[ { "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" [ "Cs" "Cs" "Cs" "Cs" ] } "a" { "source-value" 6.08874398469925 "source-unit" "angstrom" "si-unit" "m" "si-value" 6.088743984699251e-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" 37.079309380728326 "source-unit" "GPa" "source-std-uncert-value" 0.007335930724868551 "si-unit" "kg / m s^2" "si-value" 37079309380.72832 } "c12" { "source-value" 19.46661210224857 "source-unit" "GPa" "source-std-uncert-value" 0.005187286361849012 "si-unit" "kg / m s^2" "si-value" 19466612102.24857 } "c44" { "source-value" 19.467934570420578 "source-unit" "GPa" "source-std-uncert-value" 0.0018339826812337494 "si-unit" "kg / m s^2" "si-value" 19467934570.42058 } "excess" { "source-value" 8.326672684690508e-11 "source-unit" "GPa" "source-std-uncert-value" 0.0025936431809132944 "si-unit" "kg / m s^2" "si-value" 0.08326672684690509 } } { "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" [ "Cs" "Cs" "Cs" "Cs" ] } "a" { "source-value" 6.08874398469925 "source-unit" "angstrom" "si-unit" "m" "si-value" 6.088743984699251e-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" 25.337511195075155 "source-unit" "GPa" "source-std-uncert-value" 0.004235401578748263 "si-unit" "kg / m s^2" "si-value" 25337511195.07515 } } ]