{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Imcb" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0 0 ] [ 0.75 0 0 ] [ 0.75 0.5 0.5 ] [ 0.25 0.5 0.5 ] [ 0.5 0.147655 0.867181 ] [ 0 0.147655 0.132819 ] [ 0 0.852345 0.867181 ] [ 0.5 0.852345 0.132819 ] [ 0 0.647655 0.367181 ] [ 0.5 0.647655 0.632819 ] [ 0.5 0.352345 0.367181 ] [ 0 0.352345 0.632819 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" 4.73215448 "source-unit" "angstrom" } "b" { "source-value" 5.72512273 "source-unit" "angstrom" } "c" { "source-value" 6.25659665 "source-unit" "angstrom" } }