2 papers
quant-ph2026
Scientific applications of quantum computing: challenges and opportunities
Bruno Camino, C. Richard A. Catlow, John Buckeridge +13
The predictive simulation of molecules and materials has had a broad and significant impact. It nevertheless remains constrained by the cost of accurately treating electronic corre…
cond-mat.mtrl-sci2024
Modelling Silica using MACE-MP-0 Machine Learnt Interatomic Potentials
Jamal Abdul Nasir, Jingcheng Guan, Woongkyu Jee +4
Silica polymorphs and zeolites are fundamental to a wide range of industrial applications owing to their diverse structural characteristics, thermodynamic and mechanical stability…