Giuseppe Mallia

8PUBLICATIONS
21CO-AUTHORS
Theoretical quantum chemistryElemental semiconductorsOptical properties of materialsChemical thermodynamics and energeticsNonlinear optics and spectroscopy
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Publications (8)

|Oct 01, 2025
Influences of Basis Set and Electronic Exchange-Correlation on Low-Frequency Vibrations and Stability of Paracetamol Polymorphs.

Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison

|Aug 26, 2025
Probing defect formation in sulfur-annealed graphene for TMDC integration.

Ahmad Nizamuddin Muhammad Mustafa, Victoria Greenacre, Huanyu Zhou

|Jun 25, 2025
The quantum origin of magnetic coupling in molecular crystals for spintronics.

James Broadhurst, Giuseppe Mallia, Nicholas Harrison

|May 14, 2025
Ab initio simulation of molecular crystal regrowth of paracetamol from solution.

Huanyu Zhou, Giuseppe Mallia, Nicholas M Harrison

|Sep 16, 2024
A prediction of high temperature magnetic coupling in transition metal phthalocyanines.

James Broadhurst, Giuseppe Mallia, Nicholas Harrison

|Mar 20, 2023
Paramagnetic States in Oxygen-Doped Boron Nitride Extend Light Harvesting and Photochemistry to the Deep Visible Region.

Elan D R Mistry, Daphné Lubert-Perquel, Irena Nevjestic

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Frequent Collaborators

8 joint publications

Nicholas M Harrison

4 joint publications

Huanyu Zhou

2 joint publications

James Broadhurst

1 joint publications

Aleksandar Živković