Joanna Bednarska
Bartkowiak Group, Graduate Students
| Email: | joanna.bednarska@pwr.edu.pl |
| Office: | A-3 / 328b |
| Phone: | +48 71 320 4577 |
| Office hours: | Wed. 11-13 |
Theoretical chemist with research interests in the simulations of one- and two-photon absorption spectra for molecules in solutions. Joanna Bednarska graduated from Wroclaw University of Science and Technology (WUST) where she obtained B.Sc. degrees in Chemistry in 2013 and in Technology of Chemistry in 2014. In 2014 she obtained M.Sc. degree in Bioinformatics. Since 2014 she is a Ph.D. student at the WUST Faculty of Chemistry. Her scientific advisors are Prof. Wojciech Bartkowiak and Dr. Robert Zaleśny.
Papers
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Beerepoot, M. T. P.; Alam, Md. M.; Bednarska, J.; Bartkowiak, W.; Ruud, K.; Zaleśny, R. Benchmarking the Performance of Exchange-Correlation Functionals for Predicting Two-Photon Absorption Strengths. J. Chem. Theory Comput. 2018, 14 (7), 3677–3685.
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Bednarska, J.; Zaleśny, R.; Tian, G.; Murugan, N. A.; Ågren, H.; Bartkowiak, W. Nonempirical Simulations of Inhomogeneous Broadening of Electronic Transitions in Solution: Predicting Band Shapes in One- and Two-Photon Absorption Spectra of Chalcones. Molecules 2017, 22 (10), 1643. https://doi.org/10.3390/molecules22101643.
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Bednarska, J.; Zaleśny, R.; Bartkowiak, W.; Ośmiałowski, B.; Medved', M.; Jacquemin, D. Quantifying the Performances of DFT for Predicting Vibrationally Resolved Optical Spectra: Asymmetric Fluoroborate Dyes as Working Examples. J. Chem. Theory Comput. 2017, 13 (9), 4347–4356. https://doi.org/10.1021/acs.jctc.7b00469.
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Bednarska, J.; Zaleśny, R.; Wielgus, M.; Jędrzejewska, B.; Puttreddy, R.; Rissanen, K.; Bartkowiak, W.; Ågren, H.; Ośmiałowski, B. Two-photon absorption of BF2-carrying compounds: insights from theory and experiment. Phys. Chem. Chem. Phys. 2017, 19 (8), 5705–5708. https://doi.org/10.1039/C7CP00063D.
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Bednarska, J.; Zaleśny, R.; Arul Murugan, N.; Bartkowiak, W.; Ågren, H.; Odelius, M. Elucidating the Mechanism of Zn(2+) Sensing by a Bipyridine Probe Based on Two-Photon Absorption. J. Phys. Chem. B 2016, 120 (34), 9067–9075. https://doi.org/10.1021/acs.jpcb.6b04949.
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Matczyszyn, K.; Olesiak-Banska, J.; Nakatani, K.; Yu, P.; Murugan, N. A.; Zaleśny, R.; Roztoczyńska, A.; Bednarska, J.; Bartkowiak, W.; Kongsted, J.; Ågren, H.; Samoć, M. One- and Two-Photon Absorption of a Spiropyran–Merocyanine System: Experimental and Theoretical Studies. J. Phys. Chem. B 2015, 119 (4), 1515–1522. https://doi.org/10.1021/jp5071715.
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Bednarska, J.; Roztoczyńska, A.; Bartkowiak, W.; Zaleśny, R. Comparative assessment of density functionals for excited-state dipole moments. Chem. Phys. Lett. 2013, 584, 58–62. https://doi.org/10.1016/j.cplett.2013.08.079.
