[ { "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" 4.076907835900783 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.076907835900783e-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" 4782.267438873202 "source-unit" "GPa" "source-std-uncert-value" 0.007335930732598006 "si-unit" "kg / m s^2" "si-value" 4782267438873.202 } "c12" { "source-value" 5259.999927515553 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863678851045 "si-unit" "kg / m s^2" "si-value" 5259999927515.554 } "c44" { "source-value" -461.12117441679516 "source-unit" "GPa" "source-std-uncert-value" 0.00183398268195316 "si-unit" "kg / m s^2" "si-value" -461121174416.7952 } "excess" { "source-value" 0.0001802430797208311 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 180243.0797208311 } } { "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" 4.076907835900783 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.076907835900783e-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" 5100.755764634769 "source-unit" "GPa" "source-std-uncert-value" 0.00423540158352143 "si-unit" "kg / m s^2" "si-value" 5100755764634.769 } } ]