| On-surface strain-driven synthesis of nonalternant non-benzenoid aromatic compounds containing four-to eight-membered rings B Mallada, B de la Torre, JI Mendieta-Moreno, D Nachtigallová, A Matěj, ... Journal of the American Chemical Society 143 (36), 14694-14702, 2021 | 48 | 2021 |
| Density matrix renormalization group with dynamical correlation via adiabatic connection P Beran, M Matoušek, M Hapka, K Pernal, L Veis Journal of Chemical Theory and Computation 17 (12), 7575-7585, 2021 | 35 | 2021 |
| Role of Spin Polarization and Dynamic Correlation in Singlet–Triplet Gap Inversion of Heptazine Derivatives D Drwal, M Matousek, P Golub, A Tucholska, M Hapka, J Brabec, L Veis, ... Journal of Chemical Theory and Computation 19 (21), 7606-7616, 2023 | 22 | 2023 |
| The effect of geometry, spin, and orbital optimization in achieving accurate, correlated results for iron–sulfur cubanes C Mejuto-Zaera, D Tzeli, D Williams-Young, NM Tubman, M Matousek, ... Journal of chemical theory and computation 18 (2), 687-702, 2022 | 19 | 2022 |
| Ground state of the Fe (ii)-porphyrin model system corresponds to quintet: a DFT and DMRG-based tailored CC study A Antalík, D Nachtigallová, R Lo, M Matoušek, J Lang, Ö Legeza, J Pittner, ... Physical Chemistry Chemical Physics 22 (30), 17033-17037, 2020 | 17 | 2020 |
| Toward more accurate adiabatic connection approach for multireference wavefunctions M Matoušek, M Hapka, L Veis, K Pernal The Journal of Chemical Physics 158 (5), 2023 | 12 | 2023 |
| Polaritonic chemistry using the density matrix renormalization group method M Matoušek, N Vu, N Govind, JJ Foley IV, L Veis Journal of Chemical Theory and Computation 20 (21), 9424-9434, 2024 | 6 | 2024 |
| Importance of Electron Correlation on the Geometry and Electronic Structure of [2Fe–2S] Systems: A Benchmark Study of the [Fe2S2 (SCH3) 4] 2–, 3–, 4–,[Fe2S2 (SCys) 4] 2–,[Fe2S2 … D Tzeli, P Golub, J Brabec, M Matoušek, K Pernal, L Veis, S Raugei, ... Journal of Chemical Theory and Computation 20 (23), 10406-10423, 2024 | 3 | 2024 |
| Variational quantum eigensolver boosted by adiabatic connection M Matoušek, K Pernal, F Pavošević, L Veis The Journal of Physical Chemistry A 128 (3), 687-698, 2024 | 3 | 2024 |
| Globally aromatic odd-electron π-magnetic macrocycle F Villalobos, J Berger, A Matěj, R Nieman, A Sánchez-Grande, D Soler, ... Chem 11 (2), 2025 | | 2025 |
| USING THE ADIABATIC CONNECTION METHOD TO IMPROVE DMRG RESULTS MM Matoušek Seminář studentů 2022, 2022 | | 2022 |
| On-surface mechanochemistry synthesis of non-alternant non-benzenoid aromatic compounds containing 4 to 8-membered rings B Mallada, B de la Torre, JI Mendieta-Moreno, D Nachtigalova, A Matej, ... | | 2020 |
| Výpočty elektronové struktury biologicky relevantních komplexů přechodných kovů M Matoušek Univerzita Karlova, Matematicko-fyzikální fakulta, 2020 | | 2020 |
| rsc. li/pccp V Luca, J Veliscek-Carolan, A Antalık, D Nachtigallová, R Lo, M Matoušek, ... Phys. Chem. Chem. Phys 22, 17015-17026, 2020 | | 2020 |
| Srážky elektronů s dvouatomovými molekulami M Matoušek Univerzita Karlova, Matematicko-fyzikální fakulta, 2018 | | 2018 |
| Computational details A Antalík, D Nachtigallová, R Lo, M Matoušek, J Lang, Ö Legeza, J Pittner, ... | | |
