[ { "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" [ "Au" "Au" ] } "a" { "source-value" 3.225077815353871 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.225077815353871e-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" 171.2423465386477 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725087089 "si-unit" "kg / m s^2" "si-value" 171242346538.6477 } "c12" { "source-value" 176.04552940164896 "source-unit" "GPa" "source-std-uncert-value" 0.00518728636202936 "si-unit" "kg / m s^2" "si-value" 176045529401.649 } "c44" { "source-value" 61.88941724810172 "source-unit" "GPa" "source-std-uncert-value" 0.00183398268130285 "si-unit" "kg / m s^2" "si-value" 61889417248.10172 } "excess" { "source-value" 0.027956650920189934 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133105 "si-unit" "kg / m s^2" "si-value" 27956650.92018994 } } { "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" [ "Au" "Au" ] } "a" { "source-value" 3.225077815353871 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.225077815353871e-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" 174.44446844731522 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578888489 "si-unit" "kg / m s^2" "si-value" 174444468447.3152 } } ]