{ "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" [ [ 0.81762 0.31762 0 ] [ 0.31762 0.18238 0 ] [ 0.68238 0.81762 0 ] [ 0.18238 0.68238 0 ] [ 0.53891 0.324207 0.5 ] [ 0.824207 0.03891 0.5 ] [ 0.03891 0.175793 0.5 ] [ 0.324207 0.46109 0.5 ] [ 0.675793 0.53891 0.5 ] [ 0.5 0.5 0.796789 ] [ 0.96109 0.824207 0.5 ] [ 0.587222 0.087222 0.5 ] [ 0.412778 0.912778 0.5 ] [ 0.087222 0.412778 0.5 ] [ 0.46109 0.675793 0.5 ] [ 0.175793 0.96109 0.5 ] [ 0 0 0.796789 ] [ 0.5 0.5 0.203211 ] [ 0.912778 0.587222 0.5 ] [ 0 0 0.203211 ] ] } "species" { "source-value" [ "Tb" "Tb" "Tb" "Tb" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" "B" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.11916602 "source-unit" "angstrom" } "c" { "source-value" 4.03146294 "source-unit" "angstrom" } }