{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cmcm" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.103583 0.25 ] [ 0.5 0.896417 0.75 ] [ 0 0.603583 0.25 ] [ 0 0.396417 0.75 ] [ 0 0.965527 0.25 ] [ 0 0.034473 0.75 ] [ 0.5 0.249258 0.75 ] [ 0.5 0.750742 0.25 ] [ 0.5 0.465527 0.25 ] [ 0.5 0.534473 0.75 ] [ 0 0.749258 0.75 ] [ 0 0.250742 0.25 ] [ 0 0.17898 0.75 ] [ 0 0.82102 0.25 ] [ 0.5 0.67898 0.75 ] [ 0.5 0.32102 0.25 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ce" "Ce" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Pt" "Pt" "Pt" "Pt" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.26930231088 "source-unit" "angstrom" } "b" { "source-value" 16.6610476025 "source-unit" "angstrom" } "c" { "source-value" 4.24702052 "source-unit" "angstrom" } }