{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-triclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P1" } "basis-atom-coordinates" { "source-value" [ [ 0.990867 0.744723 0.501451 ] [ 0.768736 0.233625 0.754563 ] [ 0.500348 0.247793 0.992563 ] [ 0.509482 0.754709 0.996607 ] [ 0.754692 0.986544 0.247652 ] [ 0.226816 0.258924 0.248114 ] [ 0.496279 0.504326 0.494269 ] [ 0.753468 0.764129 0.748189 ] [ 0.99279 0.004158 0.000076 ] [ 0.781103 0.519235 0.254348 ] [ 0.507229 0.996597 0.501117 ] [ 0.215786 0.492936 0.749132 ] [ 0.556641 0.239488 0.186863 ] [ 0.824597 0.48217 0.453702 ] [ 0.292781 0.738373 0.425432 ] [ 0.068993 0.784551 0.689305 ] [ 0.535613 0.002099 0.701471 ] [ 0.057421 0.221033 0.684797 ] [ 0.319205 0.998906 0.918659 ] [ 0.821211 0.283851 0.941298 ] [ 0.299843 0.502834 0.954006 ] [ 0.824496 0.721954 0.936424 ] [ 0.082204 0.502553 0.171434 ] [ 0.53467 0.759505 0.185065 ] [ 0.080519 0.984021 0.201901 ] [ 0.841725 0.009376 0.436316 ] [ 0.291659 0.261544 0.438699 ] [ 0.570827 0.500044 0.686547 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Ga" "Hg" "Hg" "Hg" "Hg" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" "Te" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.53208533 "source-unit" "angstrom" } "b" { "source-value" 8.82866069 "source-unit" "angstrom" } "c" { "source-value" 14.43970103 "source-unit" "angstrom" } "alpha" { "source-value" 89.99548178 "source-unit" "degree" } "beta" { "source-value" 100.88417155 "source-unit" "degree" } "gamma" { "source-value" 90.10784762 "source-unit" "degree" } }