{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.307333 0 ] [ 0 0.692667 0 ] [ 0.5 0.807333 0 ] [ 0.5 0.192667 0 ] [ 0.768531 0 0.597934 ] [ 0.231469 0 0.402066 ] [ 0.268531 0.5 0.597934 ] [ 0.731469 0.5 0.402066 ] [ 0.406494 0 0.726589 ] [ 0.768138 0.83408 0.789681 ] [ 0.768138 0.16592 0.789681 ] [ 0 0 0.5 ] [ 0.231862 0.83408 0.210319 ] [ 0.231862 0.16592 0.210319 ] [ 0.593506 0 0.273411 ] [ 0.906494 0.5 0.726589 ] [ 0.268138 0.33408 0.789681 ] [ 0.268138 0.66592 0.789681 ] [ 0.5 0.5 0.5 ] [ 0.731862 0.33408 0.210319 ] [ 0.731862 0.66592 0.210319 ] [ 0.093506 0.5 0.273411 ] ] } "species" { "source-value" [ "Zn" "Zn" "Zn" "Zn" "As" "As" "As" "As" "O" "O" "O" "O" "O" "O" "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" 6.75944809 "source-unit" "angstrom" } "b" { "source-value" 8.62954828 "source-unit" "angstrom" } "c" { "source-value" 4.86343033 "source-unit" "angstrom" } "beta" { "source-value" 104.45249071 "source-unit" "degree" } }