{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.371148 0.75 ] [ 0 0.628852 0.25 ] [ 0.5 0.871148 0.75 ] [ 0.5 0.128852 0.25 ] [ 0 0.82111 0.75 ] [ 0 0.17889 0.25 ] [ 0.215321 0.097696 0.75 ] [ 0.784679 0.902304 0.25 ] [ 0.215321 0.902304 0.25 ] [ 0.784679 0.097696 0.75 ] [ 0.5 0.32111 0.75 ] [ 0.5 0.67889 0.25 ] [ 0.715321 0.597696 0.75 ] [ 0.284679 0.402304 0.25 ] [ 0.715321 0.402304 0.25 ] [ 0.284679 0.597696 0.75 ] ] } "species" { "source-value" [ "Lu" "Lu" "Lu" "Lu" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" "Cd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.21989797737 "source-unit" "angstrom" } "b" { "source-value" 10.6674599272 "source-unit" "angstrom" } "c" { "source-value" 4.84038986 "source-unit" "angstrom" } }