Firefly and PC GAMESS-related discussion club

Learn how to ask questions correctly  
We are NATO-free zone

Documentation for Firefly 8.1.0

Thomas Pijper

Dear Firefly users,

New documentation for Firefly is now online and can be found in the "Manuals" section. The most important improvements are information on analytical gradients for TDHF and TDDFT, keyword descriptions for the $DET and $CIDET groups, and information on four new functionals.

Complete keyword descriptions for the $TDHF and $TDDFT groups are unfortunately not yet ready and will thus appear in the next update. In the meantime, an incomplete list of descriptions for these groups (as well as for all other groups not yet included) can be found in the older manual "Firefly_input_rev002.pdf".

Kind regards,

[ Previous ] [ Next ] [ Index ]           Sun Jun 1 '14 6:33pm
[ Reply ] [ Edit ] [ Delete ]           This message read 867 times