{ "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 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0.708557 0 0.941308 ] [ 0 0.195858 0.5 ] [ 0 0.804142 0.5 ] [ 0.291443 0 0.058692 ] [ 0.208557 0.5 0.941308 ] [ 0.5 0.695858 0.5 ] [ 0.5 0.304142 0.5 ] [ 0.791443 0.5 0.058692 ] ] } "species" { "source-value" [ "Li" "Li" "Ag" "Ag" "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" 6.89143246 "source-unit" "angstrom" } "b" { "source-value" 6.47239093 "source-unit" "angstrom" } "c" { "source-value" 3.576408 "source-unit" "angstrom" } "beta" { "source-value" 98.80212443 "source-unit" "degree" } }