[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Hg" "Hg" "Hg" "Hg" ] } "a" { "source-value" 3.6306870579719552 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.630687057971955e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "c11" { "source-value" 57.814160722752035 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724902326 "si-unit" "kg / m s^2" "si-value" 57814160722.75204 } "c12" { "source-value" 32.98552340581134 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361864582 "si-unit" "kg / m s^2" "si-value" 32985523405.81134 } "c44" { "source-value" 33.054082041635354 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812558801 "si-unit" "kg / m s^2" "si-value" 33054082041.63535 } "excess" { "source-value" 0.03280340932222015 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913313 "si-unit" "kg / m s^2" "si-value" 32803409.32222015 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Hg" "Hg" "Hg" "Hg" ] } "a" { "source-value" 3.6306870579719552 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.630687057971955e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-3m" } "temperature" { "source-value" 0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "isothermal-bulk-modulus" { "source-value" 41.26173584479157 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578763238 "si-unit" "kg / m s^2" "si-value" 41261735844.79157 } } ]