# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Starikov-S-Grigorev-P-Smirnova-D--Cu-Ag-Co # implementation = 2026--Starikov-S--Cu-Ag-Co--LAMMPS--ipr1 # composition = CoCu # 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 2026-08-31 r B1--NaCl--rock-s B1--NaCl--rock-s B2--CsCl B2--CsCl B3--ZnS--cubic-z B3--ZnS--cubic-z B4--ZnS--wurtzit B4--ZnS--wurtzit L1_0--AuCu L1_0--AuCu 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan 5.701310984e+03 5.701310984e+03 nan nan nan nan 0.74 nan nan nan nan 5.056254994e+03 5.056254994e+03 5.058728013e+03 5.058728013e+03 nan nan 0.76 nan nan nan nan 4.489252253e+03 4.489252253e+03 4.488785992e+03 4.488785992e+03 nan nan 0.78 nan nan nan nan 3.989947994e+03 3.989947994e+03 3.987370581e+03 3.987370581e+03 nan nan 0.80 nan nan nan nan 3.549193393e+03 3.549193393e+03 3.545387402e+03 3.545387402e+03 nan nan 0.82 nan nan nan nan 3.159057490e+03 3.159057490e+03 3.154908494e+03 3.154908494e+03 nan nan 0.84 4.302696100e+03 4.302696100e+03 nan nan 2.813655330e+03 2.813655330e+03 2.809744930e+03 2.809744930e+03 nan nan 0.86 3.831162467e+03 3.831162467e+03 nan nan 2.504865234e+03 2.504865234e+03 2.502000092e+03 2.502000092e+03 nan nan 0.88 3.414434759e+03 3.414434759e+03 nan nan 2.228730263e+03 2.228730263e+03 2.227325148e+03 2.227325148e+03 nan nan 0.90 3.045179089e+03 3.045179089e+03 nan nan 1.982628219e+03 1.982628219e+03 1.982596622e+03 1.982596622e+03 nan nan 0.92 2.716824543e+03 2.716824543e+03 3.622981291e+03 3.622981291e+03 1.764215852e+03 1.764215852e+03 1.765244796e+03 1.765244796e+03 nan nan 0.94 2.424263399e+03 2.424263399e+03 3.228342865e+03 3.228342865e+03 1.570883565e+03 1.570883565e+03 1.572574329e+03 1.572574329e+03 3.315416587e+03 3.315416587e+03 0.96 2.162030422e+03 2.162030422e+03 2.878983841e+03 2.878983841e+03 1.399848921e+03 1.399848921e+03 1.401834000e+03 1.401834000e+03 2.954962405e+03 2.954962405e+03 0.98 1.927628709e+03 1.927628709e+03 2.569733725e+03 2.569733725e+03 1.248547505e+03 1.248547505e+03 1.250460674e+03 1.250460674e+03 2.633483842e+03 2.633483842e+03 1.00 1.718480201e+03 1.718480201e+03 2.295753614e+03 2.295753614e+03 1.114564663e+03 1.114564663e+03 1.115996931e+03 1.115996931e+03 2.347772946e+03 2.347772946e+03 1.02 1.532270099e+03 1.532270099e+03 2.052364760e+03 2.052364760e+03 9.954550603e+02 9.954550603e+02 9.962096485e+02 9.962096485e+02 2.094159393e+03 2.094159393e+03 1.04 1.366685269e+03 1.366685269e+03 1.835749867e+03 1.835749867e+03 8.894328794e+02 8.894328794e+02 8.894802056e+02 8.894802056e+02 1.869158911e+03 1.869158911e+03 1.06 1.219526432e+03 1.219526432e+03 1.642368992e+03 1.642368992e+03 7.947943204e+02 7.947943204e+02 7.942635624e+02 7.942635624e+02 1.669554414e+03 1.669554414e+03 1.08 1.088783867e+03 1.088783867e+03 1.469344909e+03 1.469344909e+03 7.101645348e+02 7.101645348e+02 7.092421974e+02 7.092421974e+02 1.492404548e+03 1.492404548e+03 1.10 9.726118664e+02 9.726118664e+02 1.314553468e+03 1.314553468e+03 6.345113424e+02 6.345113424e+02 6.333553135e+02 6.333553135e+02 1.335048951e+03 1.335048951e+03 