{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-1" } "basis-atom-coordinates" { "source-value" [ [ 0 0.5 0.5 ] [ 0 0.5 0 ] [ 0.375088 0.191146 0.724882 ] [ 0.624912 0.808854 0.275118 ] [ 0.825247 0.033791 0.689699 ] [ 0.482454 0.745789 0.834723 ] [ 0.174753 0.966209 0.310301 ] [ 0.517546 0.254211 0.165277 ] [ 0.23076 0.115907 0.147292 ] [ 0.309241 0.875321 0.721649 ] [ 0.573968 0.498874 0.28735 ] [ 0.909377 0.802682 0.21879 ] [ 0.690759 0.124679 0.278351 ] [ 0.76924 0.884093 0.852708 ] [ 0.334726 0.788345 0.330159 ] [ 0.445145 0.737167 0.028884 ] [ 0.426032 0.501126 0.71265 ] [ 0.207203 0.152935 0.479863 ] [ 0.792797 0.847065 0.520137 ] [ 0.090623 0.197318 0.78121 ] [ 0.554855 0.262833 0.971116 ] [ 0.665274 0.211655 0.669841 ] ] } "species" { "source-value" [ "K" "K" "Ga" "Ga" "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" 6.38917773134 "source-unit" "angstrom" } "b" { "source-value" 6.48278397432 "source-unit" "angstrom" } "c" { "source-value" 8.35408594588 "source-unit" "angstrom" } "alpha" { "source-value" 96.5254203014 "source-unit" "degree" } "beta" { "source-value" 103.900146162 "source-unit" "degree" } "gamma" { "source-value" 103.696902617 "source-unit" "degree" } }