# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1987--Ackland-G-J-Tichy-G-Vitek-V-Finnis-M-W--Ni # implementation = 1987--Ackland-G-J--Ni--LAMMPS--ipr1 # composition = Ni # 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 2.482706617e+02 nan 0.62 nan nan nan nan nan nan nan nan 2.228759917e+02 nan 0.64 nan nan nan nan nan 1.714247274e+02 nan nan 2.005849452e+02 nan 0.66 nan nan nan nan nan 1.546289282e+02 nan nan 1.808399000e+02 nan 0.68 nan nan nan nan nan 1.395052625e+02 nan nan 1.632681474e+02 nan 0.70 nan nan nan nan nan 1.257977176e+02 nan nan 1.476590954e+02 nan 0.72 nan nan nan 2.735943014e+02 2.736501256e+02 1.134979607e+02 nan nan 1.338250181e+02 1.866798177e+02 0.74 nan 1.700543527e+02 nan 2.500809114e+02 2.501226648e+02 1.026483734e+02 nan nan 1.215650758e+02 1.700852957e+02 0.76 nan 1.552145101e+02 nan 2.290114132e+02 2.290151406e+02 9.305701275e+01 1.577668912e+02 nan 1.106481087e+02 1.552329379e+02 0.78 nan 1.418947754e+02 nan 2.101201126e+02 2.101013370e+02 8.452838614e+01 1.441949721e+02 nan 1.008313915e+02 1.418622968e+02 0.80 nan 1.298627424e+02 nan 1.931002394e+02 1.930620136e+02 7.691582408e+01 1.319542217e+02 nan 9.194569491e+01 1.298409009e+02 0.82 nan 1.189667707e+02 nan 1.776999412e+02 1.776613366e+02 7.009398533e+01 1.208886994e+02 1.662407399e+02 8.387493837e+01 1.189835390e+02 0.84 1.637141164e+02 1.090964807e+02 1.486090221e+02 1.637315350e+02 1.637036295e+02 6.397220835e+01 1.108674100e+02 1.530427122e+02 7.652123390e+01 1.092142638e+02 0.86 1.509851807e+02 1.001237834e+02 1.369205383e+02 1.509952348e+02 1.509804907e+02 5.845219621e+01 1.018049955e+02 1.410335284e+02 6.980956158e+01 1.003955144e+02 0.88 1.393636490e+02 9.194941293e+01 1.262260260e+02 1.393785941e+02 1.393880757e+02 5.344606380e+01 9.364036690e+01 1.300673195e+02 6.368195681e+01 9.234978489e+01 0.90 1.287616608e+02 8.449735739e+01 1.164114441e+02 1.287988602e+02 1.288389271e+02 4.882721844e+01 8.623928289e+01 1.200628958e+02 5.809814545e+01 8.495666820e+01 0.92 1.190588727e+02 7.772188896e+01 1.074227963e+02 1.191138428e+02 1.191806992e+02 4.454281812e+01 7.948595168e+01 1.109215311e+02 5.303105321e+01 7.815683313e+01 0.94 1.101738531e+02 7.157734432e+01 9.922179998e+01 1.102253759e+02 1.102988326e+02 4.060317114e+01 7.329370993e+01 1.025491374e+02 4.846678008e+01 7.188711578e+01 0.96 1.020255381e+02 6.597696926e+01 9.176376449e+01 1.020618251e+02 1.021128290e+02 3.701173628e+01 6.756481298e+01 9.489623830e+01 4.437250483e+01 6.609149372e+01 0.98 9.456853895e+01 6.086300864e+01 8.499515276e+01 9.457277774e+01 9.458107435e+01 3.375854111e+01 6.223047989e+01 8.791348622e+01 4.068881523e+01 6.075205963e+01 1.00 8.774690758e+01 5.614580254e+01 7.883361598e+01 8.771376693e+01 8.767252414e+01 3.080718789e+01 5.725480854e+01 8.154762861e+01 3.735010606e+01 5.587235219e+01 1.02 8.150066244e+01 5.179155509e+01 7.318549982e+01 8.143982620e+01 8.135745146e+01 2.808918330e+01 5.264831543e+01 7.572881225e+01 3.430929530e+01 5.145040588e+01 1.04 7.578377957e+01 4.778847580e+01 6.799204107e+01 7.569391703e+01 7.558875040e+01 