{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-tetragonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P4_2/mnm" } "basis-atom-coordinates" { "source-value" [ [ 0.197157 0.197157 0.343254 ] [ 0.802843 0.802843 0.656746 ] [ 0.302843 0.697157 0.843254 ] [ 0.802843 0.802843 0.343254 ] [ 0.197157 0.197157 0.656746 ] [ 0.697157 0.302843 0.156746 ] [ 0.697157 0.302843 0.843254 ] [ 0.302843 0.697157 0.156746 ] [ 0.176915 0.176915 0 ] [ 0.823085 0.823085 0 ] [ 0.323085 0.676915 0.5 ] [ 0.676915 0.323085 0.5 ] [ 0 0 0.142674 ] [ 0.5 0.5 0.357326 ] [ 0.5 0.5 0.642674 ] [ 0.5 0 0 ] [ 0 0.5 0 ] [ 0 0 0.857326 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] ] } "species" { "source-value" [ "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "Nd" "W" "W" "W" "W" "C" "C" "C" "C" "C" "C" "C" "C" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.83786135 "source-unit" "angstrom" } "c" { "source-value" 10.40251899 "source-unit" "angstrom" } }