{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.261959 0.751003 0.359826 ] [ 0.261959 0.248997 0.859826 ] [ 0.758113 0.772756 0.164206 ] [ 0.246359 0.246723 0.32614 ] [ 0.758113 0.227244 0.664206 ] [ 0.246359 0.753277 0.82614 ] [ 0.25224 0.513498 0.090487 ] [ 0.745657 0.019638 0.403724 ] [ 0.25224 0.486502 0.590487 ] [ 0.745657 0.980362 0.903724 ] [ 0.796828 0.989412 0.052063 ] [ 0.965294 0.562249 0.120639 ] [ 0.408036 0.681473 0.163167 ] [ 0.322942 0.316901 0.147393 ] [ 0.878531 0.836211 0.339089 ] [ 0.862608 0.205044 0.350351 ] [ 0.451624 0.003447 0.373465 ] [ 0.304276 0.486247 0.444791 ] [ 0.796828 0.010588 0.552063 ] [ 0.965294 0.437751 0.620639 ] [ 0.408036 0.318527 0.663167 ] [ 0.322942 0.683099 0.647393 ] [ 0.878531 0.163789 0.839089 ] [ 0.862608 0.794956 0.850351 ] [ 0.451624 0.996553 0.873465 ] [ 0.304276 0.513753 0.944791 ] ] } "species" { "source-value" [ "Li" "Li" "Fe" "Fe" "Fe" "Fe" "P" "P" "P" "P" "O" "O" "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" 5.19353645 "source-unit" "angstrom" } "b" { "source-value" 6.88829825 "source-unit" "angstrom" } "c" { "source-value" 10.40377449 "source-unit" "angstrom" } "beta" { "source-value" 90.94216858 "source-unit" "degree" } }