[ { "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" [ "Ca" "Ca" ] } "a" { "source-value" 3.568595938384533 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.568595938384533e-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" 54.07045744240934 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724896227 "si-unit" "kg / m s^2" "si-value" 54070457442.40934 } "c12" { "source-value" 18.256244357884075 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361847616 "si-unit" "kg / m s^2" "si-value" 18256244357.88408 } "c44" { "source-value" 25.303221396272303 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812432544 "si-unit" "kg / m s^2" "si-value" 25303221396.2723 } "excess" { "source-value" 0.020108615476452176 "source-unit" "GPa" "source-std-uncert-value" 0.002593643180913306 "si-unit" "kg / m s^2" "si-value" 20108615.47645218 } } { "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" [ "Ca" "Ca" ] } "a" { "source-value" 3.568595938384533 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.568595938384533e-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" 30.194315386059163 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578752828 "si-unit" "kg / m s^2" "si-value" 30194315386.05916 } } ]