2.556809331e+01 4.842482249e+01 7.037962712e+01 3.152995723e+01 4.743562511e+01 1.06 7.052653969e+01 4.407869449e+01 6.319018911e+01 7.041357978e+01 7.030872301e+01 2.322737861e+01 4.458128354e+01 6.541325811e+01 2.897330552e+01 4.376859736e+01 1.08 6.564718600e+01 4.062005843e+01 5.873397698e+01 6.553755507e+01 6.545949394e+01 2.105560674e+01 4.108952384e+01 6.075748447e+01 2.661301061e+01 4.041871387e+01 1.10 6.106606491e+01 3.740282046e+01 5.458359681e+01 6.100374468e+01 6.097378221e+01 1.904694781e+01 3.790690713e+01 5.637869333e+01 2.440466187e+01 3.735777740e+01 1.12 5.674864400e+01 3.441075057e+01 5.070320823e+01 5.676518096e+01 5.679183406e+01 1.720317461e+01 3.499858401e+01 5.227123888e+01 2.232639825e+01 3.457263703e+01 1.14 5.267723544e+01 3.164477242e+01 4.703859744e+01 5.278252125e+01 5.286173611e+01 1.552129472e+01 3.233488526e+01 4.843872127e+01 2.036883995e+01 3.205343833e+01 1.16 4.887167436e+01 2.911116725e+01 4.354877873e+01 4.904075847e+01 4.915789017e+01 1.397763686e+01 2.989591834e+01 4.489104994e+01 1.852524684e+01 2.975802713e+01 1.18 4.535728765e+01 2.680817954e+01 4.024907433e+01 4.554348897e+01 4.567917322e+01 1.256288591e+01 2.766375570e+01 4.163113881e+01 1.679281561e+01 2.762029469e+01 1.20 4.214074640e+01 2.470764841e+01 3.715549833e+01 4.229423413e+01 4.242595891e+01 1.125934973e+01 2.562227348e+01 3.864732237e+01 1.517379816e+01 2.560132762e+01 1.22 3.919041351e+01 2.278166037e+01 3.429740621e+01 3.928446394e+01 3.939023743e+01 1.006232370e+01 2.374758744e+01 3.590342255e+01 1.365959659e+01 2.367538049e+01 1.24 3.647689926e+01 2.100942185e+01 3.170800476e+01 3.650032036e+01 3.656220791e+01 8.975168966e+00 2.201887244e+01 3.336657640e+01 1.224543641e+01 2.183140227e+01 1.26 3.396408056e+01 1.936795474e+01 2.937998942e+01 3.392376818e+01 3.393243992e+01 7.997182070e+00 2.040355603e+01 3.101461227e+01 1.093180822e+01 2.006442507e+01 1.28 3.162641923e+01 1.783407236e+01 2.726767830e+01 3.153451347e+01 3.148672234e+01 7.112081519e+00 1.886620246e+01 2.882932735e+01 9.713580093e+00 1.837615373e+01 1.30 2.943940107e+01 1.638621899e+01 2.533532600e+01 2.931271629e+01 2.921483776e+01 6.305765773e+00 1.739069664e+01 2.678613138e+01 8.588201060e+00 1.676472093e+01 1.32 2.737912020e+01 1.501466532e+01 2.355877376e+01 2.724270626e+01 2.711046502e+01 5.568120767e+00 1.596562595e+01 2.487237537e+01 7.557596915e+00 1.522365836e+01 1.34 2.544749803e+01 1.372154011e+01 2.191826729e+01 2.532189103e+01 2.517489245e+01 4.888051629e+00 1.458512623e+01 2.309061711e+01 6.618385845e+00 1.376329708e+01 1.36 2.364716367e+01 1.251020405e+01 2.039862810e+01 2.354166530e+01 2.340111592e+01 4.258452255e+00 1.324724075e+01 2.143780305e+01 5.762426528e+00 1.239386691e+01 1.38 2.196780999e+01 1.138261361e+01 1.898649380e+01 2.189109540e+01 2.177649214e+01 3.673963932e+00 1.195786175e+01 1.989929406e+01 4.982954495e+00 1.111335017e+01 1.40 2.040509144e+01 1.033581320e+01 1.767266304e+01 2.035900245e+01 2.028095762e+01 3.133358076e+00 1.072492531e+01 1.846151838e+01 4.273081260e+00 9.927053188e+00 1.42 1.896002790e+01 9.355909652e+00 