{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcb" } "basis-atom-coordinates" { "source-value" [ [ 0.5 0.059658 0.323797 ] [ 0.5 0.940342 0.676203 ] [ 0.5 0.440342 0.823797 ] [ 0.5 0.559658 0.176203 ] [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0 0.134278 0.808346 ] [ 0 0.865722 0.191654 ] [ 0 0.634278 0.691654 ] [ 0 0.365722 0.308346 ] [ 0.5 0.264668 0.538979 ] [ 0.5 0.735332 0.461021 ] [ 0.5 0.235332 0.038979 ] [ 0.5 0.764668 0.961021 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" "Sn" "Sn" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.24936856 "source-unit" "angstrom" } "b" { "source-value" 5.66476881 "source-unit" "angstrom" } "c" { "source-value" 10.12710303 "source-unit" "angstrom" } }