{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0 0.120108 0.75 ] [ 0 0.879892 0.25 ] [ 0.5 0 0.5 ] [ 0.5 0 0 ] [ 0.5 0.620108 0.75 ] [ 0.5 0.379892 0.25 ] [ 0 0.72029 0.75 ] [ 0 0.27971 0.25 ] [ 0.5 0.22029 0.75 ] [ 0.5 0.77971 0.25 ] ] } "species" { "source-value" [ "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.81886973308 "source-unit" "angstrom" } "b" { "source-value" 6.96885802818 "source-unit" "angstrom" } "c" { "source-value" 7.57733707 "source-unit" "angstrom" } }