# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2015--Kim-Y-K-Jung-W-S-Lee-B-J--Ni-Co # implementation = 2015--Kim-Y-K--Ni-Co--LAMMPS--ipr1 # 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 Co Co Co Ni Ni Ni 0.02 4.395167296e+02 8.737304572e+02 1.192811351e+03 0.04 4.168386496e+02 8.253378018e+02 1.123164102e+03 0.06 3.952506443e+02 7.795044352e+02 1.057435218e+03 0.08 3.747029435e+02 7.360994924e+02 9.954101019e+02 0.10 3.551479530e+02 6.949985970e+02 9.368856441e+02 0.12 3.365401630e+02 6.560835494e+02 8.816696208e+02 0.14 3.188360610e+02 6.192420302e+02 8.295801227e+02 0.16 3.019940469e+02 5.843673170e+02 7.804450126e+02 0.18 2.859743528e+02 5.513580138e+02 7.341014112e+02 0.20 2.707389651e+02 5.201177940e+02 6.903952093e+02 0.22 2.562515505e+02 4.905551545e+02 6.491806055e+02 0.24 2.424773844e+02 4.625831817e+02 6.103196675e+02 0.26 2.293832827e+02 4.361193288e+02 5.736819165e+02 0.28 2.169375362e+02 4.110852024e+02 5.391439328e+02 0.30 2.051098473e+02 3.874063607e+02 5.065889821e+02 0.32 1.938712704e+02 3.650121195e+02 4.759066609e+02 0.34 1.831941532e+02 3.438353692e+02 4.469925607e+02 0.36 1.730520819e+02 3.238123988e+02 4.197479499e+02 0.38 1.634198276e+02 3.048827291e+02 3.940794710e+02 0.40 1.542732953e+02 2.869889538e+02 3.698988555e+02 0.42 1.455894752e+02 2.700765882e+02 3.471226517e+02 0.44 1.373463958e+02 2.540939243e+02 3.256719686e+02 0.46 1.295230788e+02 2.389918942e+02 3.054722316e+02 0.48 1.220994962e+02 2.247239388e+02 2.864529518e+02 0.50 1.150565289e+02 2.112458838e+02 2.685475076e+02 0.52 1.083759272e+02 1.985158205e+02 2.516929370e+02 0.54 1.020402730e+02 1.864939937e+02 2.358297413e+02 0.56 9.603294339e+01 1.751426937e+02 2.209016993e+02 0.58 9.033807585e+01 1.644261545e+02 2.068556905e+02 0.60 8.494053490e+01 1.543104566e+02 1.936415286e+02 0.62 7.982588023e+01 1.447634341e+02 1.812118031e+02 0.64 7.498033609e+01 1.357545872e+02 1.695217293e+02 0.66 7.039076197e+01 1.272549979e+02 1.585290067e+02 0.68 6.604462457e+01 1.192372506e+02 1.481936841e+02 0.70 6.192997090e+01 1.116753565e+02 1.384780329e+02 0.72 5.803540260e+01 1.045446814e+02 1.293464261e+02 0.74 5.435005123e+01 9.782187679e+01 1.207652241e+02 0.76 5.086355476e+01 9.148481535e+01 1.127026669e+02 0.78 4.756603491e+01 8.551252850e+01 1.051287716e+02 0.80 4.444807560e+01 7.988514767e+01 9.801523555e+01 0.82 4.150070220e+01 7.458384826e+01 9.133534436e+01 0.84 3.871536177e+01 6.959079639e+01 8.506388542e+01 0.86 3.608390407e+01 6.488909832e+01 7.917706550e+01 0.88 3.359856346e+01 6.046275232e+01 7.365243296e+01 0.90 3.125194148e+01 5.629660301e+01 6.846880414e+01 0.92 2.903699033e+01 5.237629789e+01 6.360619366e+01 0.94 2.694699690e+01 4.868824608e+01 5.904574843e+01 0.96 2.497556762e+01 4.521957912e+01 5.476968530e+01 0.98 2.311661391e+01 4.195811371e+01 5.076123196e+01 1.00 2.136433827e+01 3.889231633e+01 4.700457111e+01 1.02 1.971322099e+01 3.601126963e+01 4.348478755e+01 1.04 1.815800742e+01 3.330464049e+01 4.018781824e+01 1.06 1.669369585e+01 3.076264976e+01 3.710040495e+01 1.08 1.531552583e+01 2.837604338e+01 3.421004953e+01 1.10 1.401896710e+01 2.613606513e+01 3.150497161e+01 1.12 1.279970896e+01 