{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "I-42m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] [ 0 0.5 0.25 ] [ 0.5 0 0.25 ] [ 0.5 0 0.75 ] [ 0 0.5 0.75 ] [ 0.5 0.5 0 ] [ 0 0 0.5 ] [ 0.799023 0.799023 0.650656 ] [ 0.299023 0.700977 0.849344 ] [ 0.700977 0.299023 0.849344 ] [ 0.200977 0.200977 0.650656 ] [ 0.299023 0.299023 0.150656 ] [ 0.799023 0.200977 0.349344 ] [ 0.200977 0.799023 0.349344 ] [ 0.700977 0.700977 0.150656 ] ] } "species" { "source-value" [ "K" "K" "Ag" "Ag" "Ag" "Ag" "Sb" "Sb" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 6.80332644 "source-unit" "angstrom" } "c" { "source-value" 9.2383963 "source-unit" "angstrom" } }