{ "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 0.477704 0.25 ] [ 0 0.522296 0.75 ] [ 0.5 0.977704 0.25 ] [ 0.5 0.022296 0.75 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0.5 0.5 ] [ 0 0.183615 0.75 ] [ 0 0.816385 0.25 ] [ 0.5 0.683615 0.75 ] [ 0.5 0.316385 0.25 ] ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" "Ag" "Ag" "Ag" "Ag" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.96688902 "source-unit" "angstrom" } "b" { "source-value" 6.80460355 "source-unit" "angstrom" } "c" { "source-value" 8.45477093 "source-unit" "angstrom" } }