{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcn" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.396805 0.674871 ] [ 0.75 0.603195 0.325129 ] [ 0.75 0.896805 0.825129 ] [ 0.25 0.103195 0.174871 ] [ 0.25 0.872194 0.538313 ] [ 0.75 0.127806 0.461687 ] [ 0.75 0.372194 0.961687 ] [ 0.25 0.627806 0.038313 ] ] } "species" { "source-value" [ "Pu" "Pu" "Pu" "Pu" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.61116693 "source-unit" "angstrom" } "b" { "source-value" 5.51817021 "source-unit" "angstrom" } "c" { "source-value" 7.67316693 "source-unit" "angstrom" } }