{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc2_1n" } "basis-atom-coordinates" { "source-value" [ [ 0.28143 0.031732 0.866667 ] [ 0.78143 0.531732 0.633333 ] [ 0.21857 0.031732 0.366667 ] [ 0.71857 0.531732 0.133333 ] [ 0.782165 0.019787 0.637269 ] [ 0.217835 0.519787 0.362731 ] [ 0.717835 0.019787 0.137269 ] [ 0.282165 0.519787 0.862731 ] [ 0.7769 0.77654 0.886457 ] [ 0.2769 0.27654 0.613543 ] [ 0.7231 0.77654 0.386457 ] [ 0.2231 0.27654 0.113543 ] ] } "species" { "source-value" [ "Zn" "Zn" "Zn" "Zn" "Cu" "Cu" "Cu" "Cu" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.149544 "source-unit" "angstrom" } "b" { "source-value" 5.93013637 "source-unit" "angstrom" } "c" { "source-value" 8.45545886 "source-unit" "angstrom" } }