Alex, Ismael, and Shyam traveled to Calgary to attend and present at the 105th Canadian Chemistry Conference and Exhibition: Diversity and Innovation in Chemistry (CCCE2022)  June 13-17, 2022. Alex co-organizes (with Stijn De Baerdemacker, University of New Brunswick and Joshua Hollett, University of Winnipeg) a symposium “Advances in Theoretical and Computational Chemistry (Quantum Chemistry)” and contributes a talk “Adaptive Fitting of Potential Energy Surfaces of Small to Medium-Sized Molecules in Sum-of-Product Form: Application to Vibrational Spectroscopy.” Shyam gives a talk “Uncovering Inter- and Intramolecular Coupling at the Silica/Water Interface” as well as presents a poster “Influence of the Excitation Wavelength on the Computation of First Order Hyperpolarizabilities using Optimally Gap Tuned Range Separated Hybrid Functionals.” Ismael gives a talk “A Quantum-Chemical Study of Degenerate and Non-Degenerate Two-Photon Absorption of Coumarin Dyes.” Check out Ismael speaking below:


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May 9th, 2024

Congratulations to Minh on passing his Candidacy Exam.

Minh does an excellent job during his PhD candidacy exam. From UofA guidelines “The candidacy examination determines whether the student […]

May 1st, 2024

Glorious joints the group as an NSERC-USRA student.

Glorious Chieme, who worked in the group as part of CHEM 299 from Sept.-April, has joined the group for the […]

April 29th, 2024

Congratulations to Mack for receiving a FGPS Graduate Student Teaching Award

Congratulations to Mack for receiving a GSTA recognizing his excellent work TAing in CHEM 10X, i.e, first year chemistry. “The […]

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 […]

April 8th, 2024

Erik joins to group as a research intern

Erik Hansen joins to group (co-supervised with Professor Mariusz Klobukowski) as a visiting research intern from Aachen. Erik has received […]

March 20th, 2024

Congratulations to Ismael for receiving the GPS Graduate Student Elevation Award

Ismael receives the GPS Graduate Student Elevation Award.

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 […]

December 9th, 2023

Cuthbert successfully defends his MSc

Congratulations to Cuthbert (co-supervised with Prof. Mariusz Klobukowski) who successfully defended his MSc “Tackling the Charge Transfer Problem: A Guide […]

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 […]