# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr # implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1 # composition = AgPb2Pt # 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 2024-04-11 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 3.969635485e+02 3.969635485e+02 1.30 3.709962090e+02 3.709962090e+02 1.32 3.467790804e+02 3.467790804e+02 1.34 3.241820348e+02 3.241820348e+02 1.36 3.030863772e+02 3.030863772e+02 1.38 2.833804805e+02 2.833804805e+02 1.40 2.649589982e+02 2.649589982e+02 1.42 2.477250494e+02 2.477250494e+02 1.44 2.315922832e+02 2.315922832e+02 1.46 2.164846231e+02 2.164846231e+02 1.48 2.023339586e+02 2.023339586e+02 1.50 1.890773085e+02 1.890773085e+02 1.52 1.766545007e+02 1.766545007e+02 1.54 1.650069933e+02 1.650069933e+02 1.56 1.540781828e+02 1.540781828e+02 1.58 1.438147289e+02 1.438147289e+02 1.60 1.341678945e+02 1.341678945e+02 1.62 1.250941150e+02 1.250941150e+02 1.64 1.165546639e+02 1.165546639e+02 1.66 1.085148388e+02 1.085148388e+02 1.68 1.009433059e+02 1.009433059e+02 1.70 9.381181237e+01 9.381181237e+01 1.72 8.709498576e+01 8.709498576e+01 1.74 8.081086555e+01 8.081086555e+01 1.76 7.497190762e+01 7.497190762e+01 1.78 6.954609643e+01 6.954609643e+01 1.80 6.450212162e+01 6.450212162e+01 1.82 5.981019309e+01 5.981019309e+01 1.84 5.544261345e+01 5.544261345e+01 1.86 5.137409082e+01 5.137409082e+01 1.88 4.758185384e+01 4.758185384e+01 1.90 4.404560534e+01 4.404560534e+01 1.92 4.074735128e+01 4.074735128e+01 1.94 3.767108792e+01 3.767108792e+01 1.96 3.480238141e+01 3.480238141e+01 1.98 3.212791399e+01 3.212791399e+01 2.00 2.963513282e+01 2.963513282e+01 2.02 2.731207291e+01 2.731207291e+01 2.04 2.514732391e+01 2.514732391e+01 2.06 2.313007054e+01 2.313007054e+01 2.08 2.125014705e+01 2.125014705e+01 2.10 1.949806610e+01 1.949806610e+01 2.12 1.786502078e+01 1.786502078e+01 2.14 1.634285953e+01 1.634285953e+01 2.16 1.492404770e+01 1.492404770e+01 2.18 1.360162951e+01 1.360162951e+01 2.20 1.236918814e+01 1.236918814e+01 2.22 1.122081163e+01 1.122081163e+01 2.24 1.015105479e+01 1.015105479e+01 2.26 9.154898169e+00 9.154898169e+00 2.28 8.227706184e+00 8.227706184e+00 2.30 7.365177692e+00 7.365177692e+00 2.32 6.563298135e+00 6.563298135e+00 2.34 5.818296778e+00 5.818296778e+00 2.36 5.126601143e+00 5.126601143e+00 2.38 4.484803485e+00 4.484803485e+00 2.40 3.889638976e+00 3.889638976e+00 2.42 3.337980905e+00 3.337980905e+00 2.44 2.826851272e+00 2.826851272e+00 2.46 2.353443872e+00 2.353443872e+00 2.48 1.915137453e+00 1.915137453e+00 2.50 1.508607673e+00 1.508607673e+00 2.52 1.131329096e+00 1.131329096e+00 2.54 7.816308896e-01 7.816308896e-01 2.56 4.579402376e-01 4.579402376e-01 2.58 1.587632507e-01 1.587632507e-01 2.60 -1.173272200e-01 -1.173272200e-01 2.62 -3.716947688e-01 -3.716947688e-01 2.64 -6.056420406e-01 -6.056420406e-01 2.66 -8.204007925e-01 -8.204007925e-01 2.68 -1.017133666e+00 -1.017133666e+00 2.70 -1.196931757e+00 -1.196931757e+00 2.72 -1.360815251e+00 -1.360815251e+00 2.74 -1.509735514e+00 -1.509735514e+00 2.76 -1.644578239e+00 -1.644578239e+00 2.78 -1.766167311e+00 -1.766167311e+00 2.80 -1.875270763e+00 -1.875270763e+00 2.82 -1.972605894e+00 -1.972605894e+00 2.84 -2.058848513e+00 -2.058848513e+00 2.86 -2.134643083e+00 -2.134643083e+00 2.88 -2.200615036e+00 -2.200615036e+00 2.90 -2.257384050e+00 -2.257384050e+00 2.92 -2.305576366e+00 -2.305576366e+00 2.94 -2.345833412e+00 -2.345833412e+00 2.96 -2.378813900e+00 -2.378813900e+00 2.98 -2.405187494e+00 -2.405187494e+00 3.00 -2.425620294e+00 -2.425620294e+00 3.02 -2.440760448e+00 -2.440760448e+00 3.04 -2.451285257e+00 -2.451285257e+00 3.06 -2.457698572e+00 -2.457698572e+00 3.08 -2.460400196e+00 -2.460400196e+00 3.10 -2.459735151e+00 -2.459735151e+00 3.12 -2.455997274e+00 -2.455997274e+00 3.14 -2.449444216e+00 -2.449444216e+00 3.16 -2.440298762e+00 -2.440298762e+00 3.18 -2.428763565e+00 -2.428763565e+00 3.20 -2.415024970e+00 -2.415024970e+00 3.22 -2.399257679e+00 -2.399257679e+00 3.24 -2.381626454e+00 -2.381626454e+00 3.26 -2.362280660e+00 -2.362280660e+00 3.28 -2.341353558e+00 -2.341353558e+00 3.30 -2.318963931e+00 -2.318963931e+00 3.32 -2.295266771e+00 -2.295266771e+00 3.34 -2.270378436e+00 -2.270378436e+00 3.36 -2.244395285e+00 -2.244395285e+00 3.38 -2.217407940e+00 -2.217407940e+00 3.40 -2.189502581e+00 -2.189502581e+00 3.42 -2.160764026e+00 -2.160764026e+00 3.44 -2.131275232e+00 -2.131275232e+00 3.46 -2.101118411e+00 -2.101118411e+00 3.48 -2.070374233e+00 -2.070374233e+00 3.50 -2.039120183e+00 -2.039120183e+00 3.52 -2.007421567e+00 -2.007421567e+00 3.54 -1.975333768e+00 -1.975333768e+00 3.56 -1.942910268e+00 -1.942910268e+00 3.58 -1.910202040e+00 -1.910202040e+00 3.60 -1.877257229e+00 -1.877257229e+00 3.62 -1.844121155e+00 -1.844121155e+00 3.64 -1.810836572e+00 -1.810836572e+00 3.66 -1.777444078e+00 -1.777444078e+00 3.68 -1.743982557e+00 -1.743982557e+00 3.70 -1.710489533e+00 -1.710489533e+00 3.72 -1.677001312e+00 -1.677001312e+00 3.74 -1.643552860e+00 -1.643552860e+00 3.76 -1.610177422e+00 -1.610177422e+00 3.78 -1.576905949e+00 -1.576905949e+00 3.80 -1.543766477e+00 -1.543766477e+00 3.82 -1.510783590e+00 -1.510783590e+00 3.84 -1.477978102e+00 -1.477978102e+00 3.86 -1.445367021e+00 -1.445367021e+00 3.88 -1.412963783e+00 -1.412963783e+00 3.90 -1.380778711e+00 -1.380778711e+00 3.92 -1.348819000e+00 -1.348819000e+00 3.94 -1.317091961e+00 -1.317091961e+00 3.96 -1.285601677e+00 -1.285601677e+00 3.98 -1.254352552e+00 -1.254352552e+00 