{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-62c" } "basis-atom-coordinates" { "source-value" [ [ 0.58264 0.92783 0.75 ] [ 0.07217 0.65481 0.75 ] [ 0.34519 0.41736 0.75 ] [ 0.41736 0.34519 0.25 ] [ 0.65481 0.07217 0.25 ] [ 0 0 0 ] [ 0 0 0.5 ] [ 0.92783 0.58264 0.25 ] [ 0.167344 0.450086 0.411532 ] [ 0.282742 0.832656 0.411532 ] [ 0.549914 0.717258 0.411532 ] [ 0.717258 0.549914 0.588468 ] [ 0.282742 0.832656 0.088468 ] [ 0.167344 0.450086 0.088468 ] [ 0.832656 0.282742 0.911532 ] [ 0.450086 0.167344 0.911532 ] [ 0.450086 0.167344 0.588468 ] [ 0.832656 0.282742 0.588468 ] [ 0.717258 0.549914 0.911532 ] [ 0.549914 0.717258 0.088468 ] [ 0.259864 0.034415 0.75 ] [ 0.333333 0.666667 0.54557 ] [ 0.333333 0.666667 0.95443 ] [ 0.666667 0.333333 0.04557 ] [ 0.666667 0.333333 0.45443 ] [ 0.034415 0.259864 0.25 ] [ 0.225449 0.965585 0.25 ] [ 0.740136 0.774551 0.25 ] [ 0.965585 0.225449 0.75 ] [ 0.774551 0.740136 0.75 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "K" "K" "K" "K" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "Au" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "a" { "source-value" 9.83708300124 "source-unit" "angstrom" } "c" { "source-value" 10.13607066 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.6283581519999997 "source-unit" "eV" } }