{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Ccmm" } "basis-atom-coordinates" { "source-value" [ [ 0 0.145245 0.75 ] [ 0 0.854755 0.25 ] [ 0.5 0.645245 0.75 ] [ 0.5 0.354755 0.25 ] [ 0.5 0.929372 0.75 ] [ 0.5 0.070628 0.25 ] [ 0 0.429372 0.75 ] [ 0 0.570628 0.25 ] ] } "species" { "source-value" [ "Pu" "Pu" "Pu" "Pu" "Ni" "Ni" "Ni" "Ni" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.74072887521 "source-unit" "angstrom" } "b" { "source-value" 10.3797382336 "source-unit" "angstrom" } "c" { "source-value" 3.98339269 "source-unit" "angstrom" } }