manual   quickstart   instguide   update   basis

Next: 18 ORBITAL LOCALIZATION Up: 17 THE DENSITY FUNCTIONAL Previous: 17.5 Empirical damped dispersion   Contents   Index   PDF

17.6 Examples

The following shows the use of both non-self-consistent and self-consistent DFT. cndft.com



molpro@molpro.net 2010-07-28