# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2013--Smirnova-D-E-Kuksin-A-Y-Starikov-S-V-et-al--U-Mo-Xe # implementation = EAM_Dynamo_SmirnovaKuskinStarikov_2013_UMoXe__MO_679329885632_005 # composition = UXe2 # 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 C1--CaF2--fluori 0.50 nan 0.52 nan 0.54 nan 0.56 nan 0.58 nan 0.60 nan 0.62 nan 0.64 nan 0.66 nan 0.68 nan 0.70 nan 0.72 nan 0.74 nan 0.76 nan 0.78 nan 0.80 nan 0.82 nan 0.84 nan 0.86 nan 0.88 nan 0.90 nan 0.92 nan 0.94 nan 0.96 nan 0.98 nan 1.00 nan 1.02 nan 1.04 nan 1.06 nan 1.08 nan 1.10 nan 1.12 nan 1.14 nan 1.16 nan 1.18 nan 1.20 nan 1.22 nan 1.24 nan 1.26 nan 1.28 nan 1.30 nan 1.32 nan 1.34 nan 1.36 nan 1.38 nan 1.40 nan 1.42 nan 1.44 nan 1.46 nan 1.48 nan 1.50 nan 1.52 nan 1.54 nan 1.56 nan 1.58 nan 1.60 nan 1.62 nan 1.64 nan 1.66 nan 1.68 nan 1.70 nan 1.72 nan 1.74 nan 1.76 nan 1.78 nan 1.80 nan 1.82 nan 1.84 nan 1.86 nan 1.88 nan 1.90 nan 1.92 nan 1.94 nan 1.96 nan 1.98 nan 2.00 nan 2.02 nan 2.04 nan 2.06 nan 2.08 3.097943759e+01 2.10 2.856235981e+01 2.12 2.646051573e+01 2.14 2.463461348e+01 2.16 2.305331384e+01 2.18 2.168415641e+01 2.20 2.049016710e+01 2.22 1.940631433e+01 2.24 1.840670221e+01 2.26 1.746209603e+01 2.28 1.655203002e+01 2.30 1.566292815e+01 2.32 1.477839031e+01 2.34 1.389018910e+01 2.36 1.299819637e+01 2.38 1.211807697e+01 2.40 1.126892902e+01 2.42 1.030310927e+01 2.44 9.520954282e+00 2.46 8.802740706e+00 2.48 8.146531542e+00 2.50 7.547398401e+00 2.52 6.999552667e+00 2.54 6.495247636e+00 2.56 6.024184810e+00 2.58 5.576410792e+00 2.60 5.149823453e+00 2.62 4.747801963e+00 2.64 4.372347311e+00 2.66 4.022044667e+00 2.68 3.693824624e+00 2.70 3.382213497e+00 2.72 3.083839304e+00 2.74 2.799369649e+00 2.76 2.531108290e+00 2.78 2.283961369e+00 2.80 2.064516200e+00 2.82 1.876172462e+00 2.84 1.719128082e+00 2.86 1.593694433e+00 2.88 1.500564227e+00 2.90 1.439835422e+00 2.92 1.407867238e+00 2.94 1.399120297e+00 2.96 1.406668737e+00 2.98 1.422111612e+00 3.00 1.435801811e+00 3.02 1.438169351e+00 3.04 1.425156246e+00 3.06 1.399273767e+00 3.08 1.364245493e+00 3.10 1.324231865e+00 3.12 1.281782727e+00 3.14 1.240053511e+00 3.16 1.202346833e+00 3.18 1.171096378e+00 3.20 1.148628581e+00 3.22 1.137469916e+00 3.24 1.139942710e+00 3.26 1.127629952e+00 3.28 1.105861021e+00 3.30 1.086168356e+00 3.32 1.068417669e+00 3.34 1.052484614e+00 3.36 1.038184232e+00 3.38 1.025320602e+00 3.40 1.013702949e+00 3.42 1.003161236e+00 3.44 9.936198432e-01 3.46 9.852631343e-01 3.48 9.783657644e-01 3.50 9.732414685e-01 3.52 9.702417316e-01 3.54 9.698036020e-01 3.56 9.603444695e-01 3.58 