[ { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 3.897482573986054 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.897482573986054e-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" 1226.6577613919435 "source-unit" "GPa" "source-std-uncert-value" 0.00733593072680626 "si-unit" "kg / m s^2" "si-value" 1226657761391.944 } "c12" { "source-value" 1188.558794898878 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863631955805 "si-unit" "kg / m s^2" "si-value" 1188558794898.878 } "c44" { "source-value" 204.0109097600482 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826815343522 "si-unit" "kg / m s^2" "si-value" 204010909760.0482 } "excess" { "source-value" 9.914321215852154e-05 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 99143.21215852154 } } { "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" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" 3.897482573986054 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.897482573986054e-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" 1201.2584503965663 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579854154 "si-unit" "kg / m s^2" "si-value" 1201258450396.566 } } ]