{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnm" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.536349 0.610037 ] [ 0.75 0.885384 0.933909 ] [ 0.75 0.24221 0.75 ] [ 0.75 0.463651 0.110037 ] [ 0.25 0.114616 0.433909 ] [ 0.25 0.75779 0.25 ] [ 0.75 0.160204 0.25 ] [ 0.75 0.463651 0.389963 ] [ 0.25 0.839796 0.75 ] [ 0.25 0.114616 0.066091 ] [ 0.75 0.885384 0.566091 ] [ 0.25 0.536349 0.889963 ] [ 0.75 0.580065 0.75 ] [ 0.25 0.14377 0.88008 ] [ 0.75 0.262811 0.944674 ] [ 0.25 0.737189 0.055326 ] [ 0.25 0.419935 0.25 ] [ 0.75 0.85623 0.38008 ] [ 0.25 0.14377 0.61992 ] [ 0.75 0.85623 0.11992 ] [ 0.75 0.262811 0.555326 ] [ 0.25 0.737189 0.444674 ] [ 0.75 0.706532 0.666504 ] [ 0.25 0.293468 0.333496 ] [ 0.25 0.293468 0.166504 ] [ 0.75 0.706532 0.833496 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Sr" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "Ge" "N" "N" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.05461115 "source-unit" "angstrom" } "b" { "source-value" 9.16913826 "source-unit" "angstrom" } "c" { "source-value" 18.0891931 "source-unit" "angstrom" } }