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Ismael, Laura, and Rodrigo’s paper on benchmarking for 2PA cross- sections is accepted in JCTC

 April 19, 2024 |  abrown |  Group members, HQP Achievements, Publications |  

Congratulations to Ismael, Rodrigo, and Laura as their paper Beyond Explored Functionals: A Computational Journey of Two-Photon Absorption is accepted into Journal of Chemical Theory and Computation. This is Isabel and Rorgio’s first JCTC and Laura’s first ever paper! Laura did a huge amount of the computational work during her summer project in 2023.

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July 23rd, 2021

Group attends, organizes, and presents at VSTC^3

The group participates in the first Virtual Symposium on Theoretical and Computational Chemistry in Canada (VSTC^3) held July 19-23. Alex […]
July 17th, 2021

Summer group BBQ – when restrictions on outdoor events were lifted

Group has a BBQ to celebrate all the events of the past year! First time many of us ever met […]
July 6th, 2021

Congratulations to Pierre and Arturo as their paper with the Michaelis group is accepted in Chem. Materials

Pierre and Arturo (Victor)’s paper with the Michaelis group “Uncovering Halogen Mixing and Octahedral Dynamics in Cs2SnX6  by Multinuclear Magnetic […]
May 3rd, 2021

Group welcomes Ismael as a new PhD student

Ismael Elayan, who recently completed his MSc with Professor Joshua Hollett, joins the group as a PhD student. Ismael will […]
May 1st, 2021

Group welcomes Moritz as a visiting student

Moritz Schäfer joins the group as a visiting MSc student from the University of Heidelberg, Germany. Moritz will work on […]
April 19th, 2021

Minh does a great job presenting his CHEM 403 research

Minh, who has been working in the group for his CHEM 401 and CHEM 403, presents his research “Dispersion and […]
April 14th, 2021

Congratulations to Arturo on passing his PhD candidacy exam

Arturo successfully passes his PhD candidacy exam after talking about and answering questions on his work on “Computational studies of […]
January 27th, 2021

Congratulations to Ryan on passing his CHEM 502

Rya passes his CHEM 502 after giving an interesting presentation on “Application of the Extremely Localized Molecular Orbital libraries for […]
January 16th, 2021

Group welcomes Labanya Bhattacharya as visiting SERB-OVDF

Labanya Bhattacharya joints the group for the next six months as a Indian Science and Engineering Research Board Overseas Visiting […]
January 4th, 2021

Group welcomes back Antoine.

Antoine returns to the group for a 1-year visit supported through a fellowship. He will continue his work on optimal […]