{ "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" [ [ 0.324903 0.824903 0.5 ] [ 0.824903 0.675097 0.5 ] [ 0.175097 0.324903 0.5 ] [ 0.675097 0.175097 0.5 ] [ 0 0 0 ] [ 0.5 0.5 0 ] [ 0.373392 0.126608 0 ] [ 0.873392 0.373392 0 ] [ 0.126608 0.626608 0 ] [ 0.626608 0.873392 0 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "In" "In" "Pd" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.87710882 "source-unit" "angstrom" } "c" { "source-value" 3.88837516 "source-unit" "angstrom" } }