{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-potential-energy-hexagonal-crystal" "instance-id" 1 "space-group" { "source-value" "P-31c" } "basis-atom-coordinates" { "source-value" [ [ 0 0 0.75 ] [ 0 0 0.25 ] [ 0.666667 0.333333 0.25 ] [ 0.333333 0.666667 0.75 ] [ 0.333333 0.666667 0.325608 ] [ 0.333333 0.666667 0.174392 ] [ 0.666667 0.333333 0.674392 ] [ 0.666667 0.333333 0.825608 ] [ 0.70067 0.019619 0.865944 ] [ 0.980381 0.29933 0.634056 ] [ 0.980381 0.681051 0.865944 ] [ 0.318949 0.019619 0.634056 ] [ 0.019619 0.318949 0.134056 ] [ 0.29933 0.980381 0.134056 ] [ 0.681051 0.70067 0.134056 ] [ 0.019619 0.70067 0.365944 ] [ 0.29933 0.318949 0.365944 ] [ 0.681051 0.980381 0.365944 ] [ 0.70067 0.681051 0.634056 ] [ 0.318949 0.29933 0.865944 ] ] } "species" { "source-value" [ "Ga" "Ga" "Ag" "Ag" "P" "P" "P" "P" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" "Se" ] } "a" { "source-value" 6.45750155 "source-unit" "angstrom" } "c" { "source-value" 14.9519757 "source-unit" "angstrom" } "cohesive-potential-energy" { "source-value" 3.9703952155000004 "source-unit" "eV" } }