[ { "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" [ "Mg" "Mg" "Mg" "Mg" ] } "a" { "source-value" 5.582588136196137 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.582588136196138e-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" 33.503009795032824 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724862725 "si-unit" "kg / m s^2" "si-value" 33503009795.03283 } "c12" { "source-value" 18.09816102286912 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361847435 "si-unit" "kg / m s^2" "si-value" 18098161022.86912 } "c44" { "source-value" 15.754518427598073 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812277004 "si-unit" "kg / m s^2" "si-value" 15754518427.59807 } "excess" { "source-value" 2.258896773336995e-06 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 2258.896773336995 } } { "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" [ "Mg" "Mg" "Mg" "Mg" ] } "a" { "source-value" 5.582588136196137 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.582588136196138e-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" 23.233110613590355 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578746282 "si-unit" "kg / m s^2" "si-value" 23233110613.59035 } } ]