9.231466059e-01 3.60 8.887813395e-01 3.62 8.591040093e-01 3.64 8.357260356e-01 3.66 8.200558336e-01 3.68 8.131335407e-01 3.70 8.136679412e-01 3.72 8.193784383e-01 3.74 8.279599358e-01 3.76 8.370115509e-01 3.78 8.439939253e-01 3.80 8.462976898e-01 3.82 8.458314264e-01 3.84 8.440762277e-01 3.86 8.408828791e-01 3.88 8.359830026e-01 3.90 8.290606577e-01 3.92 8.198786487e-01 3.94 8.082141401e-01 3.96 7.938509743e-01 3.98 7.765759773e-01 4.00 7.561785675e-01 4.02 7.324414166e-01 4.04 7.051239554e-01 4.06 6.712526757e-01 4.08 6.330934987e-01 4.10 5.926219159e-01 4.12 5.505670021e-01 4.14 5.076491648e-01 4.16 4.645869061e-01 4.18 4.221039288e-01 4.20 3.809425749e-01 4.22 3.418785013e-01 4.24 3.057409492e-01 4.26 2.734356630e-01 4.28 2.459707740e-01 4.30 2.238003354e-01 4.32 2.181259492e-01 4.34 2.208755810e-01 4.36 2.255022465e-01 4.38 2.312466769e-01 4.40 2.373497695e-01 4.42 2.430522918e-01 4.44 2.475951936e-01 4.46 2.502513614e-01 4.48 2.503739518e-01 4.50 2.473827126e-01 4.52 2.413691882e-01 4.54 2.328780496e-01 4.56 2.224625284e-01 4.58 2.106758588e-01 4.60 1.980712975e-01 4.62 1.852020222e-01 4.64 1.726045349e-01 4.66 1.607268458e-01 4.68 1.499878981e-01 4.70 1.408065327e-01 4.72 1.334941098e-01 4.74 1.278880305e-01 4.76 1.236953436e-01 4.78 1.206230880e-01 4.80 1.183782632e-01 4.82 1.166694325e-01 4.84 1.152235356e-01 4.86 1.137797175e-01 4.88 1.120772729e-01 4.90 1.098555426e-01 4.92 1.068550823e-01 4.94 1.029189672e-01 4.96 9.807089526e-02 4.98 9.235291789e-02 5.00 8.580702380e-02 5.02 7.847377151e-02 5.04 7.039167234e-02 5.06 6.159925361e-02 5.08 5.213497639e-02 5.10 4.203727708e-02 5.12 3.134464774e-02 5.14 2.009957123e-02 5.16 8.403576571e-03 5.18 -3.596689046e-03 5.20 -1.571252856e-02 5.22 -2.765141654e-02 5.24 -3.910469634e-02 5.26 -4.976371644e-02 5.28 -5.931983275e-02 5.30 -6.746436787e-02 5.32 -7.388869230e-02 5.34 -7.828414844e-02 5.36 -8.037940891e-02 5.38 -8.051623016e-02 5.40 -7.935279701e-02 5.42 -7.702599304e-02 5.44 -7.366685637e-02 5.46 -6.940641640e-02 5.48 -6.437573135e-02 5.50 -5.870584158e-02 5.52 -5.252779872e-02 5.54 -4.597261084e-02 5.56 -3.917134049e-02 5.58 -3.225009248e-02 5.60 -2.532527421e-02 5.62 -1.851215216e-02 5.64 -1.192598359e-02 5.66 -5.682033478e-03 5.68 1.044394217e-04 5.70 5.318174347e-03 5.72 9.843910132e-03 5.74 1.356638664e-02 5.76 1.637034498e-02 5.78 1.814798605e-02 5.80 1.892375372e-02 5.82 1.883548885e-02 5.84 1.802470069e-02 5.86 1.663290477e-02 5.88 1.480161472e-02 5.90 1.267234182e-02 5.92 1.038660122e-02 5.94 8.085906750e-03 5.96 1.032346680e-02 5.98 1.171298588e-02 6.00 1.218952716e-02