Saikat Mukherjee
@saikatm1986
Asst. Professor at the Nicolaus Copernicus University in Torun, Poland.
Computational Chemist,
specialist in excited states dynamics, method development
ID: 1301856928776286209
https://orcid.org/0000-0002-0025-4735 04-09-2020 12:17:50
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Today I talked at ICTP Trieste ICTP workshop about few of my research works done in Prof. Mario Barbatti's Mario Barbatti group in Aix-Marseille Univ. ICR Institut Chimie Radicalaire A big thanks to the organizers!
Visited the Molecular Modeling Group at the Nicolas Copernicus University in Torun, Poland UMK Torun. Talked about our newly developed protocols for simulating fluorescence and phosphorescence emissions with Mario Barbatti ICR Institut Chimie Radicalaire
Delivered a talk in the Chemistry and Mathematics in Phase Space (CHAMPS) workshop in Bristol, hosted by Prof. Dmitry Shalashilin. I talked about Quantum Dynamics from Classical Trajectories. Curios?? Well, article will be coming soon. Mario Barbatti ICR Institut Chimie Radicalaire
After hopping, velocity must be rescaled. How do we do that if NAC vectors aren't available? Josene Toldo, Rafael, Max Pinheiro Jr, Saikat Mukherjee, and I explain that in this new JCTC. #comchem doi.org/10.1021/acs.jc…
Yesterday at ICR Institut Chimie Radicalaire, Marseille, hosted by Mario Barbatti, we had the pleasure of listening to Prof. Henrik Ottosson from Uppsala University, Sweden. He is a pioneer in exploring excited state aromaticity. CompChemNews
Prof. Pavlo Dral Pavlo Dral from Xiamen Univ was speaking about Machine Learning excited states molecular dynamics at ICR ICR Institut Chimie Radicalaire Aix-Marseille Univ, invited by Mario Barbatti. He is paving the path of ML driven chemistry, soon become the future of computational chemistry.
Our contribution to the #CompChem #PredictionChallenge at The Journal of Chemical Physics is on arxiv.org/abs/2402.09890
How progressive is excited-state molecular dynamics? How well can it forecast an experiment? Our article in the The Journal of Chemical Physics discusses these issues. #compchem with Saikat Mukherjee, Rafael, Josene Toldo, and Hans Lischka. pubs.aip.org/aip/jcp/articl…
Look, who's in town! Spent a lovely evening with Pavlo Dral in Torun. Hoping to do some cool science together very soon.