{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I4mm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.5 0.074004 ] [ 0 0 0.574004 ] [ 0 0.5 0.843458 ] [ 0.5 0 0.843458 ] [ 0 0 0.999839 ] [ 0.5 0 0.343458 ] [ 0 0.5 0.343458 ] [ 0.5 0.5 0.499839 ] [ 0 0 0.234301 ] [ 0.5 0.5 0.734301 ] ] } "species" { "source-value" [ "Ce" "Ce" "Si" "Si" "Si" "Si" "Si" "Si" "Ru" "Ru" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.18689691436 "source-unit" "angstrom" } "c" { "source-value" 9.99552392635 "source-unit" "angstrom" } }