{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P2_1/c" } "basis-atom-coordinates" { "source-value" [ [ 0.849734 0.478815 0.131989 ] [ 0.150266 0.978815 0.368011 ] [ 0.150266 0.521185 0.868011 ] [ 0.849734 0.021185 0.631989 ] [ 0.29708 0.825496 0.601709 ] [ 0.70292 0.325496 0.898291 ] [ 0.70292 0.174504 0.398291 ] [ 0.29708 0.674504 0.101709 ] [ 0.307185 0.807815 0.950978 ] [ 0.692815 0.307815 0.549022 ] [ 0.692815 0.192185 0.049022 ] [ 0.307185 0.692185 0.450978 ] [ 0.183294 0.376593 0.071732 ] [ 0.816706 0.876593 0.428268 ] [ 0.816706 0.623407 0.928268 ] [ 0.183294 0.123407 0.571732 ] [ 0.072854 0.811616 0.190267 ] [ 0.927146 0.311616 0.309733 ] [ 0.927146 0.188384 0.809733 ] [ 0.072854 0.688384 0.690267 ] [ 0.568848 0.678069 0.186763 ] [ 0.431152 0.178069 0.313237 ] [ 0.431152 0.321931 0.813237 ] [ 0.568848 0.821931 0.686763 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Ga" "Ga" "Ga" "Ga" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" "Cl" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.09053948786 "source-unit" "angstrom" } "b" { "source-value" 6.86059625 "source-unit" "angstrom" } "c" { "source-value" 13.2108150253 "source-unit" "angstrom" } "beta" { "source-value" 92.5995353449 "source-unit" "degree" } }