[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "O" "O" ] } "a" { "source-value" 5.147556811571121 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.147556811571121e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 0.27396269805992746 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307248085995 "si-unit" "kg / m s^2" "si-value" 273962698.0599275 } "c12" { "source-value" 0.3153960034576789 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361826952 "si-unit" "kg / m s^2" "si-value" 315396003.4576789 } "c44" { "source-value" 0.3153998242613061 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812025517 "si-unit" "kg / m s^2" "si-value" 315399824.2613061 } "excess" { "source-value" 1.1564823173181262e-10 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.1156482317318126 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "O" "O" ] } "a" { "source-value" 5.147556811571121 "source-unit" "angstrom" "si-unit" "m" "si-value" 5.147556811571121e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "space-group" { "source-value" "Im-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" 0.3015849016584284 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578724716 "si-unit" "kg / m s^2" "si-value" 301584901.6584284 } } ]