{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pcmn" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0 0 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0 0.5 0.5 ] [ 0.005361 0.75 0.222606 ] [ 0.505361 0.25 0.277394 ] [ 0.994639 0.25 0.777394 ] [ 0.494639 0.75 0.722606 ] [ 0.052882 0.75 0.902063 ] [ 0.552882 0.25 0.597937 ] [ 0.947118 0.25 0.097937 ] [ 0.447118 0.75 0.402063 ] [ 0.171623 0.75 0.045504 ] [ 0.671623 0.25 0.454496 ] [ 0.828377 0.25 0.954496 ] [ 0.328377 0.75 0.545504 ] [ 0.792713 0.041911 0.175025 ] [ 0.292713 0.958089 0.324975 ] [ 0.207287 0.541911 0.824975 ] [ 0.707287 0.458089 0.675025 ] [ 0.207287 0.958089 0.824975 ] [ 0.707287 0.041911 0.675025 ] [ 0.792713 0.458089 0.175025 ] [ 0.292713 0.541911 0.324975 ] [ 0.773885 0.75 0.388447 ] [ 0.273885 0.25 0.111553 ] [ 0.226115 0.25 0.611553 ] [ 0.726115 0.75 0.888447 ] ] } "species" { "source-value" [ "Na" "Na" "Na" "Na" "Ho" "Ho" "Ho" "Ho" "Ge" "Ge" "Ge" "Ge" "O" "O" "O" "O" "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" 5.32246906 "source-unit" "angstrom" } "b" { "source-value" 6.48439601 "source-unit" "angstrom" } "c" { "source-value" 11.48003833 "source-unit" "angstrom" } }