# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Sharifi-H-Wick-C-D--Co-Ni # implementation = 2025--Sharifi-H--Co-Ni--LAMMPS--ipr1 # composition = CoNi3 # 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 2025-07-01 r A15--Cr3Si D0_3--BiF3 L1_2--AuCu3 0.50 nan nan nan 0.52 nan nan nan 0.54 nan nan nan 0.56 nan nan nan 0.58 nan nan nan 0.60 nan nan nan 0.62 nan nan nan 0.64 nan nan nan 0.66 nan nan nan 0.68 nan nan nan 0.70 nan nan nan 0.72 nan nan nan 0.74 nan nan nan 0.76 nan nan nan 0.78 nan nan nan 0.80 nan nan nan 0.82 nan nan nan 0.84 nan nan nan 0.86 nan nan nan 0.88 nan nan nan 0.90 6.327885469e+02 nan nan 0.92 5.760148820e+02 nan nan 0.94 5.243594461e+02 nan nan 0.96 4.773632716e+02 nan nan 0.98 4.346121700e+02 5.735405625e+02 nan 1.00 3.957302981e+02 5.255638852e+02 nan 1.02 3.603657595e+02 4.818245708e+02 7.037391666e+02 1.04 3.280441097e+02 4.414926640e+02 6.470414675e+02 1.06 2.984530137e+02 4.041406539e+02 5.943064603e+02 1.08 2.713707034e+02 3.695547062e+02 5.452738568e+02 1.10 2.465945505e+02 3.375456422e+02 4.997130898e+02 1.12 2.239385946e+02 3.079434793e+02 4.574161503e+02 1.14 2.032316200e+02 2.805932718e+02 4.181921818e+02 1.16 1.843156244e+02 2.553519402e+02 3.818634166e+02 1.18 1.670445864e+02 2.320859078e+02 3.482622102e+02 1.20 1.512834546e+02 2.106693787e+02 3.172289464e+02 1.22 1.369073022e+02 1.909831141e+02 2.886106209e+02 1.24 1.238006013e+02 1.729135953e+02 2.622599450e+02 1.26 1.118565851e+02 1.563524719e+02 2.380348294e+02 1.28 1.009766735e+02 1.411962180e+02 2.157981428e+02 1.30 9.106994536e+01 1.273459351e+02 1.954176558e+02 1.32 8.205264583e+01 1.147072503e+02 1.767661010e+02 1.34 7.384772088e+01 1.031902737e+02 1.597212977e+02 1.36 6.638437463e+01 9.270958687e+01 1.441663025e+02 1.38 5.959764622e+01 8.318424027e+01 1.299895558e+02 1.40 5.342800536e+01 7.453774639e+01 1.170850061e+02 1.42 4.782096563e+01 6.669805949e+01 1.053522007e+02 1.44 4.272671556e+01 5.959753432e+01 9.469633222e+01 1.46 3.809976774e+01 5.317286334e+01 8.502824105e+01 1.48 3.389862602e+01 4.736498998e+01 7.626437400e+01 1.50 3.008547159e+01 4.211899910e+01 6.832670098e+01 1.52 2.662586724e+01 3.738398764e+01 6.114259468e+01 1.54 2.348847986e+01 3.311291557e+01 5.464467522e+01 1.56 2.064481933e+01 2.926244251e+01 4.877062640e+01 1.58 1.806894692e+01 2.579275372e+01 4.346298924e+01 1.60 1.573716076e+01 2.266737644e+01 3.866893601e+01 1.62 1.362779906e+01 1.985299090e+01 3.434003186e+01 1.64 1.172108171e+01 1.731923827e+01 3.043198762e+01 1.66 9.998940032e+00 1.503852752e+01 2.690440718e+01 1.68 8.444809352e+00 1.298584444e+01 2.372053471e+01 1.70 7.043494315e+00 1.113856398e+01 2.084700344e+01 1.72 5.781073325e+00 9.476267429e+00 1.825358898e+01 1.74 4.644808148e+00 7.980566215e+00 1.591296967e+01 