[ { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.1189251393079758 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.118925139307976e-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" 165.88129679643617 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725078356 "si-unit" "kg / m s^2" "si-value" 165881296796.4362 } "c12" { "source-value" 178.33803430815132 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362032001 "si-unit" "kg / m s^2" "si-value" 178338034308.1513 } "c44" { "source-value" 83.86869474613643 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826813386524 "si-unit" "kg / m s^2" "si-value" 83868694746.13643 } "excess" { "source-value" 0.07145282928298173 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133356 "si-unit" "kg / m s^2" "si-value" 71452829.28298172 } } { "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" [ "Pd" "Pd" ] } "a" { "source-value" 3.1189251393079758 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.118925139307976e-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" 174.18578847091294 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578888245 "si-unit" "kg / m s^2" "si-value" 174185788470.9129 } } ]