[ { "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" [ "Au" "Au" "Au" "Au" ] } "a" { "source-value" 3.7407050430774693 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.740705043077469e-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" 2683.9361954819424 "source-unit" "GPa" "source-std-uncert-value" 0.007335930729180027 "si-unit" "kg / m s^2" "si-value" 2683936195481.942 } "c12" { "source-value" 1531.3037335979668 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863635903585 "si-unit" "kg / m s^2" "si-value" 1531303733597.967 } "c44" { "source-value" 1534.4864578421227 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826837015687 "si-unit" "kg / m s^2" "si-value" 1534486457842.123 } "excess" { "source-value" 1.5228494637164678 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809141713 "si-unit" "kg / m s^2" "si-value" 1522849463.716468 } } { "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" [ "Au" "Au" "Au" "Au" ] } "a" { "source-value" 3.7407050430774693 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.740705043077469e-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" 1915.5145542259584 "source-unit" "GPa" "source-std-uncert-value" 0.004235401580525875 "si-unit" "kg / m s^2" "si-value" 1915514554225.958 } } ]