{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_13" } "basis-atom-coordinates" { "source-value" [ [ 0.610121 0.389879 0.889879 ] [ 0.389879 0.889879 0.610121 ] [ 0.110121 0.110121 0.110121 ] [ 0.889879 0.610121 0.389879 ] [ 0.171194 0.328806 0.671194 ] [ 0.671194 0.171194 0.328806 ] [ 0.328806 0.671194 0.171194 ] [ 0.828806 0.828806 0.828806 ] [ 0.595574 0.904426 0.095574 ] [ 0.095574 0.595574 0.904426 ] [ 0.404426 0.404426 0.404426 ] [ 0.904426 0.095574 0.595574 ] ] } "species" { "source-value" [ "Ba" "Ba" "Ba" "Ba" "As" "As" "As" "As" "Pt" "Pt" "Pt" "Pt" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.82925544 "source-unit" "angstrom" } }