[ { "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" 3.082927376031875 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.082927376031875e-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" 209.55561105992493 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725149499 "si-unit" "kg / m s^2" "si-value" 209555611059.9249 } "c12" { "source-value" 219.05203267403874 "source-unit" "GPa" "source-std-uncert-value" 0.005187286362078895 "si-unit" "kg / m s^2" "si-value" 219052032674.0387 } "c44" { "source-value" 146.5385786498379 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826814407353 "si-unit" "kg / m s^2" "si-value" 146538578649.8379 } "excess" { "source-value" 0.0819636817676601 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133417 "si-unit" "kg / m s^2" "si-value" 81963681.7676601 } } { "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" 3.082927376031875 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.082927376031875e-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" 215.88655880266745 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578927463 "si-unit" "kg / m s^2" "si-value" 215886558802.6674 } } ]