{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.829589 0.820352 0.674229 ] [ 0.170411 0.320352 0.325771 ] [ 0.553263 0.887509 0.104435 ] [ 0.446737 0.387509 0.895565 ] [ 0.650444 0.7921 0.265572 ] [ 0.349556 0.2921 0.734428 ] ] } "species" { "source-value" [ "Na" "Na" "H" "H" "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" 3.45434548318 "source-unit" "angstrom" } "b" { "source-value" 3.40987941 "source-unit" "angstrom" } "c" { "source-value" 5.9081461671 "source-unit" "angstrom" } "beta" { "source-value" 105.800441832 "source-unit" "degree" } }