{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "C2" } "basis-atom-coordinates" { "source-value" [ [ 0 0.246152 0.5 ] [ 0.5 0.746152 0.5 ] [ 0 0.622061 0.5 ] [ 0.5 0.122061 0.5 ] [ 0.784275 0.963339 0.094428 ] [ 0.215725 0.963339 0.905572 ] [ 0.284275 0.463339 0.094428 ] [ 0.715725 0.463339 0.905572 ] [ 0.744571 0.106579 0.340596 ] [ 0.395786 0.943885 0.231979 ] [ 0.152038 0.775817 0.761457 ] [ 0 0.057715 0 ] [ 0.604214 0.943885 0.768021 ] [ 0.847962 0.775817 0.238543 ] [ 0.255429 0.106579 0.659404 ] [ 0.244571 0.606579 0.340596 ] [ 0.895786 0.443885 0.231979 ] [ 0.652038 0.275817 0.761457 ] [ 0.5 0.557715 0 ] [ 0.104214 0.443885 0.768021 ] [ 0.347962 0.275817 0.238543 ] [ 0.755429 0.606579 0.659404 ] ] } "species" { "source-value" [ "Li" "Li" "Al" "Al" "As" "As" "As" "As" "O" "O" "O" "O" "O" "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" 6.68463707296 "source-unit" "angstrom" } "b" { "source-value" 8.14436623766 "source-unit" "angstrom" } "c" { "source-value" 4.70739882069 "source-unit" "angstrom" } "beta" { "source-value" 104.142306321 "source-unit" "degree" } }