1.12 8.693252707e+02 8.693252707e+02 1.176086346e+03 1.176086346e+03 5.668955523e+02 5.668955523e+02 5.656304262e+02 5.656304262e+02 1.194920108e+03 1.194920108e+03 1.14 7.774873922e+02 7.774873922e+02 1.052245520e+03 1.052245520e+03 5.064801040e+02 5.064801040e+02 5.051934294e+02 5.051934294e+02 1.069838679e+03 1.069838679e+03 1.16 6.953423159e+02 6.953423159e+02 9.414954211e+02 9.414954211e+02 4.525071600e+02 4.525071600e+02 4.512491434e+02 4.512491434e+02 9.579429526e+02 9.579429526e+02 1.18 6.217468102e+02 6.217468102e+02 8.424628974e+02 8.424628974e+02 4.042978310e+02 4.042978310e+02 4.030887954e+02 4.030887954e+02 8.578044393e+02 8.578044393e+02 1.20 5.557760179e+02 5.557760179e+02 7.538867408e+02 7.538867408e+02 3.612239149e+02 3.612239149e+02 3.600823845e+02 3.600823845e+02 7.681612179e+02 7.681612179e+02 1.22 4.966845242e+02 4.966845242e+02 6.746287244e+02 6.746287244e+02 3.227206104e+02 3.227206104e+02 3.216636319e+02 3.216636319e+02 6.878554683e+02 6.878554683e+02 1.24 4.438182829e+02 4.438182829e+02 6.037040819e+02 6.037040819e+02 2.882977644e+02 2.882977644e+02 2.873345917e+02 2.873345917e+02 6.159189795e+02 6.159189795e+02 1.26 3.965523137e+02 3.965523137e+02 5.402453701e+02 5.402453701e+02 2.575216467e+02 2.575216467e+02 2.566566413e+02 2.566566413e+02 5.515043406e+02 5.515043406e+02 1.28 3.542859473e+02 3.542859473e+02 4.834749353e+02 4.834749353e+02 2.300114614e+02 2.300114614e+02 2.292429635e+02 2.292429635e+02 4.938437637e+02 4.938437637e+02 1.30 3.164857389e+02 3.164857389e+02 4.326899329e+02 4.326899329e+02 2.054261231e+02 2.054261231e+02 2.047444651e+02 2.047444651e+02 4.422276170e+02 4.422276170e+02 1.32 2.826762356e+02 2.826762356e+02 3.872391587e+02 3.872391587e+02 1.834462375e+02 1.834462375e+02 1.828468069e+02 1.828468069e+02 3.960236840e+02 3.960236840e+02 1.34 2.524498954e+02 2.524498954e+02 3.465515533e+02 3.465515533e+02 1.637902286e+02 1.637902286e+02 1.632688042e+02 1.632688042e+02 3.546813620e+02 3.546813620e+02 1.36 2.254454567e+02 2.254454567e+02 3.101325024e+02 3.101325024e+02 1.462163027e+02 1.462163027e+02 1.457631101e+02 1.457631101e+02 3.177014026e+02 3.177014026e+02 1.38 2.013244697e+02 2.013244697e+02 2.775583613e+02 2.775583613e+02 1.305180385e+02 1.305180385e+02 1.301163529e+02 1.301163529e+02 2.846340476e+02 2.846340476e+02 1.40 1.797830904e+02 1.797830904e+02 2.484674997e+02 2.484674997e+02 1.165057455e+02 1.165057455e+02 1.161387045e+02 1.161387045e+02 2.550580011e+02 2.550580011e+02 1.42 1.605441857e+02 1.605441857e+02 2.223450455e+02 2.223450455e+02 1.039961760e+02 1.039961760e+02 1.036556879e+02 1.036556879e+02 2.285946968e+02 2.285946968e+02 1.44 1.433506955e+02 1.433506955e+02 1.989121652e+02 1.989121652e+02 9.282250367e+01 9.282250367e+01 9.250989903e+01 9.250989903e+01 2.048920332e+02 2.048920332e+02 1.46 1.279740097e+02 1.279740097e+02 1.778980916e+02 1.778980916e+02 8.284405983e+01 8.284405983e+01 8.256255522e+01 8.256255522e+01 1.836562408e+02 1.836562408e+02 1.48 1.142216844e+02 1.142216844e+02 1.590681169e+02 1.590681169e+02 7.393790137e+01 