{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2mm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.994256 0 ] [ 0.5 0.494256 0 ] [ 0 0.600089 0.5 ] [ 0.5 0.100089 0.5 ] [ 0.152753 0.288627 0.5 ] [ 0.847247 0.288627 0.5 ] [ 0.652753 0.788627 0.5 ] [ 0.347247 0.788627 0.5 ] ] } "species" { "source-value" [ "Ce" "Ce" "Ni" "Ni" "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" 4.54762286538 "source-unit" "angstrom" } "b" { "source-value" 6.00933333538 "source-unit" "angstrom" } "c" { "source-value" 3.82281583 "source-unit" "angstrom" } }