Correlated Electron-Nuclear Dynamics: A novel mixed quantum-semiclassical approach (CoEND)
Marie CurieStatus: ongoing project
The experienced researcher, Dr. Ali Abedi, and the host supervisor, Prof. Angel Rubio, aim at developing a new predictive and practical approach that overcomes the difficulties that current methods have to treat the correlated electron-nuclear dynamics in systems such as light-harvesting complexes. The proposed project starts with the fundamental method development based on the “exact factorization framework” recently introduced by the researcher, goes through a systematic performance test to reach the desired accuracy/efficiency trade-off, and will be implemented in a computational platform to be applied to study large systems such as artificial light-harvesting complexes.
Research Executive Agency (REA)EUROPEAN COMMISSION
UNIVERSIDAD DEL PAIS VASCO (UPV/EHU)
Dr. Ali Abedi