{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.581643 0.581643 0.581643 ] [ 0.918357 0.418357 0.081643 ] [ 0.081643 0.918357 0.418357 ] [ 0.418357 0.081643 0.918357 ] [ 0.317652 0.317652 0.317652 ] [ 0.182348 0.682348 0.817652 ] [ 0.817652 0.182348 0.682348 ] [ 0.682348 0.817652 0.182348 ] [ 0.810241 0.810241 0.810241 ] [ 0.689759 0.189759 0.310241 ] [ 0.310241 0.689759 0.189759 ] [ 0.189759 0.310241 0.689759 ] [ 0.972228 0.527772 0.472228 ] [ 0.472228 0.972228 0.527772 ] [ 0.027772 0.027772 0.027772 ] [ 0.527772 0.472228 0.972228 ] [ 0.776113 0.105455 0.001312 ] [ 0.723887 0.894545 0.501312 ] [ 0.276113 0.394545 0.998688 ] [ 0.105455 0.001312 0.776113 ] [ 0.223887 0.605455 0.498688 ] [ 0.498688 0.223887 0.605455 ] [ 0.605455 0.498688 0.223887 ] [ 0.894545 0.501312 0.723887 ] [ 0.998688 0.276113 0.394545 ] [ 0.394545 0.998688 0.276113 ] [ 0.001312 0.776113 0.105455 ] [ 0.501312 0.723887 0.894545 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "As" "As" "As" "As" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.63413982 "source-unit" "angstrom" } }