One of the latest papers of my Ph.D. thesis has been published today! A summer reading suggestion: Check out the effect of electric fields in charge-transfer rates of donor-acceptor dyads⚡️
Very happy to see our latest paper in @JChemPhys on the "Effect of external electric fields in the charge transfer rates of donor–acceptor dyads: A straightforward computational evaluation" by @PauBesalu, Alexander A. Voityuk, @JosepmLuis and @miquelsola https://t.co/raQaX4FImN
"RPA, an accurate and fast method for the computation of non-linear optical properties" Should we use RPA to study NLOPs? Ans: YES 😉! Nice collab. with @PauBesalu F. B. (@UnivParisSaclay ), A.J.J.-P.(@UA_Universidad), and J.C.S.-G (@UA_Universidad)
https://t.co/4F5pAJDMvs
The current session is closed by @PauBesalu (@DIMOCAT_iqcc, @IQCCUdG, @univgirona), the last speaker of this morning. He discusses his work in defluorination-hydroxylation of 2-halophenolates by a dicopper(III) complex in a mixed experimental-theoretical study. #ADHOC2022