{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccme" } "basis-atom-coordinates" { "source-value" [ [ 0.159458 0 0.122089 ] [ 0.340542 0 0.622089 ] [ 0.659458 0 0.377911 ] [ 0.840542 0 0.877911 ] [ 0.659458 0.5 0.122089 ] [ 0.840542 0.5 0.622089 ] [ 0.159458 0.5 0.377911 ] [ 0.340542 0.5 0.877911 ] ] } "species" { "source-value" [ "I" "I" "I" "I" "I" "I" "I" "I" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.65349336874 "source-unit" "angstrom" } "b" { "source-value" 8.85176743383 "source-unit" "angstrom" } "c" { "source-value" 9.77728687 "source-unit" "angstrom" } }