{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1nm" } "basis-atom-coordinates" { "source-value" [ [ 0.487475 0.17514 0.747387 ] [ 0.987475 0.82486 0.247387 ] [ 0.487475 0.17514 0.252613 ] [ 0.987475 0.82486 0.752613 ] [ 0.49105 0.67704 0.5 ] [ 0.99105 0.32296 0 ] [ 0.990387 0.341233 0.5 ] [ 0.490387 0.658767 0 ] [ 0.106046 0.634163 0 ] [ 0.606046 0.365837 0.5 ] [ 0.1462 0.678439 0.5 ] [ 0.6462 0.321561 0 ] [ 0.603564 0.824649 0.733347 ] [ 0.103564 0.175351 0.233347 ] [ 0.103564 0.175351 0.766653 ] [ 0.603564 0.824649 0.266653 ] ] } "species" { "source-value" [ "Cd" "Cd" "Cd" "Cd" "Ga" "Ga" "Ag" "Ag" "S" "S" "S" "S" "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" 6.70078759 "source-unit" "angstrom" } "b" { "source-value" 7.01090706 "source-unit" "angstrom" } "c" { "source-value" 8.25106026 "source-unit" "angstrom" } }