[ { "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" [ "Ti" "Ti" ] } "a" { "source-value" 3.298021540045738 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.298021540045738e-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" 65.75000383377517 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724915253 "si-unit" "kg / m s^2" "si-value" 65750003833.77517 } "c12" { "source-value" 106.73061712890787 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361949522 "si-unit" "kg / m s^2" "si-value" 106730617128.9079 } "c44" { "source-value" 40.666621923858735 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812682797 "si-unit" "kg / m s^2" "si-value" 40666621923.85873 } "excess" { "source-value" 6.957397620985848e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 6.957397620985848 } } { "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" [ "Ti" "Ti" ] } "a" { "source-value" 3.298021540045738 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.298021540045738e-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" 93.07041269719696 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578811961 "si-unit" "kg / m s^2" "si-value" 93070412697.19696 } } ]