{ "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-62m" } "basis-atom-coordinates" { "source-value" [ [ 0.416233 0.416233 0.5 ] [ 0.583767 0 0.5 ] [ 0 0.583767 0.5 ] [ 0 0.236959 0 ] [ 0.763041 0.763041 0 ] [ 0.236959 0 0 ] [ 0.666667 0.333333 0 ] [ 0 0 0.5 ] [ 0.333333 0.666667 0 ] ] } "species" { "source-value" [ "Y" "Y" "Y" "Al" "Al" "Al" "Pd" "Pd" "Pd" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.16536212793 "source-unit" "angstrom" } "c" { "source-value" 4.08227616 "source-unit" "angstrom" } "isothermal-bulk-modulus" { "source-value" 92.87935794226138 "source-unit" "GPa" "source-std-uncert-value" 1.2854819140924434 } }