{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/m" } "basis-atom-coordinates" { "source-value" [ [ 0.385105 0.75 0.222482 ] [ 0.614895 0.25 0.777518 ] [ 0.998523 0.75 0.744428 ] [ 0.001477 0.25 0.255572 ] [ 0.335837 0.25 0.390836 ] [ 0.664163 0.75 0.609164 ] [ 0.843021 0.016377 0.172814 ] [ 0.156979 0.516377 0.827186 ] [ 0.156979 0.983623 0.827186 ] [ 0.843021 0.483623 0.172814 ] ] } "species" { "source-value" [ "Ce" "Ce" "B" "B" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.13628347613 "source-unit" "angstrom" } "b" { "source-value" 5.1131456 "source-unit" "angstrom" } "c" { "source-value" 6.34451655657 "source-unit" "angstrom" } "beta" { "source-value" 108.366191696 "source-unit" "degree" } }