{ "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 0 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0 0.5 0.5 ] [ 0.74145 0 0.272097 ] [ 0.273414 0.5 0.270348 ] [ 0.25855 0 0.727903 ] [ 0.726586 0.5 0.729652 ] ] } "species" { "source-value" [ "Li" "Li" "Ti" "Ni" "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" 5.06890751 "source-unit" "angstrom" } "b" { "source-value" 2.96785722 "source-unit" "angstrom" } "c" { "source-value" 5.11009252 "source-unit" "angstrom" } "beta" { "source-value" 108.73933208 "source-unit" "degree" } }