{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.579051 0.5 ] [ 0.420949 0.420949 0.5 ] [ 0.579051 0 0.5 ] [ 0.237508 0 0 ] [ 0.762492 0.762492 0 ] [ 0 0.237508 0 ] [ 0.666667 0.333333 0 ] [ 0.333333 0.666667 0 ] [ 0 0 0.5 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ga" "Ga" "Ga" "Ni" "Ni" "Ni" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.89442910708 "source-unit" "angstrom" } "c" { "source-value" 3.9952719 "source-unit" "angstrom" } }