{ "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" [ [ 0.810291 0.371536 0.071992 ] [ 0.810291 0.128464 0.571992 ] [ 0.189709 0.871536 0.428008 ] [ 0.189709 0.628464 0.928008 ] [ 0.671033 0.603344 0.431083 ] [ 0.328967 0.103344 0.068917 ] [ 0.671033 0.896656 0.931083 ] [ 0.328967 0.396656 0.568917 ] [ 0 0.5 0.5 ] [ 0 0 0 ] [ 0.589924 0.854368 0.208532 ] [ 0.410076 0.354368 0.291468 ] [ 0.589924 0.645632 0.708532 ] [ 0.410076 0.145632 0.791468 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Be" "Be" "Be" "Be" "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" 4.94313863 "source-unit" "angstrom" } "b" { "source-value" 5.31240796 "source-unit" "angstrom" } "c" { "source-value" 5.36061406 "source-unit" "angstrom" } "beta" { "source-value" 113.07589901 "source-unit" "degree" } }