{ "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 0.001946 ] [ 0 0.5 0.501946 ] [ 0.5 0 0.615316 ] [ 0.5 0.5 0.115316 ] [ 0.5 0.850267 0.303869 ] [ 0.5 0.149733 0.303869 ] [ 0.5 0.350267 0.803869 ] [ 0.5 0.649733 0.803869 ] ] } "species" { "source-value" [ "Pr" "Pr" "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" 3.89682382 "source-unit" "angstrom" } "b" { "source-value" 4.55405677 "source-unit" "angstrom" } "c" { "source-value" 6.12811921 "source-unit" "angstrom" } }