{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2/m" } "basis-atom-coordinates" { "source-value" [ [ 0.330687 0.5 0.372469 ] [ 0.669313 0.5 0.627531 ] [ 0.830687 0 0.372469 ] [ 0.169313 0 0.627531 ] [ 0.155521 0.5 0.944854 ] [ 0.844479 0.5 0.055146 ] [ 0.655521 0 0.944854 ] [ 0.344479 0 0.055146 ] [ 0.95629 0 0.821312 ] [ 0.04371 0 0.178688 ] [ 0.45629 0.5 0.821312 ] [ 0.54371 0.5 0.178688 ] [ 0.957136 0.5 0.69652 ] [ 0.159702 0 0.064174 ] [ 0.840298 0 0.935826 ] [ 0.042864 0.5 0.30348 ] [ 0.457136 0 0.69652 ] [ 0.659702 0.5 0.064174 ] [ 0.340298 0.5 0.935826 ] [ 0.542864 0 0.30348 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "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" 10.90741627 "source-unit" "angstrom" } "b" { "source-value" 3.38881309 "source-unit" "angstrom" } "c" { "source-value" 8.36646441 "source-unit" "angstrom" } "beta" { "source-value" 120.58462746 "source-unit" "degree" } }