{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/mbm" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.675913 0.175913 0.5 ] [ 0.175913 0.324087 0.5 ] [ 0.824087 0.675913 0.5 ] [ 0.324087 0.824087 0.5 ] [ 0.881452 0.381452 0 ] [ 0.381452 0.118548 0 ] [ 0.618548 0.881452 0 ] [ 0.118548 0.618548 0 ] ] } "species" { "source-value" [ "Th" "Th" "Th" "Th" "Th" "Th" "Ga" "Ga" "Ga" "Ga" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.0170355 "source-unit" "angstrom" } "c" { "source-value" 4.21828853 "source-unit" "angstrom" } }