{ "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" [ [ 0.172115 0.055288 0.898807 ] [ 0.827885 0.555288 0.601193 ] [ 0.172115 0.444712 0.398807 ] [ 0.827885 0.944712 0.101193 ] [ 0.625621 0.223552 0.741748 ] [ 0.374379 0.723552 0.758252 ] [ 0.625621 0.276448 0.241748 ] [ 0.374379 0.776448 0.258252 ] [ 0.194857 0.37511 0.809344 ] [ 0.805143 0.87511 0.690656 ] [ 0.194857 0.12489 0.309344 ] [ 0.805143 0.62489 0.190656 ] [ 0.730445 0.997968 0.793952 ] [ 0.387025 0.2522 0.9112 ] [ 0.269555 0.497968 0.706048 ] [ 0.929277 0.368968 0.793299 ] [ 0.070723 0.868968 0.706701 ] [ 0.387025 0.2478 0.4112 ] [ 0.612975 0.7522 0.5888 ] [ 0.929277 0.131032 0.293299 ] [ 0.070723 0.631032 0.206701 ] [ 0.730445 0.502032 0.293952 ] [ 0.612975 0.7478 0.0888 ] [ 0.269555 0.002032 0.206048 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Co" "Co" "Co" "Co" "B" "B" "B" "B" "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" 5.2833666 "source-unit" "angstrom" } "b" { "source-value" 8.38675394 "source-unit" "angstrom" } "c" { "source-value" 6.6857475 "source-unit" "angstrom" } "beta" { "source-value" 114.14823515 "source-unit" "degree" } }