{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0.140487 0.698546 0.898124 ] [ 0.863309 0.294386 0.568186 ] [ 0.859513 0.698546 0.101876 ] [ 0.136691 0.294386 0.431814 ] [ 0.640487 0.198546 0.898124 ] [ 0.363309 0.794386 0.568186 ] [ 0.359513 0.198546 0.101876 ] [ 0.636691 0.794386 0.431814 ] [ 0 0.07496 0 ] [ 0.5 0.57496 0 ] [ 0.929768 0.935612 0.815861 ] [ 0.070232 0.935612 0.184139 ] [ 0.924052 0.209406 0.062851 ] [ 0.075948 0.209406 0.937149 ] [ 0.429768 0.435612 0.815861 ] [ 0.570232 0.435612 0.184139 ] [ 0.424052 0.709406 0.062851 ] [ 0.575948 0.709406 0.937149 ] ] } "species" { "source-value" [ "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "Cs" "C" "C" "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" 12.4885793958 "source-unit" "angstrom" } "b" { "source-value" 6.11329598178 "source-unit" "angstrom" } "c" { "source-value" 6.60616200407 "source-unit" "angstrom" } "beta" { "source-value" 113.58838299 "source-unit" "degree" } }