[ { "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" [ "Zr" "Zr" ] } "a" { "source-value" 3.5703568384051323 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.570356838405132e-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" 201.65424465905525 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725136628 "si-unit" "kg / m s^2" "si-value" 201654244659.0552 } "c12" { "source-value" -33.64075072554615 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863618653365 "si-unit" "kg / m s^2" "si-value" -33640750725.54615 } "c44" { "source-value" 30.190572220281826 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812512157 "si-unit" "kg / m s^2" "si-value" 30190572220.28183 } "excess" { "source-value" 2.5165055224842425e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 2.516505522484243 } } { "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" [ "Zr" "Zr" ] } "a" { "source-value" 3.5703568384051323 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.570356838405132e-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" 44.79091440265432 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578808739 "si-unit" "kg / m s^2" "si-value" 44790914402.65432 } } ]