{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-6" } "basis-atom-coordinates" { "source-value" [ [ 0.283113 0.980378 0.5 ] [ 0.019622 0.302735 0.5 ] [ 0.697265 0.716887 0.5 ] [ 0.371357 0.360329 0 ] [ 0.639671 0.011028 0 ] [ 0.988972 0.628643 0 ] [ 0.333333 0.666667 0.5 ] [ 0 0 0 ] [ 0.666667 0.333333 0.5 ] [ 0.106506 0.910368 0 ] [ 0.138285 0.58505 0.5 ] [ 0.089632 0.196139 0 ] [ 0.446764 0.861715 0.5 ] [ 0.41495 0.553236 0.5 ] [ 0.470959 0.253238 0.5 ] [ 0.803861 0.893494 0 ] [ 0.782278 0.529041 0.5 ] [ 0.746762 0.217722 0.5 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Co" "Co" "Co" "B" "B" "B" "O" "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" 8.17101681 "source-unit" "angstrom" } "c" { "source-value" 3.07066795 "source-unit" "angstrom" } }