{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Immm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.816519 ] [ 0.5 0 0 ] [ 0 0 0.183481 ] [ 0.5 0.5 0.316519 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0.683481 ] [ 0 0.5 0.935556 ] [ 0 0.5 0.064444 ] [ 0.5 0 0.435556 ] [ 0.5 0 0.564444 ] [ 0.5 0.5 0.864996 ] [ 0.5 0.5 0.135004 ] [ 0 0 0.364996 ] [ 0 0 0.635004 ] ] } "species" { "source-value" [ "Ba" "Ba" "Ba" "Ba" "Ba" "Ba" "Al" "Al" "Al" "Al" "Ge" "Ge" "Ge" "Ge" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.36820995153 "source-unit" "angstrom" } "b" { "source-value" 5.15846482999 "source-unit" "angstrom" } "c" { "source-value" 20.2307897986 "source-unit" "angstrom" } }