List

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.

  Category: Publications

1 2 3 … 6
April 19th, 2024

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

Congratulations to Ismael, Rodrigo, and Laura as their paper Beyond Explored Functionals: A Computational Journey of Two-Photon Absorption is accepted […]
January 19th, 2024

Another collaborative paper with Gabriel!

Alex contributes to a benchmark paper in Phys. Chem. Chem. Phys. entitled “A density functional theory benchmark on anti-oxidant-related properties […]
November 3rd, 2023

Shyam’s paper with Ben and Juli is published in J. Chem. Phys.

Congratulations ot Shyam on his paper in J. Chem. Phys. with Prof. Juli Gibbs and Dr. Ben Rehl! The paper […]
October 23rd, 2023

Another collaborator paper with Gabriel de Souza

Alex contributes to another collaborative paper with his long-time collaborator from Brazil Gabriel de Souza The paper “On the photoinduced […]
September 15th, 2023

Mack and Antoine’s collaborative paper with Otero-de-la-Roza and DiLabio published

Congratulations to Mack and Antoine on their paper “Accurate Potential Energy Surfaces Using Atom-Centered Potentials and Minimal High-Level Data” published […]
August 15th, 2023

Nathanael’s paper published in Energy Fuels

Congratulations to Nathanael whose second paper “Computational Investigations Complement Experiment for a System of Non-Covalently Bound Asphaltene Model Compounds” is […]
August 9th, 2023

Congratulations to Nathanael on his paper accepted into Energy&Fuels

Congratulations to Nathanael’s as his second paper “Computational Investigations Complement Experiment for a System of Non-Covalently Bound Asphaltene Model Compounds” […]
June 8th, 2023

Congratulations to Ismael on his paper in PCCP

Ismael’s first paper form the Brown group “Degenerate and non-degenerate two-photon absorption of coumarin dyes” is accepted into PCCP.
April 12th, 2023

Shyam’s paper accepted into J. Phys. Chem. C

Congratulations to Shyam on his first author paper ” “Revealing Silica’s pH-Dependent Second Harmonic Generation Response with Overcharging” being accepted […]
October 27th, 2022

Congratulations to Minh on collaborative paper with the Sang group being accepted into ACS – AMI

Minh’s work computing Raman spectra for various possible SbxSy complexes is part of a collaborative paper spearheaded by the Sang […]