List

Ismael and Macarena (former UARE intern) contribute computations on one-photon absorption and emission for a series of symmetrical and unsymmetrical Cy3 dyes synthesized and characterized by the Usama group (University of Texas – San Antonio). The paper has been accepted in Journal of Organic Chemistry.

  Category: HQP Achievements

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March 24th, 2026

A collaborative paper with the Usama (UTSA) group is accepted into JOC

Ismael and Macarena (former UARE intern) contribute computations on one-photon absorption and emission for a series of symmetrical and unsymmetrical […]

March 24th, 2026

A collaborative paper with the Lundgren group is accepted into ACS Catalysis

Ismael contributes some useful DFT computations to a paper lead out of the Lundgren group (Ualberta) “Cobalt/Photoredox-Catalyzed, Phosphine-Mediated Carbon Isotope […]

March 24th, 2026

Congratulations to Abdullah on successful completion of his CHEM502

Abdullah presents an interesting CHEM 502 seminar entitled “DFT Study of Silicate and Aluminate Dissolution in the Metakaolin-Based Geopolymerization.” Based […]

February 11th, 2026

Congratulations to Ashton on successfully completing his CHEM 502

Ashton presents an interesting CHEM 502 seminar entitled “Computational Prediction and Interpretation of Biological Iron-Sulfur Cluster Reduction Potentials.” All goes […]

December 11th, 2025

Congratulations to Dr. Johannson!

Congratulations to Ryan who successfully defended his PhD thesis ‘Investigations into Environmental Effects on the Photophysical Properties of Fluorescent Chromophores.” […]

November 21st, 2025

Congratulations to Ashton on receiving an AGES scholarship

Ashton receives an Alberta Graduate Excellence Scholarship for 2026! Congratulations Ashton!

November 21st, 2025

Another paper with Ismael accepted into J.Phys. Chem. A

Ismael has another paper “Influence of Electron-Donating and Electron-Withdrawing Groups on One- and Two-Photon Absorption Properties on Modified Adenine and […]

November 21st, 2025

Paper with Rodrigo and Nathanael in collaboration with Mariusz Klobukowski and Rod Bartlett accepted in JCP

A paper with Rodrigo and Nathanael, in collaboration with Mariusz Klobukowski (Alberta) and Rod Bartlett (Florida), entitled “cQTP25: A New […]

November 21st, 2025

Congratulations to Ashton on his first paper!

Ashton, in collaboration with Ismael, has his first paper “Beyond TD-DFT: Assessing the Bethe–Salpeter Equation within the GW Approximation for […]

October 8th, 2025

Ismael and Ashton attend summer schools.

Ismael and Ashton attended two different summer schools in Europe Sept. 29-Oct.3 (but met at the airport on their departure […]