{ "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" [ [ 0.174714 0.174714 0 ] [ 0.843336 0.843336 0.5 ] [ 0.325286 0.674714 0.5 ] [ 0.156664 0.156664 0.5 ] [ 0.825286 0.825286 0 ] [ 0.674714 0.325286 0.5 ] [ 0.343336 0.656664 0 ] [ 0.656664 0.343336 0 ] [ 0.368623 0.368623 0.732866 ] [ 0.631377 0.631377 0.732866 ] [ 0.131377 0.868623 0.767134 ] [ 0.131377 0.868623 0.232866 ] [ 0.868623 0.131377 0.232866 ] [ 0.631377 0.631377 0.267134 ] [ 0.368623 0.368623 0.267134 ] [ 0.868623 0.131377 0.767134 ] [ 0 0.5 0.75 ] [ 0 0.5 0.25 ] [ 0.5 0 0.75 ] [ 0.5 0 0.25 ] ] } "species" { "source-value" [ "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Yb" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" "Pt" "Pb" "Pb" "Pb" "Pb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.72471565695 "source-unit" "angstrom" } "c" { "source-value" 7.52375496076 "source-unit" "angstrom" } }