{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2/c" } "basis-atom-coordinates" { "source-value" [ [ 0 0.243011 0.25 ] [ 0 0.756989 0.75 ] [ 0.5 0.250848 0.75 ] [ 0.5 0.749152 0.25 ] [ 0.263697 0.56447 0.932285 ] [ 0.736303 0.56447 0.567715 ] [ 0.262721 0.062846 0.059229 ] [ 0.737279 0.062846 0.440771 ] [ 0.737279 0.937154 0.940771 ] [ 0.262721 0.937154 0.559229 ] [ 0.263697 0.43553 0.432285 ] [ 0.736303 0.43553 0.067715 ] ] } "species" { "source-value" [ "Li" "Li" "Y" "Y" "F" "F" "F" "F" "F" "F" "F" "F" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.13418472256 "source-unit" "angstrom" } "b" { "source-value" 5.36265619 "source-unit" "angstrom" } "c" { "source-value" 5.36142040787 "source-unit" "angstrom" } "beta" { "source-value" 90.8467357109 "source-unit" "degree" } }