Expertises
Chemistry
- Excited State
- Electronic State
- Wave Function
- electronics
- Molecular Dynamics
- Photoisomerization
- Potential Energy Surface
Physics
- Diffusion Monte Carlo
Organisaties
Publicaties
2026
Machine-Learned Excited-State Dynamics with quantum Monte Carlo: Insights from Azomethane (2026)[Contribution to conference › Poster] NWO Physics 2026. Annarelli, A., Slootman, E. & Filippi, C.
2025
Machine-learning excited-state dynamics for photoactive systems... from first principles (2025)[Contribution to conference › Poster] MESA+ Day 2025. Annarelli, A., Poltavsky, I. & Filippi, C.Toward excited-state molecular dynamics at quantum Monte Carlo quality (2025)[Contribution to conference › Poster] 7th Psi-k Conference 2025. Annarelli, A., Poltavsky, I. & Filippi, C.Ab initio-machine learning framework for non-adiabatic dynamics Insights from azomethane photoisomerization (2025)[Contribution to conference › Poster] NEM Cluster Day 2025. Annarelli, A., Poltavsky, I. & Filippi, C.
2024
A brief introduction to the diffusion Monte Carlo method and the fixed-node approximation (2024)The Journal of chemical physics, 161(24). Article 241501. Annarelli, A., Alfè, D. & Zen, A.https://doi.org/10.1063/5.0232424
Onderzoeksprofielen
Adres
Universiteit Twente
Carré (gebouwnr. 15), kamer C4037
Hallenweg 23
7522 NH Enschede
Universiteit Twente
Carré C4037
Postbus 217
7500 AE Enschede
Scan de QR-code of