2.403443063e+01 2.897406860e+01 1.14 1.165365011e+01 2.206330271e+01 2.660687777e+01 1.16 1.057688897e+01 2.021526801e+01 2.439354057e+01 1.18 9.565714400e+00 1.848331479e+01 2.232476870e+01 1.20 8.616596847e+00 1.686081186e+01 2.039181218e+01 1.22 7.726179898e+00 1.534148857e+01 1.858642909e+01 1.24 6.891272205e+00 1.391941582e+01 1.690085697e+01 1.26 6.108839775e+00 1.258898807e+01 1.532778583e+01 1.28 5.375998618e+00 1.134490625e+01 1.386033258e+01 1.30 4.690007722e+00 1.018216156e+01 1.249201690e+01 1.32 4.048262358e+00 9.096020065e+00 1.121673844e+01 1.34 3.448287696e+00 8.082008130e+00 1.002875525e+01 1.36 2.887732711e+00 7.135898584e+00 8.922663442e+00 1.38 2.364364385e+00 6.253697601e+00 7.893377924e+00 1.40 1.876062180e+00 5.431632258e+00 6.936114238e+00 1.42 1.420812777e+00 4.666138746e+00 6.046371389e+00 1.44 9.967050709e-01 3.953851184e+00 5.219915627e+00 1.46 6.019254126e-01 3.291591023e+00 4.452765132e+00 1.48 2.347530866e-01 2.676357000e+00 3.741175554e+00 1.50 -1.064439791e-01 2.105315617e+00 3.081626353e+00 1.52 -4.232132835e-01 1.575792122e+00 2.470807902e+00 1.54 -7.170216073e-01 1.085261961e+00 1.905609318e+00 1.56 -9.892586613e-01 6.313426837e-01 1.383106963e+00 1.58 -1.241240534e+00 2.117862711e-01 9.005536017e-01 1.60 -1.474212945e+00 -1.755281226e-01 4.553681575e-01 1.62 -1.689354312e+00 -5.326010486e-01 4.512605252e-02 1.64 -1.887778636e+00 -8.613192730e-01 -3.324499100e-01 1.66 -2.070538216e+00 -1.163461939e+00 -6.794981472e-01 1.68 -2.238626191e+00 -1.440706398e+00 -9.980264090e-01 1.70 -2.392978935e+00 -1.694633731e+00 -1.289919428e+00 1.72 -2.534478288e+00 -1.926733964e+00 -1.556946131e+00 1.74 -2.663953658e+00 -2.138411011e+00 -1.800766438e+00 1.76 -2.782183993e+00 -2.330987344e+00 -2.022937668e+00 1.78 -2.889899628e+00 -2.505708407e+00 -2.224920576e+00 1.80 -2.987784041e+00 -2.663746798e+00 -2.408085048e+00 1.82 -3.076475511e+00 -2.806206210e+00 -2.573715459e+00 1.84 -3.156568708e+00 -2.934125170e+00 -2.723015745e+00 1.86 -3.228616236e+00 -3.048480565e+00 -2.857114178e+00 1.88 -3.293130133e+00 -3.150190981e+00 -2.977067878e+00 1.90 -3.350583365e+00 -3.240119858e+00 -3.083867091e+00 1.92 -3.401411322e+00 -3.319078473e+00 -3.178439220e+00 1.94 -3.446013353e+00 -3.387828766e+00 -3.261652650e+00 1.96 -3.484754337e+00 -3.447086016e+00 -3.334320363e+00 1.98 -3.517966337e+00 -3.497521368e+00 -3.397203359e+00 2.00 -3.545950338e+00 -3.539764241e+00 -3.451013876e+00 2.02 -3.568978104e+00 -3.574404600e+00 -3.496418444e+00 2.04 -3.587294168e+00 -3.601995120e+00 -3.534040739e+00 2.06 -3.601117980e+00 -3.623053247e+00 -3.564464279e+00 2.08 -3.610646239e+00 -3.638063148e+00 -3.588234936e+00 2.10 -3.616055434e+00 -3.647477588e+00 -3.605863293e+00 2.12 -3.617504614e+00 -3.651719707e+00 -3.617826840e+00 2.14 -3.615138385e+00 -3.651184733e+00 -3.624572014e+00 2.16 -3.609090148e+00 -3.646241631e+00 -3.626516112e+00 2.18 -3.599485525e+00 -3.637234679e+00 -3.624049053e+00 2.20 -3.586445910e+00 -3.624485009e+00 -3.617535035e+00 2.22 -3.570092037e+00 -3.608292090e+00 -3.607314071e+00 2.24 -3.550547410e+00 -3.588935174e+00 -3.593703427e+00 2.26 -3.527941413e+00 -3.566674697e+00 -3.576998975e+00 2.28 -3.502411899e+00 -3.541753646e+00 -3.557476452e+00 2.30 -3.474107070e+00 -3.514398877e+00 -3.535392655e+00 2.32 -3.443186485e+00 -3.484822380e+00 -3.510986574e+00 2.34 -3.409821104e+00 -3.453222493e+00 -3.484480453e+00 2.36 -3.374192356e+00 -3.419785039e+00 -3.456080804e+00 2.38 -3.336490289e+00 -3.384684390e+00 -3.425979376e+00 2.40 -3.296910983e+00 -3.348084436e+00 -3.394354066e+00 2.42 -3.255653424e+00 -3.310139457e+00 -3.361369793e+00 2.44 -3.212916117e+00 -3.270994891e+00 -3.327179329e+00 2.46 -3.168893703e+00 -3.230787990e+00 -3.291924086e+00 2.48 -3.123773831e+00 -3.189648367e+00 -3.255734867e+00 2.50 -3.077734488e+00 -3.147698444e+00 -3.218732572e+00 2.52 -3.030941931e+00 -3.105053796e+00 -3.181028875e+00 2.54 -2.983549293e+00 -3.061823427e+00 -3.142726854e+00 2.56 -2.935695861e+00 -3.018109963e+00 -3.103921590e+00 2.58 -2.887506986e+00 -2.974009811e+00 -3.064700727e+00 2.60 -2.839094513e+00 -2.929613274e+00 -3.025145004e+00 2.62 -2.790557623e+00 -2.885004663e+00 -2.985328742e+00 2.64 -2.741983937e+00 -2.840262408e+00 -2.945320305e+00 2.66 -2.693450771e+00 -2.795459175e+00 -2.905182537e+00 2.68 -2.645026413e+00 -2.750662022e+00 -2.864973151e+00 2.70 -2.596771353e+00 -2.705932568e+00 -2.824745112e+00 2.72 -2.548739388e+00 -2.661327206e+00 -2.784546971e+00 2.74 -2.500978587e+00 -2.616897332e+00 -2.744423194e+00 2.76 -2.453532090e+00 -2.572689609e+00 -2.704414454e+00 2.78 -2.406438760e+00 -2.528746236e+00 -2.664557908e+00 2.80 -2.359733700e+00 -2.485105239e+00 -2.624887451e+00 2.82 -2.313448658e+00 -2.441800754e+00 -2.585433947e+00 2.84 -2.267612349e+00 -2.398863315e+00 -2.546225457e+00 2.86 -2.222250717e+00 -2.356320127e+00 -2.507287430e+00 2.88 -2.177387139e+00 -2.314195331e+00 -2.468642899e+00 2.90 -2.133042619e+00 -2.272510248e+00 -2.430312649e+00 2.92 -2.089235935e+00 -2.231283617e+00 -2.392315380e+00 2.94 -2.045983794e+00 -2.190531804e+00 -2.354667857e+00 2.96 -2.003300959e+00 -2.150269008e+00 -2.317385049e+00 2.98 -1.961200376e+00 -2.110507445e+00 -2.280480256e+00 3.00 -1.919693289e+00 -2.071257520e+00 -2.243965232e+00 3.02 -1.878789351e+00 -2.032527986e+00 -2.207850297e+00 3.04 -1.838496730e+00 -1.994326094e+00 -2.172144438e+00 3.06 -1.798822205e+00 -1.956657727e+00 -2.136855411e+00 3.08 -1.759771257e+00 -1.919527526e+00 -2.101989829e+00 3.10 -1.721348162e+00 -1.882939006e+00 -2.067553249e+00 3.12 -1.683556071e+00 -1.846894662e+00 -2.033550250e+00 3.14 -1.646397086e+00 -1.811396064e+00 -1.999984509e+00 3.16 -1.609872340e+00 -1.776443950e+00 -1.966858869e+00 3.18 -1.573982062e+00 -1.742038299e+00 -1.934175403e+00 3.20 -1.538725643e+00 -1.708178411e+00 -1.901935479e+00 3.22 -1.504101701e+00 -1.674862968e+00 -1.870139813e+00 3.24 -1.470108140e+00 -1.642090094e+00 -1.838788523e+00 3.26 -1.436742199e+00 -1.609857414e+00 -1.807881180e+00 3.28 -1.404000513e+00 -1.578162095e+00 -1.777416855e+00 3.30 -1.371879156e+00 -1.547000894e+00 -1.747394157e+00 3.32 -1.340373687e+00 -1.516370197e+00 -1.717811282e+00 3.34 -1.309479199e+00 -1.486266055e+00 -1.688666043e+00 3.36 -1.279190354e+00 -1.456684214e+00 -1.659955912e+00 3.38 -1.249501424e+00 -1.427620149e+00 -1.631678045e+00 3.40 -1.220406328e+00 -1.399069084e+00 -1.603829321e+00 3.42 -1.191898664e+00 -1.371026022e+00 -1.576406364e+00 3.44 -1.163971742e+00 -1.343485762e+00 -1.549405571e+00 3.46 -1.136618613e+00 -1.316442923e+00 -1.522823139e+00 3.48 -1.109832099e+00 -1.289891961e+00 -1.496655083e+00 3.50 -1.083604818e+00 -1.263827186e+00 -1.470897262e+00 3.52 -1.057929209e+00 -1.238242778e+00 -1.445545393e+00 3.54 -1.032797553e+00 -1.213132802e+00 -1.420595076e+00 3.56 -1.008201998e+00 -1.188491219e+00 -1.396041801e+00 3.58 -9.841345783e-01 -1.164311902e+00 -1.371880972e+00 3.60 -9.605872300e-01 -1.140588649e+00 -1.348107916e+00 3.62 -9.375518132e-01 -1.117315189e+00 -1.324717899e+00 3.64 -9.150201256e-01 -1.094485197e+00 -1.301706133e+00 3.66 -8.929839187e-01 -1.072092302e+00 -1.279067793e+00 3.68 -8.714349115e-01 -1.050130097e+00 -1.256798020e+00 3.70 -8.503648040e-01 -1.028592149e+00 -1.234891938e+00 3.72 -8.297652894e-01 -1.007472003e+00 -1.213344655e+00 3.74 -8.096280655e-01 -9.867631970e-01 -1.192151275e+00 3.76 -7.899448447e-01 -9.664592636e-01 -1.171306901e+00 3.78 -7.707073647e-01 -9.465537395e-01 -1.150806645e+00 3.80 -7.519073963e-01 -9.270401722e-01 -1.130645633e+00 3.82 -7.335367526e-01 -9.079121258e-01 -1.110819007e+00 3.84 -7.155872960e-01 -8.891631872e-01 -1.091321933e+00 3.86 -6.980509455e-01 -8.707869718e-01 -1.072149604e+00 3.88 -6.809196828e-01 -8.527771286e-01 -1.053297242e+00 3.90 -6.641855583e-01 -8.351273452e-01 -1.034760103e+00 3.92 -6.478406965e-01 -8.178313520e-01 -1.016533481e+00 3.94 -6.318773005e-01 -8.008829271e-01 -9.986127089e-01 3.96 -6.162876565e-01 -7.842758999e-01 -9.809931594e-01 3.98 -6.010641378e-01 -7.680041545e-01 -9.636702506e-01 4.00 -5.861992083e-01 -7.520616334e-01 -9.466394454e-01 4.02 -5.716854256e-01 -7.364423405e-01 -9.298962535e-01 4.04 -5.575154436e-01 -7.211403436e-01 -9.134362331e-01 4.06 -5.436820152e-01 -7.061497773e-01 -8.972549915e-01 4.08 -5.301779945e-01 -6.914648451e-01 -8.813481866e-01 4.10 -5.169963384e-01 -6.770798211e-01 -8.657115272e-01 4.12 -5.041301081e-01 -6.629890524e-01 -8.503407740e-01 4.14 -4.915724708e-01 -6.491869602e-01 -8.352317401e-01 4.16 -4.793167005e-01 -6.356680413e-01 -8.203802913e-01 4.18 -4.673561790e-01 -6.224268692e-01 -8.057823461e-01 4.20 -4.556843965e-01 -6.094580950e-01 -7.914338766e-01 4.22 -4.442949518e-01 -5.967564485e-01 -7.773309080e-01 4.24 -4.331815532e-01 -5.843167385e-01 -7.634695188e-01 4.26 -4.223380179e-01 -5.721338533e-01 -7.498458408e-01 4.28 -4.117582727e-01 -5.602027609e-01 -7.364560588e-01 4.30 -4.014363532e-01 -5.485185098e-01 -7.232964106e-01 4.32 -3.913664038e-01 -5.370762282e-01 -7.103631868e-01 4.34 -3.815426772e-01 -5.258711244e-01 -6.976527303e-01 4.36 -3.719595339e-01 -5.148984866e-01 -6.851614360e-01 4.38 -3.626114417e-01 -5.041536826e-01 -6.728857509e-01 4.40 -3.534929747e-01 -4.936321594e-01 -6.608221727e-01 4.42 -3.437785952e-01 -4.822200154e-01 -6.475041596e-01 4.44 -3.231688992e-01 -4.558931306e-01 -6.143523791e-01 4.46 -2.656271237e-01 -3.784666663e-01 -5.128474531e-01 4.48 -1.410645351e-01 -2.049535435e-01 -2.804475825e-01 4.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 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