[ { "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" [ "Ni" "Ni" ] } "a" { "source-value" 3.050657838582993 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.050657838582993e-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" 219.29917146998528 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725165369 "si-unit" "kg / m s^2" "si-value" 219299171469.9853 } "c12" { "source-value" 136.71585459850564 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361984059 "si-unit" "kg / m s^2" "si-value" 136715854598.5056 } "c44" { "source-value" 136.92397675941825 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814250742 "si-unit" "kg / m s^2" "si-value" 136923976759.4183 } "excess" { "source-value" 0.10455282573043151 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133547 "si-unit" "kg / m s^2" "si-value" 104552825.7304315 } } { "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" [ "Ni" "Ni" ] } "a" { "source-value" 3.050657838582993 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.050657838582993e-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" 164.24362688899885 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578878895 "si-unit" "kg / m s^2" "si-value" 164243626888.9988 } } ]