{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pm" } "basis-atom-coordinates" { "source-value" [ [ 0.922421 0 0.616996 ] [ 0.580839 0.5 0.11428 ] [ 0.422141 0 0.884287 ] [ 0.073259 0.5 0.385989 ] [ 0.914285 0 0.132176 ] [ 0.582165 0.5 0.62181 ] [ 0.420391 0 0.374497 ] [ 0.087598 0.5 0.870834 ] [ 0.908941 0.5 0.128968 ] [ 0.889879 0.5 0.615746 ] [ 0.599244 0 0.147783 ] [ 0.580793 0 0.624693 ] [ 0.414095 0.5 0.368653 ] [ 0.42666 0.5 0.854891 ] [ 0.101832 0 0.359751 ] [ 0.075456 0 0.898645 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ti" "Ti" "Ti" "V" "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" 6.10895271 "source-unit" "angstrom" } "b" { "source-value" 4.13867052 "source-unit" "angstrom" } "c" { "source-value" 6.90012967 "source-unit" "angstrom" } "beta" { "source-value" 91.67832857 "source-unit" "degree" } }