The next paper with me as a co-author just came out, actually: "Synthesis, Spectroscopy, and Computational Analysis of Photoluminescent Bis(aminophenyl)-Substituted Thiophene Derivatives" in collaboration with colleagues from the TU Vienna.
M06-2X proved to be a great functional for those substances and that state-specific PCM was superior to standard linear response PCM.
The next step will be to apply this methodology to a larger number of molecules.
The Man in the Ivory Tower: Reason (Part 3/3) - The ivory tower once hold the answers for all questions. Was the world ready for them?
13 hours ago