[ { "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "B" "B" "B" "B" ] } "a" { "source-value" 3.849792450666428 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.849792450666428e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 572.9180165008862 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072574138 "si-unit" "kg / m s^2" "si-value" 572918016500.8862 } "c12" { "source-value" 645.4775342326021 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362570056 "si-unit" "kg / m s^2" "si-value" 645477534232.6022 } "c44" { "source-value" 28.00599570163604 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812476569 "si-unit" "kg / m s^2" "si-value" 28005995701.63604 } "excess" { "source-value" 0.0003472392743713051 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913295 "si-unit" "kg / m s^2" "si-value" 347239.2743713051 } } { "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "instance-id" 2 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "B" "B" "B" "B" ] } "a" { "source-value" 3.849792450666428 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.849792450666428e-10 } "basis-atom-coordinates" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.5 0.5 ] [ 0.5 0.0 0.5 ] [ 0.5 0.5 0.0 ] ] } "space-group" { "source-value" "Fm-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" 621.2910283220301 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579308725 "si-unit" "kg / m s^2" "si-value" 621291028322.0302 } } ]