34 citations
- Synopsys (United States)US5 papers
- Barcelona Supercomputing CenterES1 paper
- CEA DAM Île-de-FranceFR1 paper
- CEA GrenobleFR1 paper
- CEA Paris-SaclayFR1 paper
- Centro de Tecnologia MineralBR1 paper
- Chengdu Organic Chemicals (China)CN1 paper
- CIC nanoGUNEES1 paper
- Commissariat à l'Énergie Atomique et aux Énergies AlternativesFR1 paper
- Communication University of ZhejiangCN1 paper
- Daresbury LaboratoryGB1 paper
- Duke UniversityUS1 paper
Showing cond-mat.mtrl-sciShow all
2 papers · 1 filter
cond-mat.mtrl-sci2025★ 2 cited
On Simulating Thin-Film Processes at the Atomic Scale Using Machine Learned Force Fields
S. Kondati Natarajan, J. Schneider, N. Pandey +2
Atomistic modeling of thin-film processes provides an avenue not only for discovering key chemical mechanisms of the processes but also to extract quantitative metrics on the event…
cond-mat.mtrl-sci2020★ 34 cited
The CECAM Electronic Structure Library and the modular software development paradigm
Micael J. T. Oliveira, Nick Papior, Yann Pouillon +34
First-principles electronic structure calculations are very widely used thanks to the many successful software packages available. Their traditional coding paradigm is monolithic,…