{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.830534 0 0.846017 ] [ 0.143249 0.733115 0.113844 ] [ 0.440684 0 0.2572 ] [ 0.143249 0.266885 0.113844 ] [ 0.330534 0.5 0.846017 ] [ 0.643249 0.233115 0.113844 ] [ 0.940684 0.5 0.2572 ] [ 0.643249 0.766885 0.113844 ] [ 0.127582 0 0.595376 ] [ 0.627582 0.5 0.595376 ] [ 0.171558 0 0.33262 ] [ 0.839823 0 0.41093 ] [ 0.2507 0.176198 0.82577 ] [ 0.2507 0.823802 0.82577 ] [ 0.671558 0.5 0.33262 ] [ 0.339823 0.5 0.41093 ] [ 0.7507 0.676198 0.82577 ] [ 0.7507 0.323802 0.82577 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "C" "C" "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" 6.23704491134 "source-unit" "angstrom" } "b" { "source-value" 6.58268389144 "source-unit" "angstrom" } "c" { "source-value" 4.60179541048 "source-unit" "angstrom" } "beta" { "source-value" 128.286908292 "source-unit" "degree" } }