7.393790137e+01 7.368608204e+01 7.368608204e+01 1.646202949e+02 1.646202949e+02 1.50 1.019214775e+02 1.019214775e+02 1.422126709e+02 1.422126709e+02 6.599316432e+01 6.599316432e+01 6.576501285e+01 6.576501285e+01 1.475607124e+02 1.475607124e+02 1.52 9.091935491e+01 9.091935491e+01 1.271348657e+02 1.271348657e+02 5.890507753e+01 5.890507753e+01 5.869337919e+01 5.869337919e+01 1.322687837e+02 1.322687837e+02 1.54 8.107798652e+01 8.107798652e+01 1.136394504e+02 1.136394504e+02 5.257468008e+01 5.257468008e+01 5.237731927e+01 5.237731927e+01 1.185594853e+02 1.185594853e+02 1.56 7.228196904e+01 7.228196904e+01 1.015536999e+02 1.015536999e+02 4.691686807e+01 4.691686807e+01 4.673520405e+01 4.673520405e+01 1.062786764e+02 1.062786764e+02 1.58 6.442695534e+01 6.442695534e+01 9.072177916e+01 9.072177916e+01 4.185557769e+01 4.185557769e+01 4.169315155e+01 4.169315155e+01 9.519116662e+01 9.519116662e+01 1.60 5.741270759e+01 5.741270759e+01 8.101088372e+01 8.101088372e+01 3.732625096e+01 3.732625096e+01 3.718034605e+01 3.718034605e+01 8.519770467e+01 8.519770467e+01 1.62 5.120435720e+01 5.120435720e+01 7.239153202e+01 7.239153202e+01 3.331648774e+01 3.331648774e+01 3.318252872e+01 3.318252872e+01 7.627434776e+01 7.627434776e+01 1.64 4.501393668e+01 4.501393668e+01 6.383014702e+01 6.383014702e+01 2.931109264e+01 2.931109264e+01 2.918168300e+01 2.918168300e+01 6.738661293e+01 6.738661293e+01 1.66 3.914643980e+01 3.914643980e+01 5.573852616e+01 5.573852616e+01 2.550737362e+01 2.550737362e+01 2.537674129e+01 2.537674129e+01 5.896719759e+01 5.896719759e+01 1.68 3.364825353e+01 3.364825353e+01 4.817155796e+01 4.817155796e+01 2.191570923e+01 2.191570923e+01 2.178742731e+01 2.178742731e+01 5.108013413e+01 5.108013413e+01 1.70 2.856649147e+01 2.856649147e+01 4.117934527e+01 4.117934527e+01 1.859554186e+01 1.859554186e+01 1.846757176e+01 1.846757176e+01 4.378348646e+01 4.378348646e+01 1.72 2.394590673e+01 2.394590673e+01 3.481060324e+01 3.481060324e+01 1.554083654e+01 1.554083654e+01 1.540247475e+01 1.540247475e+01 3.712951739e+01 3.712951739e+01 1.74 1.982334685e+01 1.982334685e+01 2.911094765e+01 2.911094765e+01 1.274609013e+01 1.274609013e+01 1.260868999e+01 1.260868999e+01 3.116393391e+01 3.116393391e+01 1.76 1.621492270e+01 1.621492270e+01 2.410208741e+01 2.410208741e+01 1.028469168e+01 1.028469168e+01 1.014966366e+01 1.014966366e+01 2.591778531e+01 2.591778531e+01 1.78 1.308672032e+01 1.308672032e+01 1.974189672e+01 1.974189672e+01 8.137047954e+00 8.137047954e+00 8.004066107e+00 8.004066107e+00 2.135192926e+01 2.135192926e+01 1.80 1.039632255e+01 1.039632255e+01 1.597823415e+01 1.597823415e+01 6.278595450e+00 6.278595450e+00 6.149805476e+00 6.149805476e+00 1.741656507e+01 1.741656507e+01 1.82 8.107471198e+00 8.107471198e+00 1.276481546e+01 1.276481546e+01 4.690374529e+00 4.690374529e+00 4.567998287e+00 4.567998287e+00 1.406312565e+01 1.406312565e+01 1.84 6.188133246e+00 6.188133246e+00 1.005342888e+01 1.005342888e+01 3.344914318e+00 3.344914318e+00 3.230830563e+00 3.230830563e+00 1.124445260e+01 1.124445260e+01 