1.76 3.623057844e+00 6.634910579e+00 1.380047119e+01 1.78 2.705197089e+00 5.424371861e+00 1.189378454e+01 1.80 1.881538913e+00 4.335489263e+00 1.017275461e+01 1.82 1.143261840e+00 3.356146340e+00 8.619201805e+00 1.84 4.823413180e-01 2.475454598e+00 7.216753598e+00 1.86 -1.085147030e-01 1.683643724e+00 5.950685619e+00 1.88 -6.359261472e-01 9.719586982e-01 4.807772509e+00 1.90 -1.105897141e+00 3.325642327e-01 3.776149204e+00 1.92 -1.523868536e+00 -2.415439352e-01 2.845181993e+00 1.94 -1.894766738e+00 -7.566209955e-01 2.005349271e+00 1.96 -2.223048959e+00 -1.218248300e+00 1.248131895e+00 1.98 -2.512745130e+00 -1.631402491e+00 5.659123289e-01 2.00 -2.767496602e+00 -2.000518595e+00 -4.811757846e-02 2.02 -2.990593935e+00 -2.329552997e+00 -6.000483889e-01 2.04 -3.185026465e+00 -2.622080979e+00 -1.095390655e+00 2.06 -3.353513479e+00 -2.881369992e+00 -1.539179286e+00 2.08 -3.498507330e+00 -3.110408152e+00 -1.936017141e+00 2.10 -3.622230131e+00 -3.311927702e+00 -2.290111396e+00 2.12 -3.726712372e+00 -3.488426452e+00 -2.605306830e+00 2.14 -3.813809122e+00 -3.642187473e+00 -2.885116383e+00 2.16 -3.885214204e+00 -3.775297144e+00 -3.132749188e+00 2.18 -3.942473324e+00 -3.889661049e+00 -3.351136227e+00 2.20 -3.986996224e+00 -3.987018502e+00 -3.542953895e+00 2.22 -4.020067913e+00 -4.068957985e+00 -3.710645593e+00 2.24 -4.042859046e+00 -4.136930051e+00 -3.856441492e+00 2.26 -4.056435501e+00 -4.192258982e+00 -3.982376694e+00 2.28 -4.061767217e+00 -4.236153443e+00 -4.090307844e+00 2.30 -4.059736328e+00 -4.269716014e+00 -4.181928055e+00 2.32 -4.051144666e+00 -4.293943085e+00 -4.258769805e+00 2.34 -4.036720654e+00 -4.309732409e+00 -4.322216909e+00 2.36 -4.017125647e+00 -4.317903391e+00 -4.373531773e+00 2.38 -3.992959759e+00 -4.319204489e+00 -4.413866725e+00 2.40 -3.964767212e+00 -4.314319183e+00 -4.444273389e+00 2.42 -3.933041239e+00 -4.303871448e+00 -4.465711293e+00 2.44 -3.898228592e+00 -4.288430792e+00 -4.479055747e+00 2.46 -3.860733654e+00 -4.268516850e+00 -4.485105062e+00 2.48 -3.820922222e+00 -4.244603622e+00 -4.484587168e+00 2.50 -3.779124805e+00 -4.217122941e+00 -4.478165119e+00 2.52 -3.735636609e+00 -4.186459555e+00 -4.466431196e+00 2.54 -3.690721213e+00 -4.152956498e+00 -4.449914832e+00 2.56 -3.644616805e+00 -4.116927663e+00 -4.429100235e+00 2.58 -3.597538595e+00 -4.078660565e+00 -4.404430682e+00 2.60 -3.549680885e+00 -4.038418502e+00 -4.376311941e+00 2.62 -3.501218947e+00 -3.996442528e+00 -4.345115405e+00 2.64 -3.452310740e+00 -3.952953274e+00 -4.311180968e+00 2.66 -3.403098478e+00 -3.908152618e+00 -4.274819665e+00 2.68 -3.353710055e+00 -3.862225222e+00 -4.236316091e+00 2.70 -3.304260339e+00 -3.815339945e+00 -4.195930624e+00 2.72 -3.254852357e+00 -3.767651136e+00 -4.153901462e+00 2.74 -3.205578360e+00 -3.719299830e+00 -4.110446488e+00 2.76 -3.156520802e+00 -3.670414840e+00 -4.065764983e+00 2.78 -3.107753215e+00 -3.621113764e+00 -4.020039198e+00 2.80 -3.059341007e+00 -3.571503904e+00 -3.973435788e+00 2.82 -3.011342182e+00 -3.521683121e+00 -3.926107134e+00 2.84 -2.963807986e+00 -3.471740605e+00 -3.878192546e+00 2.86 -2.916783489e+00 -3.421757596e+00 -3.829819373e+00 2.88 -2.870308111e+00 -3.371808033e+00 -3.781104009e+00 2.90 -2.824416082e+00 -3.321959161e+00 -3.732152824e+00 2.92 -2.779136864e+00 -3.272272080e+00 -3.683063008e+00 2.94 -2.734495518e+00 -3.222802250e+00 -3.633923345e+00 2.96 -2.690513034e+00 -3.173599955e+00 -3.584814918e+00 2.98 -2.647206615e+00 -3.124710729e+00 -3.535811756e+00 3.00 -2.604589934e+00 -3.076175746e+00 -3.486981422e+00 3.02 -2.562673352e+00 -3.028032173e+00 -3.438385545e+00 3.04 -2.521464106e+00 -2.980313498e+00 -3.390080308e+00 3.06 -2.480966475e+00 -2.933049829e+00 -3.342116888e+00 3.08 -2.441181915e+00 -2.886268164e+00 -3.294541854e+00 3.10 -2.402109175e+00 -2.839992640e+00 -3.247397529e+00 3.12 -2.363744392e+00 -2.794244758e+00 -3.200722308e+00 3.14 -2.326081171e+00 -2.749043591e+00 -3.154550952e+00 3.16 -2.289110648e+00 -2.704405968e+00 -3.108914838e+00 3.18 -2.252821542e+00 -2.660346643e+00 -3.063842190e+00 3.20 -2.217200208e+00 -2.616878449e+00 -3.019358271e+00 3.22 -2.182230672e+00 -2.574012434e+00 -2.975485558e+00 3.24 -2.147894685e+00 -2.531757986e+00 -2.932243883e+00 3.26 -2.114171764e+00 -2.490122942e+00 -2.889650555e+00 3.28 -2.081039262e+00 -2.449113690e+00 -2.847720456e+00 3.30 -2.048472443e+00 -2.408735252e+00 -2.806466111e+00 3.32 -2.016444586e+00 -2.368991367e+00 -2.765897751e+00 3.34 -1.984927114e+00 -2.329884556e+00 -2.726023334e+00 3.36 -1.953889757e+00 -2.291416184e+00 -2.686848566e+00 3.38 -1.923300766e+00 -2.253586508e+00 -2.648376894e+00 3.40 -1.893127157e+00 -2.216394722e+00 -2.610609480e+00 3.42 -1.863335013e+00 -2.179838995e+00 -2.573545165e+00 3.44 -1.833889843e+00 -2.143916501e+00 -2.537180414e+00 3.46 -1.804756980e+00 -2.108623439e+00 -2.501509248e+00 3.48 -1.775902040e+00 -2.073955054e+00 -2.466522927e+00 3.50 -1.747291423e+00 -2.039905650e+00 -2.432204541e+00 3.52 -1.718892845e+00 -2.006468600e+00 -2.398527351e+00 3.54 -1.690675905e+00 -1.973636346e+00 -2.365500363e+00 3.56 -1.662612645e+00 -1.941400405e+00 -2.333118213e+00 3.58 -1.634678110e+00 -1.909751369e+00 -2.301337664e+00 3.60 -1.606850870e+00 -1.878678903e+00 -2.270133399e+00 3.62 -1.579113484e+00 -1.848171741e+00 -2.239477127e+00 3.64 -1.551452884e+00 -1.818217694e+00 -2.209337608e+00 3.66 -1.523860654e+00 -1.788803646e+00 -2.179680734e+00 3.68 -1.496333194e+00 -1.759915566e+00 -2.150469670e+00 3.70 -1.468871732e+00 -1.731538520e+00 -2.121665065e+00 3.72 -1.441482211e+00 -1.703656697e+00 -2.093225357e+00 