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 TitleAuthors / EditorsDate
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Bimolecular photoinduced electron transfer in non-polar solvents beyond the diffusion limit Nancoz, Christoph; Rumble, Christopher Allen; Rosspeintner, Arnulf; Vauthey, Eric 2020
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Bimolecular photo-induced electron transfer enlightened by diffusion Angulo Nunez, Gonzalo Manuel; Rosspeintner, Arnulf 2020
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Extension of frozen-density embedding theory for non-variational embedded wavefunctions Zech, Alexander; Dreuw, Andreas; Wesolowski, Tomasz Adam 2019
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Magnetic field effect on ion pair dynamics upon bimolecular photoinduced electron transfer in solution Feskov, Serguei V.; Rogozina, Marina V.; Ivanov, Anatoly I.; Aster, Alexander; ... Vauthey, Eric 2019
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How good is the generalized Langevin equation to describe the dynamics of photo-induced electron transfer in fluid solution? Angulo, Gonzalo; Jedrak, Jakub; Ochab-Marcinek, Anna; Pasitsuparoad, Pakorn; ... Rosspeintner, Arnulf 2017
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A simple model of solvent-induced symmetry-breaking charge transfer in excited quadrupolar molecules Ivanov, Anatoly I.; Dereka, Bogdan; Vauthey, Eric 2017
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First time combination of frozen density embedding theory with the algebraic diagrammatic construction scheme for the polarization propagator of second order Prager, Stefan; Zech, Alexander; Aquilante, Francesco; Dreuw, Andreas; Wesolowski, Tomasz Adam 2016
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Orthogonality of embedded wave functions for different states in frozen-density embedding theory Zech, Alexander; Aquilante, Francesco; Wesolowski, Tomasz Adam 2015
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Measurements of dispersion forces between colloidal latex particles with the atomic force microscope and comparison with Lifshitz theory Elzbieciak-Wodka, Magdalena; Popescu, Mihail N.; Ruiz-Cabello, F. Javier Montes; Trefalt, Gregor; ... Borkovec, Michal 2014
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Embedding potentials for excited states of embedded species Wesolowski, Tomasz Adam 2014
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Atomic shell structure from the Single-Exponential Decay Detector De Silva, Piotr; Korchowiec, Jacek; Wesolowski, Tomasz Adam 2014
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Direct measurements of forces between different charged colloidal particles and their prediction by the theory of Derjaguin, Landau, Verwey, and Overbeek (DLVO) Montes Ruiz-Cabello, Francisco; Maroni, Plinio; Borkovec, Michal 2013
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Exact non-additive kinetic potentials in realistic chemical systems De Silva, Piotr; Wesolowski, Tomasz Adam 2012
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Chain stiffness, salt valency, and concentration influences on titration curves of polyelectrolytes: Monte Carlo simulations Carnal, Fabrice; Stoll, Serge 2011
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Adsorption of monovalent and divalent cations on planar water-silica interfaces studied by optical reflectivity and Monte Carlo simulations Porus, Maria; Labbez, Christophe; Maroni, Plinio; Borkovec, Michal 2011
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Resolution of strongly competitive product channels with optimal dynamic discrimination: Application to flavins Roslund, Jonathan; Roth, Matthias; Guyon, Laurent; Boutou, Véronique; ... Rabitz, Herschel 2011
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Modelling of HNO3-mediated laser-induced condensation: A parametric study Rohwetter, P.; Kasparian, Jérôme; Wöste, L.; Wolf, Jean-Pierre 2011
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Comment on “Accurate frozen-density embedding potentials as a first step towards a subsystem description of covalent bonds” [J. Chem. Phys. 132, 164101 (2010)] Wesolowski, Tomasz Adam 2011
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The generalized active space concept in multiconfigurational self-consistent field methods Ma, Dongxia; Li Manni, Giovanni; Gagliardi, Laura 2011
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Self-consistency in frozen-density embedding theory based calculations Aquilante, Francesco; Wesolowski, Tomasz Adam 2011
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