[ { "short-name" { "source-value" [ "fcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 5.14347717166e-10 "source-value" 5.14347717166 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "property-id" "tag:staff@noreply.openkim.org,2014-05-21:property/elastic-constants-isothermal-cubic-crystal-npt" "c44" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 366879146149.0 "source-std-uncert-value" 0.001833982681799649 "source-value" 366.8791461493823 } "space-group" { "source-value" "Fm-3m" } "excess" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 364096876.944 "source-std-uncert-value" 0.0025936431809135043 "source-value" 0.36409687694442966 } "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 ] ] } "c12" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 366118192041.0 "source-std-uncert-value" 0.005187286362248288 "source-value" 366.1181920407682 } "c11" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 641700170556.0 "source-std-uncert-value" 0.00733593072585342 "source-value" 641.7001705556413 } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Lu" "Lu" "Lu" "Lu" ] } "instance-id" 1 } { "short-name" { "source-value" [ "fcc" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" 5.14347717166e-10 "source-value" 5.14347717166 } "temperature" { "si-unit" "K" "source-unit" "K" "si-value" 0.0 "source-value" 0 } "isothermal-bulk-modulus" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" 457978851546.0 "source-std-uncert-value" 0.0042354015791551385 "source-value" 457.9788515457259 } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/bulk-modulus-isothermal-cubic-crystal-npt" "space-group" { "source-value" "Fm-3m" } "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 ] ] } "cauchy-stress" { "si-unit" "kg / m s^2" "source-unit" "GPa" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-value" [ 0 0 0 0 0 0 ] } "species" { "source-value" [ "Lu" "Lu" "Lu" "Lu" ] } "instance-id" 2 } ]