Theoretical chemist with research interests in spatial confinement phenomena and nonlinear optics. Marta Chołuj graduated from Wroclaw University of Science and Technology (WUST) where she received B.Sc. degree in Mathematics (2013) and Chemistry (2014) and M.Sc. degree in Chemistry (2014). In 2018 she obtained Ph.D. in Chemistry from WUST under the supervision of Prof. Wojciech Bartkowiak.
Papers
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Chołuj, M.; Kozłowska, J.; Bartkowiak, W. Benchmarking DFT methods on linear and nonlinear electric properties of spatially confined molecules. Int. J. Quantum Chem. 2018, 118 (17), e25666. https://doi.org/10.1002/qua.25666.
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Justyniarski, A.; Zaręba, J. K.; Hańczyc, P.; Fita, P.; Chołuj, M.; Zaleśny, R.; Samoć, M. Utilizing formation of dye aggregates with aggregation-induced emission characteristics for enhancement of two-photon absorption. J. Mater. Chem. C 2018, 6 (16), 4384–4388. https://doi.org/10.1039/C7TC05509A.
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Zaleśny, R.; Chołuj, M.; Kozłowska, J.; Bartkowiak, W.; Luis, J. M. Vibrational nonlinear optical properties of spatially confined weakly bound complexes. Phys. Chem. Chem. Phys. 2017, 19 (35), 24276–24283. https://doi.org/10.1039/C7CP04259K.
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Chołuj, M.; Bartkowiak, W.; Naciążek, P.; Strasburger, K. On the calculations of the static electronic dipole (hyper)polarizability for the free and spatially confined H−. J. Chem. Phys. 2017, 146 (19), 194301. https://doi.org/10.1063/1.4983064.
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Kozłowska, J.; Chołuj, M.; Zaleśny, R.; Bartkowiak, W. Two-photon absorption of the spatially confined LiH molecule. Phys. Chem. Chem. Phys. 2017, 19 (11), 7568–7575. https://doi.org/10.1039/C6CP07368A.
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Chołuj, M.; Bartkowiak, W. Ground-state dipole moment of the spatially confined carbon monoxide and boron fluoride molecules. Chem. Phys. Lett. 2016, 663, 84–89. https://doi.org/10.1016/j.cplett.2016.09.072.
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Chołuj, M.; Kozłowska, J.; Roztoczyńska, A.; Bartkowiak, W. On the directional character of orbital compression: A model study of the electric properties of LiH–(He)n complexes. Chem. Phys. 2015, 459, 24–30. https://doi.org/10.1016/j.chemphys.2015.07.022.
