{ "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" [ [ 0.002694 0.517418 0.751406 ] [ 0.497306 0.017418 0.748594 ] [ 0.997306 0.482582 0.248594 ] [ 0.502694 0.982582 0.251406 ] [ 0.5 0.5 0.5 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.5 0.5 0 ] [ 0.739233 0.218963 0.469708 ] [ 0.760767 0.718963 0.030292 ] [ 0.260767 0.781037 0.530292 ] [ 0.239233 0.281037 0.969708 ] [ 0.783172 0.737014 0.468834 ] [ 0.716828 0.237014 0.031166 ] [ 0.216828 0.262986 0.531166 ] [ 0.283172 0.762986 0.968834 ] [ 0.941275 0.992558 0.740374 ] [ 0.558725 0.492558 0.759626 ] [ 0.441275 0.507442 0.240374 ] [ 0.058725 0.007442 0.259626 ] ] } "species" { "source-value" [ "Sr" "Sr" "Sr" "Sr" "Co" "Co" "W" "W" "O" "O" "O" "O" "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" 5.71575790747 "source-unit" "angstrom" } "b" { "source-value" 5.67841778 "source-unit" "angstrom" } "c" { "source-value" 7.99712668554 "source-unit" "angstrom" } "beta" { "source-value" 90.1408663901 "source-unit" "degree" } }