{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbnm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0 ] [ 0.5 0 0.5 ] [ 0.014015 0.957043 0.75 ] [ 0.485985 0.457043 0.75 ] [ 0.514015 0.542957 0.25 ] [ 0.985985 0.042957 0.25 ] [ 0.132061 0.420152 0.25 ] [ 0.181007 0.185489 0.571448 ] [ 0.181007 0.185489 0.928552 ] [ 0.318993 0.685489 0.571448 ] [ 0.318993 0.685489 0.928552 ] [ 0.367939 0.920152 0.25 ] [ 0.632061 0.079848 0.75 ] [ 0.681007 0.314511 0.071448 ] [ 0.681007 0.314511 0.428552 ] [ 0.818993 0.814511 0.071448 ] [ 0.818993 0.814511 0.428552 ] [ 0.867939 0.579848 0.75 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Ga" "Ga" "Ga" "Ga" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.88923136 "source-unit" "angstrom" } "b" { "source-value" 5.00952901 "source-unit" "angstrom" } "c" { "source-value" 7.4480178 "source-unit" "angstrom" } }