[ { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.607383415102959 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.607383415102959e-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" 968.4543454340874 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072638567 "si-unit" "kg / m s^2" "si-value" 968454345434.0874 } "c12" { "source-value" 510.9746851228833 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362415134 "si-unit" "kg / m s^2" "si-value" 510974685122.8833 } "c44" { "source-value" 467.84544337895903 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826819641133 "si-unit" "kg / m s^2" "si-value" 467845443378.959 } "excess" { "source-value" 1.095420050963729e-08 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 10.95420050963729 } } { "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" [ "Cu" "Cu" "Cu" "Cu" ] } "a" { "source-value" 3.607383415102959 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.607383415102959e-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" 663.467905226618 "source-unit" "GPa" "source-std-uncert-value" 0.00423540157934839 "si-unit" "kg / m s^2" "si-value" 663467905226.6179 } } ]