[ { "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" [ "V" ] } "a" { "source-value" 2.413314551115036 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.413314551115036e-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" 181.12992674390884 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725103195 "si-unit" "kg / m s^2" "si-value" 181129926743.9088 } "c12" { "source-value" 71.03279007956237 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361908405 "si-unit" "kg / m s^2" "si-value" 71032790079.56238 } "c44" { "source-value" -66.65789078931586 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813106176 "si-unit" "kg / m s^2" "si-value" -66657890789.31586 } "excess" { "source-value" 3.5527136788012834e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 3.552713678801283 } } { "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" [ "V" ] } "a" { "source-value" 2.413314551115036 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.413314551115036e-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" 107.73183563434452 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578825749 "si-unit" "kg / m s^2" "si-value" 107731835634.3445 } } ]