[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Cr" ] } "a" { "source-value" 2.3438684865832333 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.343868486583233e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 517.4303661982268 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725650997 "si-unit" "kg / m s^2" "si-value" 517430366198.2268 } "c12" { "source-value" 5.088221486224317 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636183245 "si-unit" "kg / m s^2" "si-value" 5088221486.224317 } "c44" { "source-value" -15.216963721830995 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812268252 "si-unit" "kg / m s^2" "si-value" -15216963721.831 } "excess" { "source-value" 4.4408920985016043e-10 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.4440892098501604 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Cr" ] } "a" { "source-value" 2.3438684865832333 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.343868486583233e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 175.86893639022514 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578889828 "si-unit" "kg / m s^2" "si-value" 175868936390.2252 } } ]