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physics.chem-ph2023
Machine learning regression analyses of intensity modulation two-photon spectroscopy (Mlim) in perovskite microcrystals
Qi Shi, Tönu Pullerits
Perovskite thin films hold great promise for optoelectronic applications, such as solar cells and light emitting diodes. A challenge is that defects are unavoidably formed in the m…
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-ph2014
Relaxation and fluctuation dynamics in coherent two-dimensional electronic spectra
Joachim Seibt, Tonu Pullerits
Two-dimensional (2D) spectroscopy provides information about dissipative processes subsequent to electronic excitation, which play a functional role in energy harvesting materials…