# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2026--Koju-R-K-Li-Y-Mishin-Y--Pt-ADP # implementation = 2026--Koju-R-K--Pt-ADP--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 2026-06-16 r Pt Pt 0.02 3.646000499e+02 0.04 3.528979376e+02 0.06 3.415146200e+02 0.08 3.304424768e+02 0.10 3.196740575e+02 0.12 3.092020776e+02 0.14 2.990194158e+02 0.16 2.891191095e+02 0.18 2.794943520e+02 0.20 2.701384885e+02 0.22 2.610450132e+02 0.24 2.522075656e+02 0.26 2.436199278e+02 0.28 2.352760206e+02 0.30 2.271699015e+02 0.32 2.192957603e+02 0.34 2.116479177e+02 0.36 2.042208211e+02 0.38 1.970090424e+02 0.40 1.900072753e+02 0.42 1.832103324e+02 0.44 1.766131425e+02 0.46 1.702107483e+02 0.48 1.639983035e+02 0.50 1.579710708e+02 0.52 1.521244189e+02 0.54 1.464538207e+02 0.56 1.409548505e+02 0.58 1.356231822e+02 0.60 1.304545866e+02 0.62 1.254449297e+02 0.64 1.205901702e+02 0.66 1.158863577e+02 0.68 1.113296305e+02 0.70 1.069162138e+02 0.72 1.026424174e+02 0.74 9.850463438e+01 0.76 9.449933866e+01 0.78 9.062308358e+01 0.80 8.687250001e+01 0.82 8.324429456e+01 0.84 7.973524799e+01 0.86 7.634221349e+01 0.88 7.306211512e+01 0.90 6.989194618e+01 0.92 6.682876769e+01 0.94 6.386970691e+01 0.96 6.101195585e+01 0.98 5.825276979e+01 1.00 5.558946597e+01 1.02 5.301942217e+01 1.04 5.054007534e+01 1.06 4.814892036e+01 1.08 4.584350873e+01 1.10 4.362144733e+01 1.12 4.148039721e+01 1.14 3.941807243e+01 1.16 3.743223885e+01 1.18 3.552071309e+01 1.20 3.368136132e+01 1.22 3.191209829e+01 1.24 3.021088626e+01 1.26 2.857573393e+01 1.28 2.700469551e+01 1.30 2.549586975e+01 1.32 2.404739895e+01 1.34 2.265746811e+01 1.36 2.132430398e+01 1.38 2.004617422e+01 1.40 1.882138655e+01 1.42 1.764828792e+01 1.44 1.652526373e+01 1.46 1.545073700e+01 1.48 1.442316765e+01 1.50 1.344105177e+01 1.52 1.250292086e+01 1.54 1.160734115e+01 1.56 1.075291295e+01 1.58 9.938269904e+00 1.60 9.162078446e+00 1.62 8.423037099e+00 1.64 7.719875895e+00 1.66 7.051355770e+00 1.68 6.416267996e+00 1.70 5.813433609e+00 1.72 5.241702863e+00 1.74 4.699954698e+00 1.76 4.187096218e+00 1.78 3.702062183e+00 1.80 3.243814517e+00 1.82 2.811341826e+00 1.84 2.403658926e+00 1.86 2.019806388e+00 1.88 1.658850084e+00 1.90 1.319880753e+00 1.92 1.002013574e+00 1.94 7.043877416e-01 1.96 4.261660607e-01 1.98 1.665345414e-01 2.00 -7.529799483e-02 2.02 -3.001003030e-01 2.04 -5.086190936e-01 2.06 -7.015794084e-01 2.08 -8.796849895e-01 2.10 -1.043618639e+00 2.12 -1.194042582e+00 2.14 -1.331598815e+00 2.16 -1.456909459e+00 2.18 -1.570577103e+00 2.20 -1.673185144e+00 2.22 -1.765298131e+00 2.24 -1.847462097e+00 2.26 -1.920204893e+00 2.28 -1.984036520e+00 2.30 -2.039449459e+00 2.32 -2.086918996e+00 2.34 -2.126903552e+00 2.36 -2.159845003e+00 2.38 -2.186169011e+00 2.40 -2.206285336e+00 2.42 -2.220588170e+00 2.44 -2.229456449e+00 2.46 -2.233254180e+00 2.48 -2.232330757e+00 2.50 -2.227021281e+00 2.52 -2.217646881e+00 2.54 -2.204515033e+00 2.56 -2.187919875e+00 2.58 -2.168142529e+00 2.60 -2.145451414e+00 2.62 -2.120102566e+00 2.64 -2.092339952e+00 2.66 -2.062395784e+00 2.68 -2.030490838e+00 2.70 -1.996834759e+00 2.72 -1.961626381e+00 2.74 -1.925054035e+00 2.76 -1.887295854e+00 2.78 -1.848520088e+00 2.80 -1.808885403e+00 2.82 -1.768541190e+00 2.84 -1.727627863e+00 2.86 -1.686277160e+00 2.88 -1.644612438e+00 2.90 -1.602748972e+00 2.92 -1.560794241e+00 2.94 -1.518848216e+00 2.96 -1.477003650e+00 2.98 -1.435346354e+00 3.00 -1.393955478e+00 3.02 -1.352903783e+00 3.04 -1.312257911e+00 3.06 -1.272078652e+00 3.08 -1.232421207e+00 3.10 -1.193335439e+00 3.12 -1.154866133e+00 3.14 -1.117053237e+00 3.16 -1.079932108e+00 3.18 -1.043533751e+00 3.20 -1.007885048e+00 3.22 -9.730089880e-01 3.24 -9.389248878e-01 3.26 -9.056486094e-01 3.28 -8.731927698e-01 3.30 -8.415669486e-01 3.32 -8.107778859e-01 3.34 -7.808296769e-01 3.36 -7.517239615e-01 3.38 -7.234601057e-01 3.40 -6.960353794e-01 3.42 -6.694451266e-01 3.44 -6.436829315e-01 3.46 -6.187407777e-01 3.48 -5.946092015e-01 3.50 -5.712774396e-01 3.52 -5.487335715e-01 3.54 -5.269646547e-01 3.56 -5.059568559e-01 3.58 -4.856955750e-01 3.60 -4.661655633e-01 3.62 -4.473510372e-01 3.64 -4.292357842e-01 3.66 -4.118032652e-01 3.68 -3.950367094e-01 3.70 -3.789192036e-01 3.72 -3.634337760e-01 3.74 -3.485634752e-01 3.76 -3.342914401e-01 3.78 -3.206009671e-01 3.80 -3.074755697e-01 3.82 -2.948990312e-01 3.84 -2.828554521e-01 3.86 -2.713292917e-01 3.88 -2.603053998e-01 3.90 -2.497690462e-01 3.92 -2.397059392e-01 3.94 -2.301022389e-01 3.96 -2.209445631e-01 3.98 -2.122199849e-01 4.00 -2.039160232e-01 4.02 -1.960206254e-01 4.04 -1.885221422e-01 4.06 -1.814092944e-01 4.08 -1.746711324e-01 4.10 -1.682969878e-01 4.12 -1.622764182e-01 4.14 -1.565991451e-01 4.16 -1.512549857e-01 4.18 -1.462337795e-01 4.20 -1.415253108e-01 4.22 -1.371192286e-01 4.24 -1.330049643e-01 4.26 -1.291716510e-01 4.28 -1.256080436e-01 4.30 -1.223024453e-01 4.32 -1.192426393e-01 4.34 -1.164158315e-01 4.36 -1.138086052e-01 4.38 -1.114068900e-01 4.40 -1.091959495e-01 4.42 -1.071603889e-01 4.44 -1.052841854e-01 4.46 -1.035507426e-01 4.48 -1.019429713e-01 4.50 -1.004433971e-01 4.52 -9.903429362e-02 4.54 -9.769784191e-02 4.56 -9.641631206e-02 4.58 -9.517226490e-02 4.60 -9.394876815e-02 4.62 -9.272962136e-02 4.64 -9.149958200e-02 4.66 -9.024458407e-02 4.68 -8.895194009e-02 4.70 -8.761051566e-02 4.72 -8.621086635e-02 4.74 -8.474532660e-02 4.76 -8.320804068e-02 4.78 -8.159492798e-02 4.80 -7.990357655e-02 4.82 -7.813306194e-02 4.84 -7.628369265e-02 4.86 -7.435668761e-02 4.88 -7.235379675e-02 4.90 -7.027688200e-02 4.92 -6.812748105e-02 4.94 -6.590638388e-02 4.96 -6.361325633e-02 4.98 -6.124635052e-02 5.00 -5.880234452e-02 5.02 -5.627635451e-02 5.04 -5.366216034e-02 5.06 -5.095267933e-02 5.08 -4.814071262e-02 5.10 -4.521997226e-02 5.12 -4.218637613e-02 5.14 -3.903957033e-02 5.16 -3.578460631e-02 5.18 -3.243366118e-02 5.20 -2.900765028e-02 5.22 -2.553753159e-02 5.24 -2.206502299e-02 5.26 -1.864275768e-02 5.28 -1.533310676e-02 5.30 -1.220570331e-02 5.32 -9.333459086e-03 5.34 -6.786928543e-03 5.36 -4.627096634e-03 5.38 -2.896957637e-03 5.40 -1.612686119e-03 5.42 -7.558224250e-04 5.44 -2.687589516e-04 5.46 -5.698912920e-05 5.48 -3.154247124e-06 5.50 0.000000000e+00 5.52 0.000000000e+00 5.54 0.000000000e+00 5.56 0.000000000e+00 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 6.00 0.000000000e+00 6.02 0.000000000e+00 6.04 0.000000000e+00 6.06 0.000000000e+00 6.08 0.000000000e+00 6.10 0.000000000e+00 6.12 0.000000000e+00 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