[ { "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" [ "Sc" "Sc" ] } "a" { "source-value" 3.742339253425598 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.742339253425598e-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" 569.8790164010201 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072573643 "si-unit" "kg / m s^2" "si-value" 569879016401.02 } "c12" { "source-value" 695.7937684635945 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362628011 "si-unit" "kg / m s^2" "si-value" 695793768463.5945 } "c44" { "source-value" 696.5609903963941 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826823366688 "si-unit" "kg / m s^2" "si-value" 696560990396.3942 } "excess" { "source-value" 0.37361329674476157 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809135095 "si-unit" "kg / m s^2" "si-value" 373613296.7447616 } } { "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" [ "Sc" "Sc" ] } "a" { "source-value" 3.742339253425598 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.742339253425598e-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" 653.8221844427363 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579339319 "si-unit" "kg / m s^2" "si-value" 653822184442.7363 } } ]