{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0 0.232314 0.25 ] [ 0 0.767686 0.75 ] [ 0.5 0.306218 0.75 ] [ 0.5 0.693782 0.25 ] [ 0.268013 0.434908 0.996089 ] [ 0.731987 0.434908 0.503911 ] [ 0.731987 0.565092 0.003911 ] [ 0.268013 0.565092 0.496089 ] [ 0.751185 0.915042 0.400781 ] [ 0.248815 0.915042 0.099219 ] [ 0.248815 0.084958 0.599219 ] [ 0.751185 0.084958 0.900781 ] ] } "species" { "source-value" [ "Ho" "Ho" "Ta" "Ta" "O" "O" "O" "O" "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" 5.13799974816 "source-unit" "angstrom" } "b" { "source-value" 5.50538897 "source-unit" "angstrom" } "c" { "source-value" 5.32619284804 "source-unit" "angstrom" } "beta" { "source-value" 96.4757671594 "source-unit" "degree" } }