000e+00 9.30 0.000000000e+00 9.32 0.000000000e+00 9.34 0.000000000e+00 9.36 0.000000000e+00 9.38 0.000000000e+00 9.40 0.000000000e+00 9.42 0.000000000e+00 9.44 0.000000000e+00 9.46 0.000000000e+00 9.48 0.000000000e+00 9.50 0.000000000e+00 9.52 0.000000000e+00 9.54 0.000000000e+00 9.56 0.000000000e+00 9.58 0.000000000e+00 9.60 0.000000000e+00 9.62 0.000000000e+00 9.64 0.000000000e+00 9.66 0.000000000e+00 9.68 0.000000000e+00 9.70 0.000000000e+00 9.72 0.000000000e+00 9.74 0.000000000e+00 9.76 0.000000000e+00 9.78 0.000000000e+00 9.80 0.000000000e+00 9.82 0.000000000e+00 9.84 0.000000000e+00 9.86 0.000000000e+00 9.88 0.000000000e+00 9.90 0.000000000e+00 9.92 0.000000000e+00 9.94 0.000000000e+00 9.96 0.000000000e+00 9.98 0.000000000e+00 10.00 0.000000000e+00