{ "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Im3" } "basis-atom-coordinates" { "source-value" [ [ 0.75 0.75 0.75 ] [ 0.75 0.25 0.75 ] [ 0.75 0.75 0.25 ] [ 0.25 0.75 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.25 ] [ 0.25 0.25 0.75 ] [ 0.75 0.25 0.25 ] [ 0 0.333342 0.15952 ] [ 0.666658 0.15952 0 ] [ 0.84048 0 0.333342 ] [ 0.666658 0.84048 0 ] [ 0.15952 0 0.666658 ] [ 0.333342 0.84048 0 ] [ 0.84048 0 0.666658 ] [ 0.15952 0 0.333342 ] [ 0.333342 0.15952 0 ] [ 0 0.666658 0.15952 ] [ 0 0.333342 0.84048 ] [ 0 0.666658 0.84048 ] [ 0.5 0.833342 0.65952 ] [ 0.166658 0.65952 0.5 ] [ 0.34048 0.5 0.833342 ] [ 0.166658 0.34048 0.5 ] [ 0.65952 0.5 0.166658 ] [ 0.833342 0.34048 0.5 ] [ 0.34048 0.5 0.166658 ] [ 0.65952 0.5 0.833342 ] [ 0.833342 0.65952 0.5 ] [ 0.5 0.166658 0.65952 ] [ 0.5 0.833342 0.34048 ] [ 0.5 0.166658 0.34048 ] ] } "species" { "source-value" [ "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Co" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" "Sb" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 9.11522528542 "source-unit" "angstrom" } "c11" { "source-value" 179.2201874844209 "source-unit" "GPa" } "c12" { "source-value" 34.786007011823145 "source-unit" "GPa" } "c44" { "source-value" 48.732742873333336 "source-unit" "GPa" } "excess" { "source-value" 0 "source-unit" "GPa" } }