{ "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" [ [ 0.670626 0 0.322953 ] [ 0.329374 0 0.677047 ] [ 0.170626 0.5 0.322953 ] [ 0.829374 0.5 0.677047 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0 0.249814 0.5 ] [ 0 0.750186 0.5 ] [ 0.5 0.749814 0.5 ] [ 0.5 0.250186 0.5 ] ] } "species" { "source-value" [ "Pr" "Pr" "Pr" "Pr" "Sb" "Sb" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.72470102 "source-unit" "angstrom" } "b" { "source-value" 5.72583323 "source-unit" "angstrom" } "c" { "source-value" 7.18963875 "source-unit" "angstrom" } "beta" { "source-value" 111.38510444 "source-unit" "degree" } }