{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.25 0.75 0.5 ] [ 0 0 0 ] [ 0.25 0.25 0.5 ] [ 0.75 0.25 0.5 ] [ 0.5 0.5 0 ] [ 0.75 0.75 0.5 ] [ 0.213054 0.126877 0 ] [ 0.786946 0.873123 0 ] [ 0.213054 0.873123 0 ] [ 0.786946 0.126877 0 ] [ 0 0.352955 0.5 ] [ 0 0.647045 0.5 ] [ 0.713054 0.626877 0 ] [ 0.286946 0.373123 0 ] [ 0.713054 0.373123 0 ] [ 0.286946 0.626877 0 ] [ 0.5 0.852955 0.5 ] [ 0.5 0.147045 0.5 ] ] } "species" { "source-value" [ "Mg" "Mg" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" "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" 7.17556707 "source-unit" "angstrom" } "b" { "source-value" 10.02261125 "source-unit" "angstrom" } "c" { "source-value" 3.23815317 "source-unit" "angstrom" } }