{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.232967 0.162983 0.54105 ] [ 0.767033 0.662983 0.95895 ] [ 0.767033 0.837017 0.45895 ] [ 0.232967 0.337017 0.04105 ] [ 0.229687 0.900584 0.826397 ] [ 0.770313 0.400584 0.673603 ] [ 0.770313 0.099416 0.173603 ] [ 0.229687 0.599416 0.326397 ] [ 0.289808 0.661122 0.603886 ] [ 0.710192 0.161122 0.896114 ] [ 0.710192 0.338878 0.396114 ] [ 0.289808 0.838878 0.103886 ] [ 0.307188 0.403457 0.797074 ] [ 0.692812 0.903457 0.702926 ] [ 0.692812 0.596543 0.202926 ] [ 0.307188 0.096543 0.297074 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.8272184 "source-unit" "angstrom" } "b" { "source-value" 6.41205607 "source-unit" "angstrom" } "c" { "source-value" 12.58836376 "source-unit" "angstrom" } "beta" { "source-value" 117.43863515 "source-unit" "degree" } }