{ "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" [ [ 0.749037 0.749037 0 ] [ 0.250963 0 0 ] [ 0 0.250963 0 ] [ 0 0.586174 0.5 ] [ 0.586174 0 0.5 ] [ 0.413826 0.413826 0.5 ] [ 0 0 0.5 ] [ 0.666667 0.333333 0 ] [ 0.333333 0.666667 0 ] ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Mo" "Mo" "Mo" "P" "P" "P" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.85716387 "source-unit" "angstrom" } "c" { "source-value" 3.74992285 "source-unit" "angstrom" } "isothermal-bulk-modulus" { "source-value" 241.284890612592 "source-unit" "GPa" "source-std-uncert-value" 0.4983137897246195 } }