[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A4B7_tP44_116_ach2i_e3j" } "stoichiometric-species" { "source-value" [ "Mn" "Si" ] } "a" { "source-value" 5.4833 "source-unit" "angstrom" } "binding-potential-energy-per-atom" { "source-value" -5.43919 "source-unit" "eV" } "binding-potential-energy-per-formula" { "source-value" -59.83109 "source-unit" "eV" } "parameter-names" { "source-value" [ "c/a" "x3" "z4" "z5" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" ] } "parameter-values" { "source-value" [ 3.1576423 0.33512749 0.12990287 0.4351682 0.19199004 0.15460012 0.19761582 0.11345017 0.32254331 0.84157866 0.18295465 0.34634269 0.23027551 0.96111184 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A4B7_tP44_116_ach2i_e3j" } "stoichiometric-species" { "source-value" [ "Mn" "Si" ] } "a" { "source-value" 5.4833 "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" [ "c/a" "x3" "z4" "z5" "z6" "x7" "y7" "z7" "x8" "y8" "z8" "x9" "y9" "z9" ] } "parameter-values" { "source-value" [ 3.1576423 0.33512749 0.12990287 0.4351682 0.19199004 0.15460012 0.19761582 0.11345017 0.32254331 0.84157866 0.18295465 0.34634269 0.23027551 0.96111184 ] } } ]