{ "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 0 0 ] [ 0.75 0.75 0 ] [ 0.25 0.75 0 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] [ 0.25 0.25 0 ] [ 0.75 0.25 0 ] [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.5 0 0 ] [ 0.252782 0 0.799643 ] [ 0.007387 0.731118 0.784192 ] [ 0.007387 0.268882 0.784192 ] [ 0.747218 0 0.200357 ] [ 0.748137 0 0.802999 ] [ 0.992613 0.268882 0.215808 ] [ 0.992613 0.731118 0.215808 ] [ 0.251863 0 0.197001 ] [ 0.752782 0.5 0.799643 ] [ 0.507387 0.231118 0.784192 ] [ 0.507387 0.768882 0.784192 ] [ 0.247218 0.5 0.200357 ] [ 0.248137 0.5 0.802999 ] [ 0.492613 0.768882 0.215808 ] [ 0.492613 0.231118 0.215808 ] [ 0.751863 0.5 0.197001 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Te" "Te" "O" "O" "O" "O" "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" 10.15067997 "source-unit" "angstrom" } "b" { "source-value" 5.97014671 "source-unit" "angstrom" } "c" { "source-value" 6.3275179 "source-unit" "angstrom" } "beta" { "source-value" 128.41029669 "source-unit" "degree" } }