[ { "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" 2.812021598219871 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.812021598219871e-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" 101.66895760183426 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072497376 "si-unit" "kg / m s^2" "si-value" 101668957601.8343 } "c12" { "source-value" 164.86994128924297 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362016488 "si-unit" "kg / m s^2" "si-value" 164869941289.243 } "c44" { "source-value" 135.7461307461767 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814231554 "si-unit" "kg / m s^2" "si-value" 135746130746.1767 } "excess" { "source-value" 0.10184927642008164 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913353 "si-unit" "kg / m s^2" "si-value" 101849276.4200816 } } { "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" 2.812021598219871 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.812021598219871e-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" 143.8029467267734 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578859672 "si-unit" "kg / m s^2" "si-value" 143802946726.7734 } } ]