{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-rhombohedral-crystal-npt" "instance-id" 1 "space-group" { "source-value" "R3m" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.257391 ] [ 0.666667 0.333333 0.590724 ] [ 0.333333 0.666667 0.924057 ] [ 0 0 0.747906 ] [ 0.666667 0.333333 0.081239 ] [ 0.333333 0.666667 0.414572 ] [ 0 0 0.860483 ] [ 0.666667 0.333333 0.193816 ] [ 0.333333 0.666667 0.527149 ] [ 0 0 0.994221 ] [ 0.666667 0.333333 0.327554 ] [ 0.333333 0.666667 0.660887 ] ] } "species" { "source-value" [ "Cr" "Cr" "Cr" "Ag" "Ag" "Ag" "Se" "Se" "Se" "Se" "Se" "Se" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 3.58574372508 "source-unit" "angstrom" } "alpha" { "source-value" 90 "source-unit" "degree" } }