{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.269537 0.75 0.974918 ] [ 0.730463 0.25 0.025082 ] [ 0.73513 0.25 0.524727 ] [ 0.26487 0.75 0.475273 ] [ 0.722718 0.75 0.778072 ] [ 0.277282 0.25 0.221928 ] [ 0.061745 0.25 0.337622 ] [ 0.18551 0.25 0.01334 ] [ 0.446465 0.479227 0.265693 ] [ 0.938255 0.75 0.662378 ] [ 0.446465 0.020773 0.265693 ] [ 0.553535 0.979227 0.734307 ] [ 0.553535 0.520773 0.734307 ] [ 0.81449 0.75 0.98666 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Be" "Be" "H" "H" "H" "H" "H" "H" "H" "H" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.07872828592 "source-unit" "angstrom" } "b" { "source-value" 4.99306949 "source-unit" "angstrom" } "c" { "source-value" 6.85350186747 "source-unit" "angstrom" } "beta" { "source-value" 98.5229106542 "source-unit" "degree" } }