{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4/nmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.751031 ] [ 0.5 0 0.248969 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0 0.5 0.152769 ] [ 0.5 0 0.847231 ] [ 0 0 0.5 ] [ 0.5 0.5 0.5 ] ] } "species" { "source-value" [ "Nd" "Nd" "Cu" "Cu" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.37718469 "source-unit" "angstrom" } "c" { "source-value" 10.11537422 "source-unit" "angstrom" } }