3.74 -1.414175014e+00 -1.676253438e+00 -2.065107163e+00 3.76 -1.386964566e+00 -1.649311281e+00 -2.037265772e+00 3.78 -1.359868807e+00 -1.622812022e+00 -2.009655749e+00 3.80 -1.332908571e+00 -1.596736787e+00 -1.982231631e+00 3.82 -1.306106895e+00 -1.571066127e+00 -1.954948726e+00 3.84 -1.279488289e+00 -1.545780128e+00 -1.927763987e+00 3.86 -1.253078003e+00 -1.520858542e+00 -1.900636948e+00 3.88 -1.226901320e+00 -1.496280941e+00 -1.873530672e+00 3.90 -1.200982905e+00 -1.472026890e+00 -1.846412696e+00 3.92 -1.175346237e+00 -1.448076137e+00 -1.819255905e+00 3.94 -1.150013127e+00 -1.424408821e+00 -1.792039294e+00 3.96 -1.125003361e+00 -1.401005694e+00 -1.764748567e+00 3.98 -1.100334439e+00 -1.377848353e+00 -1.737376531e+00 4.00 -1.076021433e+00 -1.354919476e+00 -1.709923239e+00 4.02 -1.051772218e+00 -1.332203047e+00 -1.682395871e+00 4.04 -1.023423951e+00 -1.309684586e+00 -1.654808336e+00 4.06 -9.821085565e-01 -1.287351346e+00 -1.627180630e+00 4.08 -9.348093320e-01 -1.265192490e+00 -1.599537948e+00 4.10 -9.130775652e-01 -1.243199237e+00 -1.571909642e+00 4.12 -8.924035481e-01 -1.221364965e+00 -1.544328051e+00 4.14 -8.721094032e-01 -1.199685258e+00 -1.516827292e+00 4.16 -8.521916336e-01 -1.178157921e+00 -1.489442078e+00 4.18 -8.326465415e-01 -1.156782924e+00 -1.462206616e+00 4.20 -8.134702709e-01 -1.135562300e+00 -1.435153656e+00 4.22 -7.946588419e-01 -1.114500000e+00 -1.408313709e+00 4.24 -7.762081766e-01 -1.093601689e+00 -1.381714474e+00 4.26 -7.581141193e-01 -1.072854509e+00 -1.355380466e+00 4.28 -7.403724511e-01 -1.051857977e+00 -1.329332842e+00 4.30 -7.229789018e-01 -1.029500167e+00 -1.303589402e+00 4.32 -7.059291574e-01 -1.005511787e+00 -1.278164728e+00 4.34 -6.892188671e-01 -9.845114728e-01 -1.253070440e+00 4.36 -6.728436473e-01 -9.648889047e-01 -1.228315511e+00 4.38 -6.567990856e-01 -9.455025878e-01 -1.203906623e+00 4.40 -6.399136606e-01 -9.263617888e-01 -1.179848530e+00 4.42 -6.013046698e-01 -9.074750463e-01 -1.156144398e+00 4.44 -4.851326521e-01 -8.888500416e-01 -1.132796117e+00 4.46 -2.590129924e-01 -8.704935065e-01 -1.109804559e+00 4.48 -1.017446292e-01 -8.524111676e-01 -1.087169807e+00 4.50 -9.874059958e-02 -8.346077253e-01 -1.064891318e+00 4.52 -9.582341603e-02 -8.170868613e-01 -1.042968063e+00 4.54 -9.299057805e-02 -7.998512730e-01 -1.021398628e+00 4.56 -9.023966001e-02 -7.829027274e-01 -1.000181281e+00 4.58 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-6.737172420e-01 4.94 -4.859943802e-02 -4.920153646e-01 -6.332909546e-01 4.96 -3.889689693e-02 -3.985771815e-01 -5.151057397e-01 4.98 -1.931815683e-02 -2.020089762e-01 -2.639932375e-01 5.00 -1.538773585e-23 -8.376912255e-23 -7.905295056e-23 5.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.30 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