{ "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" [ [ 0.119767 0.5 0.321874 ] [ 0.880233 0.5 0.678126 ] [ 0.619767 0 0.321874 ] [ 0.380233 0 0.678126 ] [ 0.805716 0.5 0.133315 ] [ 0 0 0 ] [ 0.194284 0.5 0.866685 ] [ 0.305716 0 0.133315 ] [ 0.5 0.5 0 ] [ 0.694284 0 0.866685 ] [ 0.092789 0 0.640381 ] [ 0.907211 0 0.359619 ] [ 0.592789 0.5 0.640381 ] [ 0.407211 0.5 0.359619 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Y" "Al" "Al" "Al" "Al" "Al" "Al" "Si" "Si" "Si" "Si" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 10.19652464 "source-unit" "angstrom" } "b" { "source-value" 4.05117656 "source-unit" "angstrom" } "c" { "source-value" 6.63690714 "source-unit" "angstrom" } "beta" { "source-value" 101.02370806 "source-unit" "degree" } }