{ "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" [ [ 0.064229 0.064229 0.064229 ] [ 0.435771 0.935771 0.564229 ] [ 0.564229 0.435771 0.935771 ] [ 0.935771 0.564229 0.435771 ] [ 0.421745 0.421745 0.421745 ] [ 0.078255 0.578255 0.921745 ] [ 0.921745 0.078255 0.578255 ] [ 0.578255 0.921745 0.078255 ] [ 0.192858 0.403873 0.007984 ] [ 0.692858 0.096127 0.992016 ] [ 0.807142 0.903873 0.492016 ] [ 0.096127 0.992016 0.692858 ] [ 0.492016 0.807142 0.903873 ] [ 0.992016 0.692858 0.096127 ] [ 0.403873 0.007984 0.192858 ] [ 0.007984 0.192858 0.403873 ] [ 0.307142 0.596127 0.507984 ] [ 0.507984 0.307142 0.596127 ] [ 0.596127 0.507984 0.307142 ] [ 0.903873 0.492016 0.807142 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Cl" "Cl" "Cl" "Cl" "O" "O" "O" "O" "O" "O" "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" 6.68960613 "source-unit" "angstrom" } }