{ "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 0.496883 0.291409 ] [ 0.25 0.503117 0.708591 ] [ 0.75 0.996883 0.208591 ] [ 0.25 0.003117 0.791409 ] [ 0.75 0.337085 0.925093 ] [ 0.25 0.662915 0.074907 ] [ 0.75 0.837085 0.574907 ] [ 0.25 0.162915 0.425093 ] [ 0.75 0.723773 0.906187 ] [ 0.25 0.276227 0.093813 ] [ 0.75 0.223773 0.593813 ] [ 0.25 0.776227 0.406187 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Li" "Li" "Li" "Li" "Bi" "Bi" "Bi" "Bi" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.94864727 "source-unit" "angstrom" } "b" { "source-value" 8.23367775 "source-unit" "angstrom" } "c" { "source-value" 8.69123759 "source-unit" "angstrom" } }