{ "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.153453 0.346547 0.653453 ] [ 0.346547 0.653453 0.153453 ] [ 0.653453 0.153453 0.346547 ] [ 0.846547 0.846547 0.846547 ] [ 0.844944 0.655056 0.344944 ] [ 0.655056 0.344944 0.844944 ] [ 0.344944 0.844944 0.655056 ] [ 0.155056 0.155056 0.155056 ] ] } "species" { "source-value" [ "Be" "Be" "Be" "Be" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.72356624 "source-unit" "angstrom" } "c11" { "source-value" 200.77489775907551 "source-unit" "GPa" } "c12" { "source-value" 121.5059889695248 "source-unit" "GPa" } "c44" { "source-value" 42.37411738666667 "source-unit" "GPa" } "excess" { "source-value" 0 "source-unit" "GPa" } }