{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.341886 0.929734 ] [ 0.25 0.658114 0.070266 ] [ 0.75 0.841886 0.570266 ] [ 0.25 0.158114 0.429734 ] [ 0.75 0.476964 0.315182 ] [ 0.25 0.523036 0.684818 ] [ 0.75 0.976964 0.184818 ] [ 0.25 0.023036 0.815182 ] [ 0.75 0.751077 0.890538 ] [ 0.25 0.248923 0.109462 ] [ 0.75 0.251077 0.609462 ] [ 0.25 0.748923 0.390538 ] ] } "species" { "source-value" [ "Ca" "Ca" "Ca" "Ca" "Ca" "Ca" "Ca" "Ca" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.08442564 "source-unit" "angstrom" } "b" { "source-value" 7.91636901 "source-unit" "angstrom" } "c" { "source-value" 9.61667781 "source-unit" "angstrom" } }