1.645153097e+01 1.893792475e+01 1.889849331e+01 2.639098598e+00 9.554861946e+00 1.711297677e+01 3.627162893e+00 8.847074944e+00 1.44 1.761980326e+01 8.428708688e+00 1.530770773e+01 1.761553142e+01 1.761340032e+01 2.188881920e+00 8.458121798e+00 1.583989070e+01 3.038557153e+00 7.873610174e+00 1.46 1.635193475e+01 7.543933471e+00 1.421609188e+01 1.636883936e+01 1.640336735e+01 1.775550684e+00 7.441827655e+00 1.462556677e+01 2.498018427e+00 6.988819889e+00 1.48 1.513771555e+01 6.701294589e+00 1.316329203e+01 1.518359758e+01 1.525236555e+01 1.396324052e+00 6.508471535e+00 1.346601526e+01 1.998311748e+00 6.183460166e+00 1.50 1.397521286e+01 5.903530992e+00 1.213949911e+01 1.405171311e+01 1.414798551e+01 1.049490038e+00 5.654434074e+00 1.236463679e+01 1.533108213e+00 5.452054727e+00 1.52 1.286822049e+01 5.151800911e+00 1.113295668e+01 1.296747033e+01 1.308013928e+01 7.300346868e-01 4.872538069e+00 1.132535851e+01 1.097878293e+00 4.787853135e+00 1.54 1.181827646e+01 4.442567245e+00 1.013443187e+01 1.193000268e+01 1.204775948e+01 4.265250733e-01 4.156403932e+00 1.035058768e+01 6.917576631e-01 4.179399381e+00 1.56 1.082786030e+01 3.774167151e+00 9.146833323e+00 1.094146055e+01 1.105417641e+01 1.343001209e-01 3.501522791e+00 9.441262340e+00 3.145766767e-01 3.617005384e+00 1.58 9.900323661e+00 3.146066405e+00 8.182015571e+00 1.000560016e+01 1.010396470e+01 -1.453085188e-01 2.904114490e+00 8.591736021e+00 -3.385167460e-02 3.092621987e+00 1.60 9.039089589e+00 2.554179580e+00 7.253165362e+00 9.124511511e+00 9.200093597e+00 -4.102038121e-01 2.359712157e+00 7.794931226e+00 -3.559198506e-01 2.598941517e+00 1.62 8.243010116e+00 1.990767193e+00 6.371641610e+00 8.297001563e+00 8.343376158e+00 -6.583006653e-01 1.864817712e+00 7.038621581e+00 -6.565008209e-01 2.132240136e+00 1.64 7.493562336e+00 1.452501219e+00 5.547742737e+00 7.512133013e+00 7.527390203e+00 -8.875270234e-01 1.416306612e+00 6.310819987e+00 -9.388173510e-01 1.689841423e+00 1.66 6.773695208e+00 9.382298013e-01 4.790059349e+00 6.760492517e+00 6.747521185e+00 -1.095828947e+00 1.010876160e+00 5.604691396e+00 -1.203195250e+00 1.269145662e+00 1.68 6.074797066e+00 4.476246785e-01 4.097545909e+00 6.036343408e+00 6.000027606e+00 -1.282265727e+00 6.432465641e-01 4.919122344e+00 -1.451649606e+00 8.678669422e-01 1.70 5.393531675e+00 -1.825532324e-02 3.463986097e+00 5.337075568e+00 5.282526571e+00 -1.448714976e+00 3.061443265e-01 4.256844291e+00 -1.684717242e+00 4.853743893e-01 1.72 4.730421367e+00 -4.578149481e-01 2.880244323e+00 4.662467730e+00 4.595273711e+00 -1.599841016e+00 -7.740695541e-03 3.619610738e+00 -1.902162671e+00 1.223696462e-01 1.74 4.086053939e+00 -8.701426866e-01 2.337110173e+00 4.012290485e+00 3.938641509e+00 -1.740332498e+00 -3.036008509e-01 3.007377600e+00 -2.103623519e+00 -2.205773329e-01 1.76 3.461441712e+00 -1.253991919e+00 1.829744494e+00 3.387727236e+00 3.314012914e+00 -1.872681593e+00 -5.858471985e-01 2.423006798e+00 -2.289503640e+00 -5.457268182e-01 1.78 2.859658334e+00 -1.607383156e+00 1.353915684e+00 2.791647594e+00 2.723636854e+00 -1.999044666e+00 -8.584768610e-01 1.871326037e+00 -2.461425939e+00 -8.558569725e-01 1.80 2.285289118e+00 -1.929111958e+00 9.072387948e-01 2.227805095e+00 2.170321072e+00 -2.119743136e+00 -1.123290431e+00 1.355760482e+00 -2.620839223e+00 -1.149859444e+00 1.82 1.743368031e+00 -2.218305306e+00 4.890988437e-01 1.698930722e+00 1.654493413e+00 -2.233340981e+00 -1.380279744e+00 8.785217198e-01 -2.767655727e+00 -1.425271801e+00 1.84 1.238838578e+00 -2.475289889e+00 9.895258987e-02 1.207813262e+00 1.176787946e+00 -2.338343748e+00 -1.628858308e+00 4.383792782e-01 -2.901824004e+00 -1.679646915e+00 1.86 7.739863121e-01 -2.701144884e+00 -2.644379470e-01 7.556832856e-01 7.373802592e-01 -2.433965836e+00 -1.868409142e+00 3.252971846e-02 -3.024266766e+00 -1.911410136e+00 1.88 3.479738823e-01 -2.898428631e+00 -6.035125257e-01 3.411045766e-01 3.342352708e-01 -2.520639965e+00 -2.098835357e+00 -3.411140344e-01 -3.135265389e+00 -2.120014031e+00 1.90 -4.023937515e-02 -3.071054535e+00 -9.202320340e-01 -3.753697643e-02 -3.483457771e-02 -2.598370678e+00 -2.319186515e+00 -6.844462984e-01 -3.234755514e+00 -2.304982554e+00 1.92 -3.939137591e-01 -3.222122226e+00 -1.216002200e+00 -3.834862181e-01 -3.730586771e-01 -2.666662782e+00 -2.527388789e+00 -1.000552312e+00 -3.322860616e+00 -2.468228215e+00 1.94 -7.203428426e-01 -3.355125352e+00 -1.492204579e+00 -7.029624889e-01 -6.855821353e-01 -2.725026794e+00 -2.721320129e+00 -1.293984239e+00 -3.400158899e+00 -2.615946850e+00 1.96 -1.024806736e+00 -3.472946538e+00 -1.750216148e+00 -1.000693584e+00 -9.765804317e-01 -2.773290344e+00 -2.900639613e+00 -1.567365074e+00 -3.467869665e+00 -2.752602717e+00 1.98 -1.309028802e+00 -3.577240612e+00 -1.992154211e+00 -1.278875208e+00 -1.248721613e+00 -2.812960740e+00 -3.067163362e+00 -1.821744024e+00 -3.526852505e+00 -2.879835612e+00 2.00 -1.574344438e+00 -3.669491180e+00 -2.220537481e+00 -1.539458276e+00 -1.504572114e+00 -2.846155078e+00 -3.222360764e+00 -2.058028135e+00 -3.577775229e+00 -2.999045065e+00 2.02 -1.822076118e+00 -3.751169904e+00 -2.437863545e+00 -1.784380293e+00 -1.746684469e+00 -2.874992371e+00 -3.365725497e+00 -2.277109931e+00 -3.621238852e+00 -3.111631572e+00 2.04 -2.053533136e+00 -3.823736374e+00 -2.646142352e+00 -2.015480078e+00 -1.977427019e+00 -2.901156241e+00 -3.496403717e+00 -2.479867220e+00 -3.657457330e+00 -3.218996668e+00 2.06 -2.269895934e+00 -3.888637987e+00 -2.844976810e+00 -2.233893408e+00 -2.197890881e+00 -2.924978506e+00 -3.615154093e+00 -2.667091711e+00 -3.686415295e+00 -3.322312094e+00 2.08 -2.471550860e+00 -3.947292793e+00 -3.032859111e+00 -2.439690024e+00 -2.407829188e+00 -2.946220200e+00 -3.723069199e+00 -2.839673537e+00 -3.708036648e+00 -3.421189744e+00 2.10 -2.658547292e+00 -4.000414388e+00 -3.208250360e+00 -2.632600132e+00 -2.606652972e+00 -2.964612598e+00 -3.820086355e+00 -2.999467790e+00 -3.722170259e+00 -3.514596262e+00 2.12 -2.830920169e+00 -4.047786777e+00 -3.369588282e+00 -2.812338585e+00 -2.793757002e+00 -2.979859661e+00 -3.905780044e+00 -3.148065815e+00 -3.728663875e+00 -3.601497790e+00 2.14 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