109 citations · 109 across the 2 of their papers we have counts for
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physics.chem-ph2016
Optimized long-range corrected density functionals for electronic and optical properties of bare and ligated CdSe quantum dots
O. S. Bokareva, M. F. Shibl, M. J. Al-Marri +2
The reliable prediction of optical and fundamental gaps of finite size systems using density functional theory requires to account for the potential self-interaction error, which i…
physics.chem-ph2016★ 109 cited
Multi-Layer Multi-Configuration Time-Dependent Hartree (ML-MCTDH) Approach to the Correlated Exciton-Vibrational Dynamics in the FMO Complex
Jan Schulze, Mohamed Shibl, Mohammed Al-Marri +1
The coupled quantum dynamics of excitonic and vibrational degrees of freedom is investigated for high-dimensional models of the Fenna-Matthews-Olson (FMO) complex. This includes a…