[ { "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" [ "Mn" "Mn" ] } "a" { "source-value" 2.7879842966794968 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.787984296679497e-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" 575.8573766126402 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725746168 "si-unit" "kg / m s^2" "si-value" 575857376612.6403 } "c12" { "source-value" 535.6321023603759 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863624435345 "si-unit" "kg / m s^2" "si-value" 535632102360.3759 } "c44" { "source-value" 115.61142544046454 "source-unit" "GPa" "source-std-uncert-value" 0.001833982681390358 "si-unit" "kg / m s^2" "si-value" 115611425440.4645 } "excess" { "source-value" 0.01572310400396158 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133035 "si-unit" "kg / m s^2" "si-value" 15723104.00396158 } } { "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" [ "Mn" "Mn" ] } "a" { "source-value" 2.7879842966794968 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.787984296679497e-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" 549.0405271111306 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579240777 "si-unit" "kg / m s^2" "si-value" 549040527111.1306 } } ]