Firefly (computer program): Difference between revisions

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Firefly's unique capabilities include XMCQDPT2, a reformulation of Nakano's multi-state multi-configuration quasi-degenerate perturbation theory (MCQDPT) correcting for some of its deficiencies.<ref>{{cite journal |last1=Granovsky |first1=Alexander A. |title=Extended multi-configuration quasi-degenerate perturbation theory: The new approach to multi-state multi-reference perturbation theory |journal=The Journal of Chemical Physics |date=7 June 2011 |volume=134 |issue=21 |pages=214113 |doi=10.1063/1.3596699|pmid=21663350 |bibcode=2011JChPh.134u4113G }}</ref>
 
At the end of 2019, Firefly's main developer A. A. Granovsky unexpectedly passed awaydied but the project continues.<ref>[http://classic.chem.msu.su/gran/gamess/index.htm Firefly Official Website]</ref>
 
==See also==