[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "C" "C" "C" "C" ] } "a" { "source-value" 2.7898715957999234 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.789871595799924e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "c11" { "source-value" 105.43739544983028 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724979899 "si-unit" "kg / m s^2" "si-value" 105437395449.8303 } "c12" { "source-value" 91.90442904840417 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361932445 "si-unit" "kg / m s^2" "si-value" 91904429048.40417 } "c44" { "source-value" -1.6420106471555886 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812047127 "si-unit" "kg / m s^2" "si-value" -1642010647.155589 } "excess" { "source-value" 0.06158269923637203 "source-unit" "GPa" "source-std-uncert-value" 0.00259364318091333 "si-unit" "kg / m s^2" "si-value" 61582699.23637203 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "C" "C" "C" "C" ] } "a" { "source-value" 2.7898715957999234 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.789871595799924e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "isothermal-bulk-modulus" { "source-value" 96.41541784887954 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578815107 "si-unit" "kg / m s^2" "si-value" 96415417848.87955 } } ]