Jan Wilhelm
- CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
2020/05/19 by Thomas D. Kühne, Marcella Iannuzzi, Mauro Del Ben +36 · 69 citations
Engineering · Physics and Astronomy · #Advanced Chemical Physics Studies #Molecular Junctions and Nanostructures #Spectroscopy and Quantum Chemical Studies
- Roadmap on Advancements of the FHI-aims Software Package
2025/04/30 by Joseph W. Abbott, Abbott, Joseph W., Carlos Mera Acosta +405 · 3 voices · 6 citations
#cond-mat.mtrl-sci #physics.chem-ph
- Solving multi-pole challenges in the GW100 benchmark enables precise low-scaling GW calculations
2024/05/30 by Mia Schambeck, Dorothea Golze, Schambeck, Mia +3 · 2 citations
Engineering · Physics and Astronomy · #Particle accelerators and beam dynamics #Magnetic confinement fusion research #Particle Accelerators and Free-Electron Lasers
- Molecular Transport
2024/11/03 by María Camarasa-Gómez, María Camarasa‐Gómez, Camarasa-Gómez, María +10 · 1 voice · 1 citation
Chemistry · Physics and Astronomy · #Chemical Physics (physics.chem-ph) #FOS: Physical sciences #Ferrocene Chemistry and Applications #Mesoscale and Nanoscale Physics (cond-mat.mes-hall) #cond-mat.mes-hall #physics.chem-ph
- The CP2K Program Package Made Simple
2025/08/21 by Marcella Iannuzzi, Iannuzzi, Marcella, Jan Wilhelm +56 · 1 voice · 3 citations
Chemistry · Materials Science · Physics and Astronomy · #Computational Physics (physics.comp-ph) #Disordered Systems and Neural Networks (cond-mat.dis-nn) #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Soft Condensed Matter (cond-mat.soft) #Statistical Mechanics (cond-mat.stat-mech) #cond-mat.dis-nn #cond-mat.mtrl-sci #cond-mat.soft #cond-mat.stat-mech #physics.comp-ph
- CP2K: An electronic structure and molecular dynamics software package - Dynamics, Transport, and Spectroscopic Response
2026/07/24 by Jan Wilhelm, Anna Hehn, Hossam Elgabarty +39
#physics.chem-ph #cond-mat.dis-nn #cond-mat.mtrl-sci #cond-mat.stat-mech #physics.comp-ph