4.00 -1.223349306e+00 -1.223349306e+00 4.02 -1.192597783e+00 -1.192597783e+00 4.04 -1.162105827e+00 -1.162105827e+00 4.06 -1.131884232e+00 -1.131884232e+00 4.08 -1.101947694e+00 -1.101947694e+00 4.10 -1.072314054e+00 -1.072314054e+00 4.12 -1.043011753e+00 -1.043011753e+00 4.14 -1.014069363e+00 -1.014069363e+00 4.16 -9.855228602e-01 -9.855228602e-01 4.18 -9.574127042e-01 -9.574127042e-01 4.20 -9.297822711e-01 -9.297822711e-01 4.22 -9.026757078e-01 -9.026757078e-01 4.24 -8.761354088e-01 -8.761354088e-01 4.26 -8.501993890e-01 -8.501993890e-01 4.28 -8.248988602e-01 -8.248988602e-01 4.30 -8.002562874e-01 -8.002562874e-01 4.32 -7.762841229e-01 -7.762841229e-01 4.34 -7.529842997e-01 -7.529842997e-01 4.36 -7.303484542e-01 -7.303484542e-01 4.38 -7.083587551e-01 -7.083587551e-01 4.40 -6.869891639e-01 -6.869891639e-01 4.42 -6.662069385e-01 -6.662069385e-01 4.44 -6.459742092e-01 -6.459742092e-01 4.46 -6.262494982e-01 -6.262494982e-01 4.48 -6.069890965e-01 -6.069890965e-01 4.50 -5.881482604e-01 -5.881482604e-01 4.52 -5.696822243e-01 -5.696822243e-01 4.54 -5.515470559e-01 -5.515470559e-01 4.56 -5.337003974e-01 -5.337003974e-01 4.58 -5.161021422e-01 -5.161021422e-01 4.60 -4.987150979e-01 -4.987150979e-01 4.62 -4.815056787e-01 -4.815056787e-01 4.64 -4.644446559e-01 -4.644446559e-01 4.66 -4.475079751e-01 -4.475079751e-01 4.68 -4.306776281e-01 -4.306776281e-01 4.70 -4.139425402e-01 -4.139425402e-01 4.72 -3.972994054e-01 -3.972994054e-01 4.74 -3.807533843e-01 -3.807533843e-01 4.76 -3.643185575e-01 -3.643185575e-01 4.78 -3.480180300e-01 -3.480180300e-01 4.80 -3.318821523e-01 -3.318821523e-01 4.82 -3.159536463e-01 -3.159536463e-01 4.84 -3.002769054e-01 -3.002769054e-01 4.86 -2.849026440e-01 -2.849026440e-01 4.88 -2.698839820e-01 -2.698839820e-01 4.90 -2.552740263e-01 -2.552740263e-01 4.92 -2.411234400e-01 -2.411234400e-01 4.94 -2.274781981e-01 -2.274781981e-01 4.96 -2.143777036e-01 -2.143777036e-01 4.98 -2.018533924e-01 -2.018533924e-01 5.00 -1.899278902e-01 -1.899278902e-01 5.02 -1.786147275e-01 -1.786147275e-01 5.04 -1.679185623e-01 -1.679185623e-01 5.06 -1.578358242e-01 -1.578358242e-01 5.08 -1.483556740e-01 -1.483556740e-01 5.10 -1.394611687e-01 -1.394611687e-01 5.12 -1.311305272e-01 -1.311305272e-01 5.14 -1.233384087e-01 -1.233384087e-01 5.16 -1.160571291e-01 -1.160571291e-01 5.18 -1.092577621e-01 -1.092577621e-01 5.20 -1.029110728e-01 -1.029110728e-01 5.22 -9.698828473e-02 -9.698828473e-02 5.24 -9.146165258e-02 -9.146165258e-02 5.26 -8.630484954e-02 -8.630484954e-02 5.28 -8.149317369e-02 -8.149317369e-02 5.30 -7.700361048e-02 -7.700361048e-02 5.32 -7.281478258e-02 -7.281478258e-02 5.34 -6.890681753e-02 -6.890681753e-02 5.36 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