{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/m" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0 ] [ 0.5 0.755407 0 ] [ 0.5 0.244593 0 ] [ 0.5 0 0.5 ] [ 0 0.752135 0.5 ] [ 0 0.247865 0.5 ] [ 0.5 0.5 0.5 ] [ 0.73564 0 0.30371 ] [ 0.774875 0.5 0.277643 ] [ 0.711961 0.761502 0.714156 ] [ 0.288039 0.761502 0.285844 ] [ 0.711961 0.238498 0.714156 ] [ 0.26436 0 0.69629 ] [ 0.225125 0.5 0.722357 ] [ 0.288039 0.238498 0.285844 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Si" "Ni" "Ni" "Ni" "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" 5.05744485 "source-unit" "angstrom" } "b" { "source-value" 5.50389799 "source-unit" "angstrom" } "c" { "source-value" 5.16754757 "source-unit" "angstrom" } "beta" { "source-value" 111.63307418 "source-unit" "degree" } }