{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-hexagonal-crystal-npt" "instance-id" 1 "space-group" { "source-value" "P-62c" } "basis-atom-coordinates" { "source-value" [ [ 0.007795 0.401513 0.75 ] [ 0.598487 0.606283 0.75 ] [ 0.393717 0.992205 0.75 ] [ 0.992205 0.393717 0.25 ] [ 0.606283 0.598487 0.25 ] [ 0.401513 0.007795 0.25 ] [ 0.333333 0.666667 0.466445 ] [ 0.666667 0.333333 0.533555 ] [ 0.333333 0.666667 0.033555 ] [ 0 0 0.75 ] [ 0 0 0.25 ] [ 0.666667 0.333333 0.966445 ] [ 0.267308 0.267308 0.5 ] [ 0 0.732692 0.5 ] [ 0 0.732692 0 ] [ 0.732692 0 0.5 ] [ 0.732692 0 0 ] [ 0.267308 0.267308 0 ] ] } "species" { "source-value" [ "Hf" "Hf" "Hf" "Hf" "Hf" "Hf" "Co" "Co" "Co" "Co" "Co" "Co" "Sn" "Sn" "Sn" "Sn" "Sn" "Sn" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.11017740268 "source-unit" "angstrom" } "c" { "source-value" 7.16404481 "source-unit" "angstrom" } "isothermal-bulk-modulus" { "source-value" 139.83302715237812 "source-unit" "GPa" "source-std-uncert-value" 0.7743094502482109 } }