[ { "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" [ "Mo" "Mo" ] } "a" { "source-value" 3.149100035429001 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.149100035429001e-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" 547.2961575209251 "source-unit" "GPa" "source-std-uncert-value" 0.0073359307256996445 "si-unit" "kg / m s^2" "si-value" 547296157520.9251 } "c12" { "source-value" 167.53990947770956 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362019564 "si-unit" "kg / m s^2" "si-value" 167539909477.7096 } "c44" { "source-value" 159.6946962525788 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681462165 "si-unit" "kg / m s^2" "si-value" 159694696252.5788 } "excess" { "source-value" 5.329070518201925e-09 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 5.329070518201926 } } { "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" [ "Mo" "Mo" ] } "a" { "source-value" 3.149100035429001 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.149100035429001e-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" 294.1253254921147 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579001043 "si-unit" "kg / m s^2" "si-value" 294125325492.1147 } } ]