{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0.764927 0.178121 0.333434 ] [ 0 0.548848 0.5 ] [ 0.235073 0.178121 0.666566 ] [ 0.264927 0.678121 0.333434 ] [ 0.5 0.048848 0.5 ] [ 0.735073 0.678121 0.666566 ] [ 0.213061 0.95013 0.759956 ] [ 0.895585 0.362358 0.3952 ] [ 0.889263 0.734968 0.5908 ] [ 0.104415 0.362358 0.6048 ] [ 0.110737 0.734968 0.4092 ] [ 0.786939 0.95013 0.240044 ] [ 0.713061 0.45013 0.759956 ] [ 0.395585 0.862358 0.3952 ] [ 0.389263 0.234968 0.5908 ] [ 0.604415 0.862358 0.6048 ] [ 0.610737 0.234968 0.4092 ] [ 0.286939 0.45013 0.240044 ] ] } "species" { "source-value" [ "Be" "Be" "Be" "Be" "Be" "Be" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.53875386 "source-unit" "angstrom" } "b" { "source-value" 4.87484887 "source-unit" "angstrom" } "c" { "source-value" 9.03220055 "source-unit" "angstrom" } "beta" { "source-value" 92.53991583 "source-unit" "degree" } }