[ { "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" 2.7218548655509953 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.721854865550995e-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" 216.0824518492416 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725160129 "si-unit" "kg / m s^2" "si-value" 216082451849.2416 } "c12" { "source-value" -20.520529670761572 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361850225 "si-unit" "kg / m s^2" "si-value" -20520529670.76157 } "c44" { "source-value" -43.61124998628099 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812730769 "si-unit" "kg / m s^2" "si-value" -43611249986.28099 } "excess" { "source-value" 1.036208156317041e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 1.036208156317041 } } { "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" 2.7218548655509953 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.721854865550995e-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" 58.34713083590615 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578805037 "si-unit" "kg / m s^2" "si-value" 58347130835.90615 } } ]