[ { "short-name" { "source-value" [ "bcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 3.28013525903e-10 "source-value" 3.28013525903 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "c44" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 62113096600.0 "source-std-uncert-value" 0.0018339826813032144 "source-value" 62.113096600031234 } "space-group" { "source-value" "Im-3m" } "excess" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 3.70074341542 "source-std-uncert-value" 0.0025936431809132944 "source-value" 3.7007434154180035e-09 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "c12" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 109793837575.0 "source-std-uncert-value" 0.005187286361953051 "source-value" 109.7938375753913 } "c11" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 107769096935.0 "source-std-uncert-value" 0.007335930724983698 "source-value" 107.76909693535215 } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Ti" "Ti" ] } "instance-id" 1 } { "short-name" { "source-value" [ "bcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 3.28013525903e-10 "source-value" 3.28013525903 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "isothermal-bulk-modulus" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 109118924029.0 "source-std-uncert-value" 0.004235401578827054 "source-value" 109.11892402871158 } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "space-group" { "source-value" "Im-3m" } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.5 0.5 0.5 ] ] } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Ti" "Ti" ] } "instance-id" 2 } ]