Katarzyna Pernal

prof. dr hab. inż. Katarzyna Pernal

M. Hapka, E. Pastorczak, K. Pernal, Self-Adapting Short-Range Correlation Functional for Complete Active Space-Based Approximations, J. Phys. Chem. A 128(33), 7013-7022, 2024

10.1021/acs.jpca.4c03299
D. Drwal, K. Pernal, E. Pastorczak, Multireference Correlated Oscillator Strengths from Adiabatic Connection Approaches Based on Extended Random Phase Approximation, J. Chem. Theory Comput. 20(9), 3659-3668, 2024

10.1021/acs.jctc.4c00103
M. Matoušek, K. Pernal, F. Pavošević, L. Veis, Variational Quantum Eigensolver Boosted by Adiabatic Connection, J. Phys. Chem. A 128(3), 687-698, 2024

10.1021/acs.jpca.3c07590
R. Zuzak, M. Kumar, O. Stoica, D. Soler‐Polo, J. Brabec, K. Pernal, L. Veis, R. Blieck, A. M. Echavarren, P. Jelínek, S. Godlewski, On‐Surface Synthesis and Determination of the Open‐Shell Singlet Ground State of Tridecacene, Angew. Chem. Int. Ed., 2024

10.1002/anie.202317091
Y. Guo, K. Pernal, Spinless formulation of linearized adiabatic connection approximation and its comparison with the second order N-electron valence state perturbation theory, Faraday Discuss., 2024

10.1039/D4FD00054D

pokój nr 3.10 (nowy budynek)
poniedziałek 9:15-10:00
czwartek 10:15-11:00