{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.315174 0.814073 0.1351 ] [ 0.815174 0.685927 0.1351 ] [ 0.184826 0.314073 0.8649 ] [ 0.684826 0.185927 0.8649 ] [ 0.36572 0.254786 0.243287 ] [ 0.86572 0.245214 0.243287 ] [ 0.636638 0.736332 0.304942 ] [ 0.136638 0.763668 0.304942 ] [ 0.863362 0.236332 0.695058 ] [ 0.363362 0.263668 0.695058 ] [ 0.13428 0.754786 0.756713 ] [ 0.63428 0.745214 0.756713 ] [ 0.207355 0.611626 0.942051 ] [ 0.707355 0.888374 0.942051 ] [ 0.292645 0.111626 0.057949 ] [ 0.792645 0.388374 0.057949 ] ] } "species" { "source-value" [ "Mg" "Mg" "Mg" "Mg" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "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" 7.70724352 "source-unit" "angstrom" } "b" { "source-value" 6.40128346 "source-unit" "angstrom" } "c" { "source-value" 8.51445005 "source-unit" "angstrom" } "beta" { "source-value" 113.46019914 "source-unit" "degree" } }