1.86 4.607421208e+00 4.607421208e+00 7.797722260e+00 7.797722260e+00 2.220534782e+00 2.220534782e+00 2.119468507e+00 2.119468507e+00 8.909479244e+00 8.909479244e+00 1.88 3.299990754e+00 3.299990754e+00 5.953793210e+00 5.953793210e+00 1.299936082e+00 1.299936082e+00 1.216252661e+00 1.216252661e+00 7.004124678e+00 7.004124678e+00 1.90 2.262838623e+00 2.262838623e+00 4.476891170e+00 4.476891170e+00 5.629829329e-01 5.629829329e-01 4.996136452e-01 4.996136452e-01 5.473506420e+00 5.473506420e+00 1.92 1.462388958e+00 1.462388958e+00 3.318897932e+00 3.318897932e+00 -1.132113308e-02 -1.132113308e-02 -5.501541125e-02 -5.501541125e-02 4.263057938e+00 4.263057938e+00 1.94 8.601933915e-01 8.601933915e-01 2.430058494e+00 2.430058494e+00 -4.452782222e-01 -4.452782222e-01 -4.734835849e-01 -4.734835849e-01 3.319410357e+00 3.319410357e+00 1.96 4.069949740e-01 4.069949740e-01 1.759472938e+00 1.759472938e+00 -7.652441275e-01 -7.652441275e-01 -7.834828680e-01 -7.834828680e-01 2.590280580e+00 2.590280580e+00 1.98 8.683669514e-03 8.683669514e-03 1.256067081e+00 1.256067081e+00 -9.978616346e-01 -9.978616346e-01 -1.011768438e+00 -1.011768438e+00 2.024465657e+00 2.024465657e+00 2.00 -3.094816977e-01 -3.094816977e-01 8.696359538e-01 8.696359538e-01 -1.168440467e+00 -1.168440467e+00 -1.182338016e+00 -1.182338016e+00 1.573139726e+00 1.573139726e+00 2.02 -5.825187916e-01 -5.825187916e-01 5.430216955e-01 5.430216955e-01 -1.301784998e+00 -1.301784998e+00 -1.318476500e+00 -1.318476500e+00 1.187579482e+00 1.187579482e+00 2.04 -8.381474627e-01 -8.381474627e-01 2.271799019e-01 2.271799019e-01 -1.416305252e+00 -1.416305252e+00 -1.437090190e+00 -1.437090190e+00 8.317441871e-01 8.317441871e-01 2.06 -1.075535142e+00 -1.075535142e+00 -6.090178344e-02 -6.090178344e-02 -1.514966797e+00 -1.514966797e+00 -1.540171199e+00 -1.540171199e+00 4.874136597e-01 4.874136597e-01 2.08 -1.292787163e+00 -1.292787163e+00 -3.244611330e-01 -3.244611330e-01 -1.598795485e+00 -1.598795485e+00 -1.628272230e+00 -1.628272230e+00 1.476391487e-01 1.476391487e-01 2.10 -1.496370465e+00 -1.496370465e+00 -6.159538571e-01 -6.159538571e-01 -1.670266861e+00 -1.670266861e+00 -1.703264734e+00 -1.703264734e+00 -1.654714217e-01 -1.654714217e-01 2.12 -1.687364194e+00 -1.687364194e+00 -9.095708403e-01 -9.095708403e-01 -1.730986750e+00 -1.730986750e+00 -1.766506576e+00 -1.766506576e+00 -4.821990974e-01 -4.821990974e-01 2.14 -1.862437634e+00 -1.862437634e+00 -1.186897454e+00 -1.186897454e+00 -1.783157821e+00 -1.783157821e+00 -1.819873494e+00 -1.819873494e+00 -8.207399508e-01 -8.207399508e-01 2.16 -2.019054691e+00 -2.019054691e+00 -1.450246393e+00 -1.450246393e+00 -1.828674227e+00 -1.828674227e+00 -1.864969493e+00 -1.864969493e+00 -1.130819985e+00 -1.130819985e+00 2.18 -2.156319474e+00 -2.156319474e+00 -1.696797297e+00 -1.696797297e+00 -1.868986899e+00 -1.868986899e+00 -1.903010926e+00 -1.903010926e+00 -1.413448641e+00 -1.413448641e+00 2.20 -2.274372703e+00 -2.274372703e+00 -1.924574230e+00 -1.924574230e+00 -1.905051895e+00 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