[ { "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" [ "Re" "Re" "Re" "Re" ] } "a" { "source-value" 3.896744579076767 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.896744579076767e-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" 495.17462424723163 "source-unit" "GPa" "source-std-uncert-value" 0.007335930725614744 "si-unit" "kg / m s^2" "si-value" 495174624247.2316 } "c12" { "source-value" 310.2897593384759 "source-unit" "GPa" "source-std-uncert-value" 0.0051872863621839835 "si-unit" "kg / m s^2" "si-value" 310289759338.4759 } "c44" { "source-value" 234.68817524735127 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826815843227 "si-unit" "kg / m s^2" "si-value" 234688175247.3513 } "excess" { "source-value" 0.1201283931588439 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809133634 "si-unit" "kg / m s^2" "si-value" 120128393.1588439 } } { "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" [ "Re" "Re" "Re" "Re" ] } "a" { "source-value" 3.896744579076767 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.896744579076767e-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" 371.9180476413945 "source-unit" "GPa" "source-std-uncert-value" 0.004235401579074202 "si-unit" "kg / m s^2" "si-value" 371918047641.3945 } } ]