Extended Hubbard model with renormalized Wannier wave functions in the correlated state III AP Kądzielawa, J Spałek, J Kurzyk, W Wójcik The European Physical Journal B 86 (6), 252, 2013 | 21 | 2013 |
and molecules with an ab initio optimization of wave functions in correlated state: electron–proton couplings and intermolecular microscopic parameters JS Andrzej P. Kądzielawa, Agata Bielas, Marcello Acquarone, Andrzej Biborski ... New Journal of Physics 16 (12), 123022, 2014 | 20 | 2014 |
MAELAS: MAgneto-ELAStic properties calculation via computational high-throughput approach P Nieves, S Arapan, SH Zhang, AP Kądzielawa, RF Zhang, D Legut Computer Physics Communications 264, 107964, 2021 | 13 | 2021 |
Dot-ring nanostructure: Rigorous analysis of many-electron effects A Biborski, AP Kądzielawa, A Gorczyca-Goraj, E Zipper, MM Maśka, ... Scientific Reports 6, 29887, 2016 | 13 | 2016 |
Combined shared and distributed memory ab-initio computations of molecular-hydrogen systems in the correlated state: process pool solution and two-level parallelism A Biborski, AP Kądzielawa, J Spałek Computer Physics Communications 197, 7-16, 2015 | 12 | 2015 |
Atomization of correlated molecular-hydrogen chain: A fully microscopic Variational Monte-Carlo solution A Biborski, AP Kądzielawa, J Spałek arXiv preprint arXiv:1803.04855, 2018 | 8 | 2018 |
Inhibition of steel corrosion with imidazolium-based compounds--experimental and theoretical study D Legut, AP Kądzielawa, P Pánek, K Marková, P Váňová, K Konečná, ... arXiv preprint arXiv:2102.02006, 2021 | 6 | 2021 |
Discontinuous transition of molecular-hydrogen chain to the quasi-atomic state: Exact diagonalization-ab initio approach AP Kądzielawa, A Biborski, J Spałek Phys. Rev. B 92, 161101(R), 2015 | 6 | 2015 |
MAELAS 2.0: A new version of a computer program for the calculation of magneto-elastic properties P Nieves, S Arapan, SH Zhang, AP Kądzielawa, RF Zhang, D Legut arXiv preprint arXiv:2106.03624, 2021 | 5 | 2021 |
MAELASviewer: An online tool to visualize magnetostriction P Nieves, S Arapan, AP Kądzielawa, D Legut Sensors 20 (22), 6436, 2020 | 4 | 2020 |
Metallization of solid molecular hydrogen in two dimensions: Mott-Hubbard-type transition A Biborski, AP Kądzielawa, J Spałek Physical Review B 96 (8), 085101, 2017 | 4 | 2017 |
Ultrafine-grained W-Cr composite prepared by controlled W-Cr solid solution decomposition J Veverka, F Lukáč, AP Kądzielawa, M Koller, Z Chlup, H Hadraba, ... Materials Letters 304, 130728, 2021 | 3 | 2021 |
Photoemission signature of momentum-dependent hybridization in R Kurleto, M Fidrysiak, L Nicolaď, J Minár, M Rosmus, A Tejeda, JE Rault, ... Physical Review B 104 (12), 125104, 2021 | 1 | 2021 |
Metallization of Atomic Solid Hydrogen within the Extended Hubbard Model with Renormalized Wannier Wave Functions AP Kądzielawa Acta Physica Polonica A 126, A-58, 2014 | 1 | 2014 |
vasprun Q Zhu, A Kądzielawa Kraków: Repozytorium Uniwersytetu Jagiellońskiego, 2020 | | 2020 |
PoVaB visualization suite A Kądzielawa Zenodo, 2020 | | 2020 |
JorGπ A Kądzielawa Zenodo, 2020 | | 2020 |
First-principle approach to electronic states and metal-insulator transition in selected correlated model systems A Kądzielawa | | 2015 |