[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "AB_hR22_160_11a_11a" } "stoichiometric-species" { "source-value" [ "C" "Si" ] } "a" { "source-value" 3.5436014 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.5436014e-10 } "binding-potential-energy-per-atom" { "source-value" -6.683089290052799 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.070748950345824e-18 } "binding-potential-energy-per-formula" { "source-value" -13.366178580105599 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.141497900691649e-18 } "parameter-names" { "source-value" [ "c/a" "x1" "x2" "x3" "x4" "x5" "x6" "x7" "x8" "x9" "x10" "x11" "x12" "x13" "x14" "x15" "x16" "x17" "x18" "x19" "x20" "x21" "x22" ] } "parameter-values" { "source-value" [ 23.076208 0.83698456 0.13740295 0.78278352 0.41367663 0.047491221 0.35973564 0.65914841 0.96301583 0.59368531 0.22729047 0.53939704 0.25225787 0.56626246 0.86411938 0.16229333 0.80965297 0.44087222 0.072416009 0.38642604 0.68421946 0.98945998 0.62088072 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "AB_hR22_160_11a_11a" } "stoichiometric-species" { "source-value" [ "C" "Si" ] } "a" { "source-value" 3.5436014 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.5436014e-10 } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "parameter-names" { "source-value" [ "c/a" "x1" "x2" "x3" "x4" "x5" "x6" "x7" "x8" "x9" "x10" "x11" "x12" "x13" "x14" "x15" "x16" "x17" "x18" "x19" "x20" "x21" "x22" ] } "parameter-values" { "source-value" [ 23.076208 0.83698456 0.13740295 0.78278352 0.41367663 0.047491221 0.35973564 0.65914841 0.96301583 0.59368531 0.22729047 0.53939704 0.25225787 0.56626246 0.86411938 0.16229333 0.80965297 0.44087222 0.072416009 0.38642604 0.68421946 0.98945998 0.62088072 ] } } ]