[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A8B21_aP29_2_4i_a10i" } "stoichiometric-species" { "source-value" [ "Cr" "O" ] } "a" { "source-value" 5.5113 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -6.93389 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -201.08281 "source-unit" "eV" } "parameter-names" { "source-value" [ "b/a" "c/a" "alpha" "beta" "gamma" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" "x10" "y10" "z10" "x11" "y11" "z11" "x12" "y12" "z12" "x13" "y13" "z13" "x14" "y14" "z14" "x15" "y15" "z15" ] } "parameter-values" { "source-value" [ 2.2999474 1.2187506 74.6914 77.8635 84.8294 0.35206269 0.43070625 0.21209556 0.79622583 0.60095492 0.23256168 0.84849719 0.25092748 0.36758542 0.22944078 0.9705569 0.79406495 0.31300733 0.43282337 0.5091581 0.92718788 0.46089552 0.82108912 0.63788007 0.32371842 0.2387 0.87866925 0.68923022 0.72115734 0.17405048 0.27040054 0.85290155 0.41006103 0.44361937 0.89726323 0.88245842 0.11689698 0.32885771 0.53229857 0.086218384 0.11718456 0.691192 0.91915216 0.37981166 0.76231453 0.24463553 0.611507 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A8B21_aP29_2_4i_a10i" } "stoichiometric-species" { "source-value" [ "Cr" "O" ] } "a" { "source-value" 5.5113 "source-unit" "angstrom" } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" } "temperature" { "source-value" 0.0 "source-unit" "K" } "parameter-names" { "source-value" [ "b/a" "c/a" "alpha" "beta" "gamma" "x2" "y2" "z2" "x3" "y3" "z3" "x4" "y4" "z4" "x5" "y5" "z5" "x6" "y6" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" "x10" "y10" "z10" "x11" "y11" "z11" "x12" "y12" "z12" "x13" "y13" "z13" "x14" "y14" "z14" "x15" "y15" "z15" ] } "parameter-values" { "source-value" [ 2.2999474 1.2187506 74.6914 77.8635 84.8294 0.35206269 0.43070625 0.21209556 0.79622583 0.60095492 0.23256168 0.84849719 0.25092748 0.36758542 0.22944078 0.9705569 0.79406495 0.31300733 0.43282337 0.5091581 0.92718788 0.46089552 0.82108912 0.63788007 0.32371842 0.2387 0.87866925 0.68923022 0.72115734 0.17405048 0.27040054 0.85290155 0.41006103 0.44361937 0.89726323 0.88245842 0.11689698 0.32885771 0.53229857 0.086218384 0.11718456 0.691192 0.91915216 0.37981166 0.76231453 0.24463553 0.611507 ] } } ]