{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Fm-3m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0 0 0.198418 ] [ 0.198418 0 0 ] [ 0 0.198418 0 ] [ 0 0.801582 0 ] [ 0.801582 0 0 ] [ 0 0 0.801582 ] [ 0 0.5 0.698418 ] [ 0.198418 0.5 0.5 ] [ 0 0.698418 0.5 ] [ 0 0.301582 0.5 ] [ 0.801582 0.5 0.5 ] [ 0 0.5 0.301582 ] [ 0.5 0 0.698418 ] [ 0.698418 0 0.5 ] [ 0.5 0.198418 0.5 ] [ 0.5 0.801582 0.5 ] [ 0.301582 0 0.5 ] [ 0.5 0 0.301582 ] [ 0.5 0.5 0.198418 ] [ 0.698418 0.5 0 ] [ 0.5 0.698418 0 ] [ 0.5 0.301582 0 ] [ 0.301582 0.5 0 ] [ 0.5 0.5 0.801582 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "P" "P" "P" "P" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "short-name" { "source-value" [ "fcc" ] } "a" { "source-value" 8.25966851739 "source-unit" "angstrom" } }