[ { "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" 4.615999475121498 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.615999475121498e-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" 231.88499632103677 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072518587 "si-unit" "kg / m s^2" "si-value" 231884996321.0368 } "c12" { "source-value" 181.97996105381245 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362036194 "si-unit" "kg / m s^2" "si-value" 181979961053.8124 } "c44" { "source-value" 72.87888454530336 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813207507 "si-unit" "kg / m s^2" "si-value" 72878884545.30336 } "excess" { "source-value" 2.2137532547840185e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 22137.53254784019 } } { "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" 4.615999475121498 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.615999475121498e-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" 198.61497280955388 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578911219 "si-unit" "kg / m s^2" "si-value" 198614972809.5539 } } ]