# 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 = Mo2UXe # 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 L2_1--AlCu2Mn--h L2_1--AlCu2Mn--h 0.50 nan nan 0.52 nan nan 0.54 nan nan 0.56 nan nan 0.58 nan nan 0.60 nan nan 0.62 nan nan 0.64 nan nan 0.66 nan nan 0.68 nan nan 0.70 nan nan 0.72 nan nan 0.74 nan nan 0.76 nan nan 0.78 nan nan 0.80 nan nan 0.82 nan nan 0.84 nan nan 0.86 nan nan 0.88 nan nan 0.90 nan nan 0.92 nan nan 0.94 nan nan 0.96 nan nan 0.98 nan nan 1.00 nan nan 1.02 nan nan 1.04 nan nan 1.06 nan nan 1.08 nan nan 1.10 nan nan 1.12 nan nan 1.14 nan nan 1.16 nan nan 1.18 nan nan 1.20 nan nan 1.22 nan nan 1.24 nan nan 1.26 nan nan 1.28 nan nan 1.30 nan nan 1.32 nan nan 1.34 nan nan 1.36 nan nan 1.38 nan nan 1.40 nan nan 1.42 nan nan 1.44 nan nan 1.46 nan nan 1.48 nan nan 1.50 nan nan 1.52 nan nan 1.54 nan nan 1.56 nan nan 1.58 nan nan 1.60 nan nan 1.62 nan nan 1.64 nan nan 1.66 nan nan 1.68 nan nan 1.70 nan nan 1.72 nan nan 1.74 nan nan 1.76 nan nan 1.78 nan nan 1.80 nan nan 1.82 nan nan 1.84 nan nan 1.86 nan nan 1.88 nan nan 1.90 nan nan 1.92 nan nan 1.94 nan nan 1.96 nan nan 1.98 nan nan 2.00 nan nan 2.02 nan nan 2.04 nan nan 2.06 nan nan 2.08 nan nan 2.10 nan nan 2.12 nan nan 2.14 9.084358830e+01 9.084358830e+01 2.16 7.617291103e+01 7.617291103e+01 2.18 6.152341477e+01 6.152341477e+01 2.20 4.723895311e+01 4.723895311e+01 2.22 3.178741544e+01 3.178741544e+01 2.24 2.230154716e+01 2.230154716e+01 2.26 1.545961419e+01 1.545961419e+01 2.28 1.080857943e+01 1.080857943e+01 2.30 7.880851767e+00 7.880851767e+00 2.32 6.207852024e+00 6.207852024e+00 2.34 5.315749997e+00 5.315749997e+00 2.36 4.729088998e+00 4.729088998e+00 2.38 4.180877249e+00 4.180877249e+00 2.40 3.644118206e+00 3.644118206e+00 2.42 3.088708866e+00 3.088708866e+00 2.44 2.558913444e+00 2.558913444e+00 2.46 2.062562678e+00 2.062562678e+00 2.48 1.595649656e+00 1.595649656e+00 2.50 1.147436206e+00 1.147436206e+00 2.52 7.202059091e-01 7.202059091e-01 2.54 3.185097429e-01 3.185097429e-01 2.56 -5.422659497e-02 -5.422659497e-02 2.58 -3.957931870e-01 -3.957931870e-01 2.60 -7.045058283e-01 -7.045058283e-01 2.62 -9.784922872e-01 -9.784922872e-01 2.64 -1.217121904e+00 -1.217121904e+00 2.66 -1.421859812e+00 -1.421859812e+00 2.68 -1.594825925e+00 -1.594825925e+00 2.70 -1.738956800e+00 -1.738956800e+00 2.72 -1.857712590e+00 -1.857712590e+00 2.74 -1.953983440e+00 -1.953983440e+00 2.76 -2.030150243e+00 -2.030150243e+00 2.78 -2.088022369e+00 -2.088022369e+00 2.80 -2.129167798e+00 -2.129167798e+00 2.82 -2.154596396e+00 -2.154596396e+00 2.84 -2.164263876e+00 -2.164263876e+00 2.86 -2.158870112e+00 -2.158870112e+00 2.88 -2.140414750e+00 -2.140414750e+00 2.90 -2.112050003e+00 -2.112050003e+00 2.92 -2.076995080e+00 -2.076995080e+00 2.94 -2.039015049e+00 -2.039015049e+00 2.96 -2.002115510e+00 -2.002115510e+00 2.98 -1.970024458e+00 -1.970024458e+00 3.00 -1.945690492e+00 -1.945690492e+00 3.02 -1.931769993e+00 -1.931769993e+00 3.04 -1.928262616e+00 -1.928262616e+00 3.06 -1.931344352e+00 -1.931344352e+00 3.08 -1.936654806e+00 -1.936654806e+00 3.10 -1.939854983e+00 -1.939854983e+00 3.12 -1.938735664e+00 -1.938735664e+00 3.14 -1.931192584e+00 -1.931192584e+00 3.16 -1.915782612e+00 -1.915782612e+00 3.18 -1.892120580e+00 -1.892120580e+00 3.20 -1.860222288e+00 -1.860222288e+00 3.22 -1.820674267e+00 -1.820674267e+00 3.24 -1.774858529e+00 -1.774858529e+00 3.26 -1.725407175e+00 -1.725407175e+00 3.28 -1.672796172e+00 -1.672796172e+00 3.30 -1.617002771e+00 -1.617002771e+00 3.32 -1.558480573e+00 -1.558480573e+00 3.34 -1.497771943e+00 -1.497771943e+00 3.36 -1.435583519e+00 -1.435583519e+00 3.38 -1.372805225e+00 -1.372805225e+00 3.40 -1.310365596e+00 -1.310365596e+00 3.42 -1.249179943e+00 -1.249179943e+00 3.44 -1.190159011e+00 -1.190159011e+00 3.46 -1.134545203e+00 -1.134545203e+00 3.48 -1.083718554e+00 -1.083718554e+00 3.50 -1.039126512e+00 -1.039126512e+00 3.52 -1.002267843e+00 -1.002267843e+00 3.54 -9.742494055e-01 -9.742494055e-01 3.56 -9.545701981e-01 -9.545701981e-01 3.58 -9.416633927e-01 -9.416633927e-01 3.60 -9.340082819e-01 -9.340082819e-01 3.62 -9.302171419e-01 -9.302171419e-01 3.64 -9.289715479e-01 -9.289715479e-01 3.66 -9.286986868e-01 -9.286986868e-01 3.68 -9.274582024e-01 -9.274582024e-01 3.70 -9.240426466e-01 -9.240426466e-01 3.72 -9.177708647e-01 -9.177708647e-01 3.74 -9.090230221e-01 -9.090230221e-01 3.76 -8.986828111e-01 -8.986828111e-01 3.78 -8.879085067e-01 -8.879085067e-01 3.80 -8.781613570e-01 -8.781613570e-01 3.82 -8.704531565e-01 -8.704531565e-01 3.84 -8.650134144e-01 -8.650134144e-01 3.86 -8.621510581e-01 -8.621510581e-01 3.88 -8.615903952e-01 -8.615903952e-01 3.90 -8.626968166e-01 -8.626968166e-01 3.92 -8.645794933e-01 -8.645794933e-01 3.94 -8.662115431e-01 -8.662115431e-01 3.96 -8.665839194e-01 -8.665839194e-01 3.98 -8.646913960e-01 -8.646913960e-01 4.00 -8.657480351e-01 -8.657480351e-01 4.02 -8.668771828e-01 -8.668771828e-01 4.04 -8.619657773e-01 -8.619657773e-01 4.06 -8.498886177e-01 -8.498886177e-01 4.08 -8.298434923e-01 -8.298434923e-01 4.10 -8.024088112e-01 -8.024088112e-01 4.12 -7.684934370e-01 -7.684934370e-01 4.14 -7.242723784e-01 -7.242723784e-01 4.16 -6.745367327e-01 -6.745367327e-01 4.18 -6.209038166e-01 -6.209038166e-01 4.20 -5.646014103e-01 -5.646014103e-01 4.22 -5.069167409e-01 -5.069167409e-01 4.24 -4.491918956e-01 -4.491918956e-01 4.26 -3.928157591e-01 -3.928157591e-01 4.28 -3.391619250e-01 -3.391619250e-01 4.30 -2.891724219e-01 -2.891724219e-01 4.32 -2.432171635e-01 -2.432171635e-01 4.34 -2.015997953e-01 -2.015997953e-01 4.36 -2.071842863e-01 -2.071842863e-01 4.38 -2.129705134e-01 -2.129705134e-01 4.40 -2.171025534e-01 -2.171025534e-01 4.42 -2.196452914e-01 -2.196452914e-01 4.44 -2.206635227e-01 -2.206635227e-01 4.46 -2.202294148e-01 -2.202294148e-01 4.48 -2.184488332e-01 -2.184488332e-01 4.50 -2.154376180e-01 -2.154376180e-01 4.52 -2.113160153e-01 -2.113160153e-01 4.54 -2.062073386e-01 -2.062073386e-01 4.56 -2.002348813e-01 -2.002348813e-01 4.58 -1.935219816e-01 -1.935219816e-01 4.60 -1.861919723e-01 -1.861919723e-01 4.62 -1.783681855e-01 -1.783681855e-01 4.64 -1.701832833e-01 -1.701832833e-01 4.66 -1.618648212e-01 -1.618648212e-01 4.68 -1.536958427e-01 -1.536958427e-01 4.70 -1.459600230e-01 -1.459600230e-01 4.72 -1.388925902e-01 -1.388925902e-01 4.74 -1.325152699e-01 -1.325152699e-01 4.76 -1.267910694e-01 -1.267910694e-01 4.78 -1.216829793e-01 -1.216829793e-01 4.80 -1.171539271e-01 -1.171539271e-01 4.82 -1.131673752e-01 -1.131673752e-01 4.84 -1.096991660e-01 -1.096991660e-01 4.86 -1.067391617e-01 -1.067391617e-01 4.88 -1.042779954e-01 -1.042779954e-01 4.90 -1.023062437e-01 -1.023062437e-01 4.92 -1.008150770e-01 -1.008150770e-01 4.94 -9.983821362e-02 -9.983821362e-02 4.96 -9.948440628e-02 -9.948440628e-02 4.98 -9.987004424e-02 -9.987004424e-02 5.00 -1.011110664e-01 -1.011110664e-01 5.02 -1.032342444e-01 -1.032342444e-01 5.04 -1.060687978e-01 -1.060687978e-01 5.06 -1.094174066e-01 -1.094174066e-01 5.08 -1.130828053e-01 -1.130828053e-01 5.10 -1.168677348e-01 -1.168677348e-01 5.12 -1.205748428e-01 -1.205748428e-01 5.14 -1.240082872e-01 -1.240082872e-01 5.16 -1.269928468e-01 -1.269928468e-01 5.18 -1.293689611e-01 -1.293689611e-01 5.20 -1.310286899e-01 -1.310286899e-01 5.22 -1.320998346e-01 -1.320998346e-01 5.24 -1.327784942e-01 -1.327784942e-01 5.26 -1.332607442e-01 -1.332607442e-01 5.28 -1.337426115e-01 -1.337426115e-01 5.30 -1.344201446e-01 -1.344201446e-01 5.32 -1.354894185e-01 -1.354894185e-01 5.34 -1.371464745e-01 -1.371464745e-01 5.36 -1.395702388e-01 -1.395702388e-01 5.38 -1.426428916e-01 -1.426428916e-01 5.40 -1.457435732e-01 -1.457435732e-01 5.42 -1.487374415e-01 -1.487374415e-01 5.44 -1.519267848e-01 -1.519267848e-01 5.46 -1.546653630e-01 -1.546653630e-01 5.48 -1.568219057e-01 -1.568219057e-01 5.50 -1.583110178e-01 -1.583110178e-01 5.52 -1.590473221e-01 -1.590473221e-01 5.54 -1.589453759e-01 -1.589453759e-01 5.56 -1.583749711e-01 -1.583749711e-01 5.58 -1.569798247e-01 -1.569798247e-01 5.60 -1.547229973e-01 -1.547229973e-01 5.62 -1.516160628e-01 -1.516160628e-01 5.64 -1.476707096e-01 -1.476707096e-01 5.66 -1.428985966e-01 -1.428985966e-01 5.68 -1.373113378e-01 -1.373113378e-01 5.70 -1.309205908e-01 -1.309205908e-01 5.72 -1.237379698e-01 -1.237379698e-01 5.74 -1.157751596e-01 -1.157751596e-01 5.76 -1.070438224e-01 -1.070438224e-01 5.78 -9.756220061e-02 -9.756220061e-02 5.80 -8.746665642e-02 -8.746665642e-02 5.82 -7.699464525e-02 -7.699464525e-02 5.84 -6.638701129e-02 -6.638701129e-02 5.86 -5.588446632e-02 -5.588446632e-02 5.88 -4.572783637e-02 -4.572783637e-02 5.90 -3.615789565e-02 -3.615789565e-02 5.92 -2.741541258e-02 -2.741541258e-02 5.94 -1.974116052e-02 -1.974116052e-02 5.96 -1.337595158e-02 -1.337595158e-02 5.98 -8.560543091e-03 -8.560543091e-03 6.00 -5.477671686e-03 -5.477671686e-03