{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmnb" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.370431 0.720458 ] [ 0.25 0.629569 0.279542 ] [ 0.25 0.129569 0.220458 ] [ 0.75 0.870431 0.779542 ] [ 0.75 0.849798 0.077107 ] [ 0.75 0.413578 0.115867 ] [ 0.25 0.586422 0.884133 ] [ 0.25 0.086422 0.615867 ] [ 0.75 0.349798 0.422893 ] [ 0.25 0.650202 0.577107 ] [ 0.75 0.913578 0.384133 ] [ 0.25 0.150202 0.922893 ] ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.27803468 "source-unit" "angstrom" } "b" { "source-value" 6.87025795 "source-unit" "angstrom" } "c" { "source-value" 9.08277377 "source-unit" "angstrom" } }