{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2mm" } "basis-atom-coordinates" { "source-value" [ [ 0.212612 0.739312 0 ] [ 0.693936 0.5 0.251336 ] [ 0.693936 0.5 0.748664 ] [ 0.212612 0.260688 0 ] [ 0.282818 0.240853 0.5 ] [ 0.282818 0.759147 0.5 ] [ 0.749795 0 0.247951 ] [ 0.749795 0 0.752049 ] [ 0.573664 0.5 0 ] [ 0.164343 0 0 ] [ 0.627983 0 0.5 ] [ 0.414028 0.5 0.5 ] [ 0.476821 0.230098 0.772103 ] [ 0.476821 0.769902 0.227897 ] [ 0.476821 0.769902 0.772103 ] [ 0.983236 0.256512 0.71536 ] [ 0.983236 0.256512 0.28464 ] [ 0.983236 0.743488 0.28464 ] [ 0.983236 0.743488 0.71536 ] [ 0.476821 0.230098 0.227897 ] ] } "species" { "source-value" [ "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "Pb" "O" "O" "O" "O" "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" } "a" { "source-value" 6.11020848 "source-unit" "angstrom" } "b" { "source-value" 8.19194777 "source-unit" "angstrom" } "c" { "source-value" 8.30812289 "source-unit" "angstrom" } }