# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2017--Mahdizadeh-S-J-Akhlamadi-G--Ge # implementation = 2017--Mahdizadeh-S-J--Ge--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 Ge Ge 0.02 1.260555626e+03 0.04 1.194534199e+03 0.06 1.131860728e+03 0.08 1.072368806e+03 0.10 1.015900189e+03 0.12 9.623044016e+02 0.14 9.114383565e+02 0.16 8.631659975e+02 0.18 8.173579558e+02 0.20 7.738912244e+02 0.22 7.326488484e+02 0.24 6.935196299e+02 0.26 6.563978474e+02 0.28 6.211829888e+02 0.30 5.877794973e+02 0.32 5.560965293e+02 0.34 5.260477247e+02 0.36 4.975509877e+02 0.38 4.705282786e+02 0.40 4.449054156e+02 0.42 4.206118860e+02 0.44 3.975806670e+02 0.46 3.757480548e+02 0.48 3.550535023e+02 0.50 3.354394644e+02 0.52 3.168512509e+02 0.54 2.992368868e+02 0.56 2.825469791e+02 0.58 2.667345899e+02 0.60 2.517551165e+02 0.62 2.375661761e+02 0.64 2.241274974e+02 0.66 2.114008165e+02 0.68 1.993497781e+02 0.70 1.879398419e+02 0.72 1.771381934e+02 0.74 1.669136586e+02 0.76 1.572366232e+02 0.78 1.480789563e+02 0.80 1.394139364e+02 0.82 1.312161826e+02 0.84 1.234615881e+02 0.86 1.161272573e+02 0.88 1.091914462e+02 0.90 1.026335048e+02 0.92 9.643382400e+01 0.94 9.057378310e+01 0.96 8.503570145e+01 0.98 7.980279166e+01 1.00 7.485911531e+01 1.02 7.018954086e+01 1.04 6.577970356e+01 1.06 6.161596737e+01 1.08 5.768538872e+01 1.10 5.397568207e+01 1.12 5.047518716e+01 1.14 4.717283784e+01 1.16 4.405813243e+01 1.18 4.112110562e+01 1.20 3.835230164e+01 1.22 3.574274882e+01 1.24 3.328393537e+01 1.26 3.096778639e+01 1.28 2.878664195e+01 1.30 2.673323634e+01 1.32 2.480067823e+01 1.34 2.298243194e+01 1.36 2.127229953e+01 1.38 1.966440381e+01 1.40 1.815317221e+01 1.42 1.673332142e+01 1.44 1.539984280e+01 1.46 1.414798852e+01 1.48 1.297325839e+01 1.50 1.187138731e+01 1.52 1.083833339e+01 1.54 9.870266605e+00 1.56 8.963558091e+00 1.58 8.114769893e+00 1.60 7.320645268e+00 1.62 6.578099461e+00 1.64 5.884210939e+00 1.66 5.236213064e+00 1.68 4.631486180e+00 1.70 4.067550096e+00 1.72 3.542056946e+00 1.74 3.052784401e+00 1.76 2.597629227e+00 1.78 2.174601162e+00 1.80 1.781817103e+00 1.82 1.417495577e+00 1.84 1.079951502e+00 1.86 7.675912016e-01 1.88 4.789076709e-01 1.90 2.124760873e-01 1.92 -3.305045930e-02 1.94 -2.589450169e-01 1.96 -4.664106192e-01 1.98 -6.565839381e-01 2.00 -8.305387519e-01 2.02 -9.892892372e-01 2.04 -1.133793095e+00 2.06 -1.264954515e+00 2.08 -1.383626998e+00 2.10 -1.490616020e+00 2.12 -1.586681576e+00 2.14 -1.672540584e+00 2.16 -1.748869171e+00 2.18 -1.816304841e+00 2.20 -1.875448531e+00 2.22 -1.926866562e+00 2.24 -1.971092494e+00 2.26 -2.008628878e+00 2.28 -2.039948926e+00 2.30 -2.065498088e+00 2.32 -2.085695553e+00 2.34 -2.100935672e+00 2.36 -2.111589302e+00 2.38 -2.118005088e+00 2.40 -2.120510671e+00 2.42 -2.119413841e+00 2.44 -2.115003625e+00 2.46 -2.107551318e+00 2.48 -2.097311462e+00 2.50 -2.084522775e+00 2.52 -2.069409029e+00 2.54 -2.052179883e+00 2.56 -2.033031669e+00 2.58 -2.012148146e+00 2.60 -1.989701202e+00 2.62 -1.965851528e+00 2.64 -1.940749249e+00 2.66 -1.914534532e+00 2.68 -1.887338151e+00 2.70 -1.859282025e+00 2.72 -1.830479733e+00 2.74 -1.801036993e+00 2.76 -1.771052120e+00 2.78 -1.740616459e+00 2.80 -1.709814795e+00 2.82 -1.660383647e+00 2.84 -1.576208534e+00 2.86 -1.461659686e+00 2.88 -1.322314707e+00 2.90 -1.164653772e+00 2.92 -9.957255811e-01 2.94 -8.228012089e-01 2.96 -6.530327123e-01 2.98 -4.931323278e-01 3.00 -3.490863233e-01 3.02 -2.259152430e-01 3.04 -1.274895177e-01 3.06 -5.640636689e-02 3.08 -1.393075042e-02 3.10 0.000000000e+00 3.12 0.000000000e+00 3.14 0.000000000e+00 3.16 0.000000000e+00 3.18 0.000000000e+00 3.20 0.000000000e+00 3.22 0.000000000e+00 3.24 0.000000000e+00 3.26 0.000000000e+00 3.28 0.000000000e+00 3.30 0.000000000e+00 3.32 0.000000000e+00 3.34 0.000000000e+00 3.36 0.000000000e+00 3.38 0.000000000e+00 3.40 0.000000000e+00 3.42 0.000000000e+00 3.44 0.000000000e+00 3.46 0.000000000e+00 3.48 0.000000000e+00 3.50 0.000000000e+00 3.52 0.000000000e+00 3.54 0.000000000e+00 3.56 0.000000000e+00 3.58 0.000000000e+00 3.60 0.000000000e+00 3.62 0.000000000e+00 3.64 0.000000000e+00 3.66 0.000000000e+00 3.68 0.000000000e+00 3.70 0.000000000e+00 3.72 0.000000000e+00 3.74 0.000000000e+00 3.76 0.000000000e+00 3.78 0.000000000e+00 3.80 0.000000000e+00 3.82 0.000000000e+00 3.84 0.000000000e+00 3.86 0.000000000e+00 3.88 0.000000000e+00 3.90 0.000000000e+00 3.92 0.000000000e+00 3.94 0.000000000e+00 3.96 0.000000000e+00 3.98 0.000000000e+00 4.00 0.000000000e+00 4.02 0.000000000e+00 4.04 0.000000000e+00 4.06 0.000000000e+00 4.08 0.000000000e+00 4.10 0.000000000e+00 4.12 0.000000000e+00 4.14 0.000000000e+00 4.16 0.000000000e+00 4.18 0.000000000e+00 4.20 0.000000000e+00 4.22 0.000000000e+00 4.24 0.000000000e+00 4.26 0.000000000e+00 4.28 0.000000000e+00 4.30 0.000000000e+00 4.32 0.000000000e+00 4.34 0.000000000e+00 4.36 0.000000000e+00 4.38 0.000000000e+00 4.40 0.000000000e+00 4.42 0.000000000e+00 4.44 0.000000000e+00 4.46 0.000000000e+00 4.48 0.000000000e+00 4.50 0.000000000e+00 4.52 0.000000000e+00 4.54 0.000000000e+00 4.56 0.000000000e+00 4.58 0.000000000e+00 4.60 0.000000000e+00 4.62 0.000000000e+00 4.64 0.000000000e+00 4.66 0.000000000e+00 4.68 0.000000000e+00 4.70 0.000000000e+00 4.72 0.000000000e+00 4.74 0.000000000e+00 4.76 0.000000000e+00 4.78 0.000000000e+00 4.80 0.000000000e+00 4.82 0.000000000e+00 4.84 0.000000000e+00 4.86 0.000000000e+00 4.88 0.000000000e+00 4.90 0.000000000e+00 4.92 0.000000000e+00 4.94 0.000000000e+00 4.96 0.000000000e+00 4.98 0.000000000e+00 5.00 0.000000000e+00 5.02 0.000000000e+00 5.04 0.000000000e+00 5.06 0.000000000e+00 5.08 0.000000000e+00 5.10 0.000000000e+00 5.12 0.000000000e+00 5.14 0.000000000e+00 5.16 0.000000000e+00 5.18 0.000000000e+00 5.20 0.000000000e+00 5.22 0.000000000e+00 5.24 0.000000000e+00 5.26 0.000000000e+00 5.28 0.000000000e+00 5.30 0.000000000e+00 5.32 0.000000000e+00 5.34 0.000000000e+00 5.36 0.000000000e+00 5.38 0.000000000e+00 5.40 0.000000000e+00 5.42 0.000000000e+00 5.44 0.000000000e+00 5.46 0.000000000e+00 5.48 0.000000000e+00 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