{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0 0 0.5 ] [ 0.5 0.5 0.5 ] [ 0.145462 0.5 0.772647 ] [ 0.854538 0.5 0.227353 ] [ 0.645462 0 0.772647 ] [ 0.354538 0 0.227353 ] ] } "species" { "source-value" [ "In" "In" "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" 6.78223147707 "source-unit" "angstrom" } "b" { "source-value" 3.71218670676 "source-unit" "angstrom" } "c" { "source-value" 6.73056710112 "source-unit" "angstrom" } "beta" { "source-value" 97.9157901218 "source-unit" "degree" } }