[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Ti" ] } "a" { "source-value" 2.7734025940299043 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.773402594029904e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 142.14412746052864 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725039691 "si-unit" "kg / m s^2" "si-value" 142144127460.5286 } "c12" { "source-value" 14.207471485508735 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863618429525 "si-unit" "kg / m s^2" "si-value" 14207471485.50874 } "c44" { "source-value" -5.997986854227615 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812118082 "si-unit" "kg / m s^2" "si-value" -5997986854.227615 } "excess" { "source-value" 0.0 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.0 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Ti" ] } "a" { "source-value" 2.7734025940299043 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.773402594029904e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] ] } "space-group" { "source-value" "Pm-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" 56.853023477182035 "source-unit" "GPa" "source-std-uncert-value" 0.0042354015787778995 "si-unit" "kg / m s^2" "si-value" 56853023477.18204 } } ]