Items where Author is "Pápai, Mátyás Imre"

Article

Naumova, M.A. and Paveliuc, G. and Biednov, M. and Kubicek, K. and Kalinko, A. and Meng, J. and Liang, M. and Rahaman, A. and Abdellah, M. and Checchia, S. and Alves, Lima F. and Zalden, P. and Gawelda, W. and Bressler, C. and Geng, H. and Lin, W. and Liu, Y. and Zhao, Q. and Pan, Q. and Akter, M. and Kong, Q. and Retegan, M. and Gosztola, D.J. and Pápai, Mátyás Imre and Khakhulin, D. and Daku, M.L. and Zheng, K. and Canton, S.E. (2024) Nonadiabatic Charge Transfer within Photoexcited Nickel Porphyrins. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 15 (13). pp. 3627-3638. ISSN 1948-7185

Pápai, Mátyás Imre and Rozgonyi, Tamás and Vankó, György (2023) Ultrafast 3MLCT quenching and vibrational coherence : excited-state dynamics of the first-discovered Fe(II)-carbene sensitiser resolved. JOURNAL OF MATERIALS CHEMISTRY A, 11 (47). pp. 25955-25962. ISSN 2050-7488

Schnack-Petersen, Anna Kristina and Pápai, Mátyás Imre and Coriani, Sonia and Møller, Klaus Braagaard (2023) A theoretical study of the time-resolved x-ray absorption spectrum of the photoionized BT-1T cation. STRUCTURAL DYNAMICS, 10 (3). No-034102. ISSN 2329-7778

Schnack-Petersen, Anna Kristina and Pápai, Mátyás Imre and Møller, Klaus Braagaard (2022) Azobenzene photoisomerization dynamics: Revealing the key degrees of freedom and the long timescale of the trans-to-cis process. JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 428. ISSN 1010-6030

Zulfikri, Habiburrahman and Pápai, Mátyás Imre and Dohn Asmus, Ougaard (2022) Simulating the solvation structure of low- and high-spin [Fe(bpy)(3)](2+): long-range dispersion and many-body effects. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 24 (27). pp. 16655-16670. ISSN 1463-9076

Béres, Kende Attila and Homonnay, Zoltán and Kvitek, Libor and Dürvanger, Zsolt and Kubikova, Martina and Harmat, Veronika and Szilágyi, Fanni and Czégény, Zsuzsanna and Németh, Péter and Bereczki, Laura and Petrusevski, Vladimir M. and Pápai, Mátyás Imre and Farkas, Attila and Kótai, László (2022) Thermally Induced Solid-Phase Quasi-Intramolecular Redox Reactions of [Hexakis(urea-O)iron(III)] Permanganate: An Easy Reaction Route to Prepare Potential (Fe,Mn)O x Catalysts for CO2 Hydrogenation. INORGANIC CHEMISTRY, 61 (36). pp. 14403-14418. ISSN 0020-1669

Pápai, Mátyás Imre (2022) Toward Simulation of Fe(II) Low-Spin - High-Spin Photoswitching by Synergistic Spin-Vibronic Dynamics. JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 18 (3). pp. 1329-1339. ISSN 1549-9618

Pápai, Mátyás Imre (2021) Photoinduced Low-Spin → High-Spin Mechanism of an Octahedral Fe(II) Complex Revealed by Synergistic Spin-Vibronic Dynamics. INORGANIC CHEMISTRY, 60 (18). pp. 13950-13954. ISSN 0020-1669

Pápai, Mátyás Imre and Xusong, Li and Nielsen, Martin M. and Mølller, Klaus B. (2021) Trajectory surface-hopping photoinduced dynamics from Rydberg states of trimethylamine. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 23. pp. 10964-10977. ISSN 1463-9076

March, A. M. and Assefa, T. A. and Boemer, Ch. and Bressler, Ch. and Britz, A. and Németh, Zoltán and Pápai, Mátyás Imre and Vankó, György (2017) Probing Transient Valence Orbital Changes with Picosecond Valence-to-Core X-ray Emission Spectroscopy. JOURNAL OF PHYSICAL CHEMISTRY C, 121 (5). pp. 2620-2626. ISSN 1932-7447

Biasin, E. and van Driel, T. B. and Kjær, K. S. and Dohn, A. O. and Christensen, M. and Pápai, Mátyás Imre and Németh, Zoltán and Vankó, György (2016) Femtosecond X-Ray Scattering Study of Ultrafast Photoinduced Structural Dynamics in Solvated [Co(terpy)2]2+. PHYSICAL REVIEW LETTERS, 117 (1). ISSN 0031-9007

Pápai, Mátyás Imre and Vankó, György and Rozgonyi, Tamás and Penfold, T. J. (2016) High-Efficiency Iron Photosensitizer Explained with Quantum Wavepacket Dynamics. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 7. pp. 2009-2014. ISSN 1948-7185

Penfold, T. J. and Pápai, Mátyás Imre and Rozgonyi, Tamás and Moller, K. B. and Vankó, György (2016) Probing Spin-Vibronic Dynamics Using Femtosecond X-ray Spectroscopy. FARADAY DISCUSSIONS, 2016 (194). pp. 731-746. ISSN 1359-6640

Vankó, György and Bordage, Amelie and Pápai, Mátyás Imre and Haldrup, K. and Glatzel, P. and Németh, Zoltán and Rozsályi, Emese Tünde and Rozgonyi, Tamás (2015) Detailed Characterization of a Nanosecond-lived Excited State: X-Ray and Theoretical Investigation of the Quintet State in Photoexcited [Fe(terpy)2]2+. JOURNAL OF PHYSICAL CHEMISTRY C, 119. pp. 5888-5902. ISSN 1932-7447

March, A. M. and Assefa, T. A. and Bressler, C. and Doumy, G. and Galler, A. and Németh, Zoltán and Pápai, Mátyás Imre and Vankó, György (2015) Feasibility of Valence-to-Core X-ray Emission Spectroscopy for Tracking Transient Species. JOURNAL OF PHYSICAL CHEMISTRY C, 119 (26). pp. 14571-14578. ISSN 1932-7447

Canton, S. E. and Kjær, K. S. and Vankó, György and van Driel, T. B. and Adachi, S. and Bordage, Amelie and Németh, Zoltán and Pápai, Mátyás Imre (2015) Visualizing the Nonequilibrium Dynamics of Photoinduced Intramolecular Electron Transfer with Femtosecond X-ray Pulses. NATURE COMMUNICATIONS, 6. p. 6359. ISSN 2041-1723