[ { "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" 2.653443209826946 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.653443209826946e-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" 1058.7814760211684 "source-unit" "GPa" "source-std-uncert-value" 0.007335930726532806 "si-unit" "kg / m s^2" "si-value" 1058781476021.168 } "c12" { "source-value" 551.7378630795408 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863624620865 "si-unit" "kg / m s^2" "si-value" 551737863079.5408 } "c44" { "source-value" 554.3963022698069 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826821050964 "si-unit" "kg / m s^2" "si-value" 554396302269.8069 } "excess" { "source-value" 1.3292572672206964 "source-unit" "GPa" "source-std-uncert-value" 0.00259364318091406 "si-unit" "kg / m s^2" "si-value" 1329257267.220696 } } { "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" 2.653443209826946 "source-unit" "angstrom" "si-unit" "m" "si-value" 2.653443209826946e-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" 720.7524007267499 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579402264 "si-unit" "kg / m s^2" "si-value" 720752400726.7499 } } ]