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Niccolò Ricardi
Niccolò Ricardi
Zweryfikowany adres z unige.ch
Tytuł
Cytowane przez
Cytowane przez
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Benchmark of excitation energy shifts from frozen-density embedding theory: introduction of a density-overlap-based applicability threshold
A Zech, N Ricardi, S Prager, A Dreuw, TA Wesolowski
Journal of Chemical Theory and Computation 14 (8), 4028-4040, 2018
172018
Explicit vs. implicit electronic polarisation of environment of an embedded chromophore in frozen-density embedding theory
N Ricardi, A Zech, Y Gimbal-Zofka, TA Wesolowski
Physical Chemistry Chemical Physics 20 (41), 26053-26062, 2018
132018
Frontiers in multiscale modeling of photoreceptor proteins
MA Mroginski, S Adam, GS Amoyal, A Barnoy, AN Bondar, VA Borin, ...
Photochemistry and Photobiology 97 (2), 243-269, 2021
112021
The deconvolution analysis of ATR-FTIR spectra of diacetylene during UV exposure
RD Ortuso, N Ricardi, T Bürgi, TA Wesolowski, K Sugihara
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 219, 23-32, 2019
102019
Embedding-theory-based simulations using experimental electron densities for the environment
N Ricardi, M Ernst, P Macchi, TA Wesolowski
Acta Crystallographica Section A: Foundations and Advances 76 (5), 571-579, 2020
42020
Embedding non-rigid solutes in an averaged environment: a case study on rhodopsins
N Ricardi, CE González-Espinoza, S Adam, J Church, I Schapiro, ...
32021
N-representability of the target density in Frozen-Density Embedding Theory based methods: Numerical significance and its relation to electronic polarization
N Ricardi, CE González-Espinoza, TA Wesołowski
The Journal of Chemical Physics 157 (6), 064108, 2022
2022
The significance of negativity of the target density in Frozen-Density Embedding Theory based simulations
N Ricardi, CE González-Espinoza, TA Wesołowski
2022
Approximations in Modelling the Environment in Frozen Density Embedding Theory and Their Effect on the Results
N Ricardi
University of Geneva, 2022
2022
Frozen-Density Embedding Theory based simulations with experimental electron densities
N Ricardi, M Ernst, P Macchi, TA Wesolowski
arXiv preprint arXiv:2005.13409, 2020
2020
Frozen-Density Embedding Theory based simulations using experimental electron densities for the environment
N Ricardi, M Ernst, P Macchi, TA Wesolowski
2020
Benchmark of excitation energy shifts from frozen-density embedding theory
A Zech, N Ricardi, S Prager, A Dreuw, TA Wesolowski
2018
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