Lars Goerigk

34PUBLICATIONS

45CO-AUTHORS

Computational chemistryOrganic semiconductorsTheoretical quantum chemistryCatalysis and mechanisms of reactionsMain group metal chemistry

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Publications (34)

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|Jun 16, 2026

The extended "family" of B97-based density functional approximations: a comprehensive overview for DFT users and developers.

|Aug 07, 2025

Planarisation or a twist? Using steric engineering to unlock the origin of mechanofluorochromic red-shifts.

Peter W McDonald, Lars Goerigk, Chris Ritchie

|Jul 02, 2025

Spin-scaled double hybrids with long-range correction solve the TD-DFT overestimation problem in BODIPY dyes: benchmarking and experimental validation.

Shebual Sebastian, Vaughan Riley, Binuki Wanniarachchi

|Feb 07, 2025

Showcasing physical chemistry research in Australia and New Zealand - a vital nexus of innovation and opportunity.

Sarah L Masters, Lars Goerigk

|Jan 06, 2025

Cobalt Complexes with Aminophenolate Ligands: Spin Crossover and Ligand Versatility.

I Haseena Ismail, Marcus J Giansiracusa, Robert W Gable

|Oct 16, 2024

Putting the squeeze on valence tautomerism in cobalt-dioxolene complexes.

Aston Summers, F Zahra M Zahir, Gemma F Turner

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Frequent Collaborators

Chris Ritchie

Marcos Casanova-Páez

Colette Boskovic

Asim Najibi

Dominique A Wappett

Amy C Hancock

Robert W Gable

Dale R Lonsdale

F Zahra M Zahir

Jonathan M White

Frequent Collaborators

Chris Ritchie

Marcos Casanova-Páez

Colette Boskovic

Asim Najibi