# 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 = CoMgMo2 # 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 3.098982787e+02 3.098982787e+02 1.30 2.864783056e+02 2.864783056e+02 1.32 2.648587021e+02 2.648587021e+02 1.34 2.448863765e+02 2.448863765e+02 1.36 2.264193965e+02 2.264193965e+02 1.38 2.093276635e+02 2.093276635e+02 1.40 1.934939104e+02 1.934939104e+02 1.42 1.788139736e+02 1.788139736e+02 1.44 1.651958400e+02 1.651958400e+02 1.46 1.525579638e+02 1.525579638e+02 1.48 1.408276304e+02 1.408276304e+02 1.50 1.299396051e+02 1.299396051e+02 1.52 1.198349361e+02 1.198349361e+02 1.54 1.104598905e+02 1.104598905e+02 1.56 1.017650887e+02 1.017650887e+02 1.58 9.370478870e+01 9.370478870e+01 1.60 8.623623375e+01 8.623623375e+01 1.62 7.931907104e+01 7.931907104e+01 1.64 7.291491812e+01 7.291491812e+01 1.66 6.698712750e+01 6.698712750e+01 1.68 6.150074654e+01 6.150074654e+01 1.70 5.642258900e+01 5.642258900e+01 1.72 5.172397354e+01 5.172397354e+01 1.74 4.737868409e+01 4.737868409e+01 1.76 4.335875724e+01 4.335875724e+01 1.78 3.963838904e+01 3.963838904e+01 1.80 3.619314144e+01 3.619314144e+01 1.82 3.300083783e+01 3.300083783e+01 1.84 3.004164479e+01 3.004164479e+01 1.86 2.729806930e+01 2.729806930e+01 1.88 2.475477156e+01 2.475477156e+01 1.90 2.239821594e+01 2.239821594e+01 1.92 2.021624272e+01 2.021624272e+01 1.94 1.819767492e+01 1.819767492e+01 1.96 1.633203442e+01 1.633203442e+01 1.98 1.460937553e+01 1.460937553e+01 2.00 1.302019267e+01 1.302019267e+01 2.02 1.155535657e+01 1.155535657e+01 2.04 1.020605705e+01 1.020605705e+01 2.06 8.963753935e+00 8.963753935e+00 2.08 7.820155120e+00 7.820155120e+00 2.10 6.767242945e+00 6.767242945e+00 2.12 5.797354060e+00 5.797354060e+00 2.14 4.903295432e+00 4.903295432e+00 2.16 4.078464660e+00 4.078464660e+00 2.18 3.316937292e+00 3.316937292e+00 2.20 2.613498185e+00 2.613498185e+00 2.22 1.963609769e+00 1.963609769e+00 2.24 1.363333101e+00 1.363333101e+00 2.26 8.092246529e-01 8.092246529e-01 2.28 2.982306101e-01 2.982306101e-01 2.30 -1.724042731e-01 -1.724042731e-01 2.32 -6.052109262e-01 -6.052109262e-01 2.34 -1.002546399e+00 -1.002546399e+00 2.36 -1.366628949e+00 -1.366628949e+00 2.38 -1.699557458e+00 -1.699557458e+00 2.40 -2.003321405e+00 -2.003321405e+00 2.42 -2.279772695e+00 -2.279772695e+00 2.44 -2.530428649e+00 -2.530428649e+00 2.46 -2.757162756e+00 -2.757162756e+00 2.48 -2.961812083e+00 -2.961812083e+00 2.50 -3.146052405e+00 -3.146052405e+00 2.52 -3.311406787e+00 -3.311406787e+00 2.54 -3.459255275e+00 -3.459255275e+00 2.56 -3.590846775e+00 -3.590846775e+00 2.58 -3.707279810e+00 -3.707279810e+00 2.60 -3.809193214e+00 -3.809193214e+00 2.62 -3.896981923e+00 -3.896981923e+00 2.64 -3.971076053e+00 -3.971076053e+00 2.66 -4.031896703e+00 -4.031896703e+00 2.68 -4.079819596e+00 -4.079819596e+00 2.70 -4.115232815e+00 -4.115232815e+00 2.72 -4.138541420e+00 -4.138541420e+00 2.74 -4.150171897e+00 -4.150171897e+00 2.76 -4.150575246e+00 -4.150575246e+00 2.78 -4.140228584e+00 -4.140228584e+00 2.80 -4.119637054e+00 -4.119637054e+00 2.82 -4.089315784e+00 -4.089315784e+00 2.84 -4.049777657e+00 -4.049777657e+00 2.86 -4.001585931e+00 -4.001585931e+00 2.88 -3.945367865e+00 -3.945367865e+00 2.90 -3.881821496e+00 -3.881821496e+00 2.92 -3.811718972e+00 -3.811718972e+00 2.94 -3.735903617e+00 -3.735903617e+00 2.96 -3.655278508e+00 -3.655278508e+00 2.98 -3.570785612e+00 -3.570785612e+00 3.00 -3.483376189e+00 -3.483376189e+00 3.02 -3.393974975e+00 -3.393974975e+00 3.04 -3.303441963e+00 -3.303441963e+00 3.06 -3.212537477e+00 -3.212537477e+00 3.08 -3.121892985e+00 -3.121892985e+00 3.10 -3.031994537e+00 -3.031994537e+00 3.12 -2.943177826e+00 -2.943177826e+00 3.14 -2.855637315e+00 -2.855637315e+00 3.16 -2.769442324e+00 -2.769442324e+00 3.18 -2.684563066e+00 -2.684563066e+00 3.20 -2.600898033e+00 -2.600898033e+00 3.22 -2.518301898e+00 -2.518301898e+00 3.24 -2.436611431e+00 -2.436611431e+00 3.26 -2.355668199e+00 -2.355668199e+00 3.28 -2.275337390e+00 -2.275337390e+00 3.30 -2.195529416e+00 -2.195529416e+00 3.32 -2.116229480e+00 -2.116229480e+00 3.34 -2.037377994e+00 -2.037377994e+00 3.36 -1.958964936e+00 -1.958964936e+00 3.38 -1.881052805e+00 -1.881052805e+00 3.40 -1.803724617e+00 -1.803724617e+00 3.42 -1.726919927e+00 -1.726919927e+00 3.44 -1.650631778e+00 -1.650631778e+00 3.46 -1.574972358e+00 -1.574972358e+00 3.48 -1.500158671e+00 -1.500158671e+00 3.50 -1.426490364e+00 -1.426490364e+00 3.52 -1.354321514e+00 -1.354321514e+00 3.54 -1.284029421e+00 -1.284029421e+00 3.56 -1.215983903e+00 -1.215983903e+00 3.58 -1.150520324e+00 -1.150520324e+00 3.60 -1.087918784e+00 -1.087918784e+00 3.62 -1.028390744e+00 -1.028390744e+00 3.64 -9.720731899e-01 -9.720731899e-01 3.66 -9.190294618e-01 -9.190294618e-01 3.68 -8.692552963e-01 -8.692552963e-01 3.70 -8.226883502e-01 -8.226883502e-01 3.72 -7.792195540e-01 -7.792195540e-01 3.74 -7.387048980e-01 -7.387048980e-01 3.76 -7.009766109e-01 -7.009766109e-01 3.78 -6.658530501e-01 -6.658530501e-01 3.80 -6.331469430e-01 -6.331469430e-01 3.82 -6.026718608e-01 -6.026718608e-01 3.84 -5.742469794e-01 -5.742469794e-01 3.86 -5.477002995e-01 -5.477002995e-01 3.88 -5.228705621e-01 -5.228705621e-01 3.90 -4.996081348e-01 -4.996081348e-01 3.92 -4.777750546e-01 -4.777750546e-01 3.94 -4.572450881e-01 -4.572450881e-01 3.96 -4.379024767e-01 -4.379024767e-01 3.98 -4.196416837e-01 -4.196416837e-01 4.00 -4.023665649e-01 -4.023665649e-01 4.02 -3.859897159e-01 -3.859897159e-01 4.04 -3.704318918e-01 -3.704318918e-01 4.06 -3.556214991e-01 -3.556214991e-01 4.08 -3.414941557e-01 -3.414941557e-01 4.10 -3.279919453e-01 -3.279919453e-01 4.12 -3.150646786e-01 -3.150646786e-01 4.14 -3.026671675e-01 -3.026671675e-01 4.16 -2.907607857e-01 -2.907607857e-01 4.18 -2.793128284e-01 -2.793128284e-01 4.20 -2.682963195e-01 -2.682963195e-01 4.22 -2.576897394e-01 -2.576897394e-01 4.24 -2.474766118e-01 -2.474766118e-01 4.26 -2.376448975e-01 -2.376448975e-01 4.28 -2.281861669e-01 -2.281861669e-01 4.30 -2.190945595e-01 -2.190945595e-01 4.32 -2.103656348e-01 -2.103656348e-01 4.34 -2.019951918e-01 -2.019951918e-01 4.36 -1.939781999e-01 -1.939781999e-01 4.38 -1.863071900e-01 -1.863071900e-01 4.40 -1.789732598e-01 -1.789732598e-01 4.42 -1.719658894e-01 -1.719658894e-01 4.44 -1.652720065e-01 -1.652720065e-01 4.46 -1.588764463e-01 -1.588764463e-01 4.48 -1.527625336e-01 -1.527625336e-01 4.50 -1.469126882e-01 -1.469126882e-01 4.52 -1.413089776e-01 -1.413089776e-01 4.54 -1.359335745e-01 -1.359335745e-01 4.56 -1.307691027e-01 -1.307691027e-01 4.58 -1.257988743e-01 -1.257988743e-01 4.60 -1.210070362e-01 -1.210070362e-01 4.62 -1.163786504e-01 -1.163786504e-01 4.64 -1.118997302e-01 -1.118997302e-01 4.66 -1.075572585e-01 -1.075572585e-01 4.68 -1.033392042e-01 -1.033392042e-01 4.70 -9.923455554e-02 -9.923455554e-02 4.72 -9.523337858e-02 -9.523337858e-02 4.74 -9.132690894e-02 -9.132690894e-02 4.76 -8.750767672e-02 -8.750767672e-02 4.78 -8.376966011e-02 -8.376966011e-02 4.80 -8.010825028e-02 -8.010825028e-02 4.82 -7.652128015e-02 -7.652128015e-02 4.84 -7.300781069e-02 -7.300781069e-02 4.86 -6.956915401e-02 -6.956915401e-02 4.88 -6.620864765e-02 -6.620864765e-02 4.90 -6.293151053e-02 -6.293151053e-02 4.92 -5.974457438e-02 -5.974457438e-02 4.94 -5.665587465e-02 -5.665587465e-02 4.96 -5.367411457e-02 -5.367411457e-02 4.98 -5.080804622e-02 -5.080804622e-02 5.00 -4.806581946e-02 -4.806581946e-02 5.02 -4.545436851e-02 -4.545436851e-02 5.04 -4.297890235e-02 -4.297890235e-02 5.06 -4.064254893e-02 -4.064254893e-02 5.08 -3.844618152e-02 -3.844618152e-02 5.10 -3.638843005e-02 -3.638843005e-02 5.12 -3.446585157e-02 -3.446585157e-02 5.14 -3.267322728e-02 -3.267322728e-02 5.16 -3.100393696e-02 -3.100393696e-02 5.18 -2.945036164e-02 -2.945036164e-02 5.20 -2.800427686e-02 -2.800427686e-02 5.22 -2.665720772e-02 -2.665720772e-02 5.24 -2.540072817e-02 -2.540072817e-02 5.26 -2.422669735e-02 -2.422669735e-02 5.28 -2.312743347e-02 -2.312743347e-02 5.30 -2.209583087e-02 -2.209583087e-02 5.32 -2.112542844e-02 -2.112542844e-02 5.34 -2.021043860e-02 -2.021043860e-02 5.36 -1.934574548e-02 -1.934574548e-02 5.38 -1.852685967e-02 -1.852685967e-02 5.40 -1.774987300e-02 -1.774987300e-02 5.42 -1.701148452e-02 -1.701148452e-02 5.44 -1.630887902e-02 -1.630887902e-02 5.46 -1.563965717e-02 -1.563965717e-02 5.48 -1.500176690e-02 -1.500176690e-02 5.50 -1.439343571e-02 -1.439343571e-02 5.52 -1.381310678e-02 -1.381310678e-02 5.54 -1.325938133e-02 -1.325938133e-02 5.56 -1.273096925e-02 -1.273096925e-02 5.58 -1.222664944e-02 -1.222664944e-02 5.60 -1.174524032e-02 -1.174524032e-02 5.62 -1.128558019e-02 -1.128558019e-02 5.64 -1.084651653e-02 -1.084651653e-02 5.66 -1.042690236e-02 -1.042690236e-02 5.68 -1.002559810e-02 -1.002559810e-02 5.70 -9.641476822e-03 -9.641476822e-03 5.72 -9.273431215e-03 -9.273431215e-03 5.74 -8.920380998e-03 -8.920380998e-03 5.76 -8.581279658e-03 -8.581279658e-03 5.78 -8.255119992e-03 -8.255119992e-03 5.80 -7.940938185e-03 -7.940938185e-03 5.82 -7.637816398e-03 -7.637816398e-03 5.84 -7.344884071e-03 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