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Journal of Molecular Modeling|February 19, 2008
Applications of natural orbitals for chemical valence in a description of bonding in conjugated moleculesMariusz Mitoraj, Artur MichalakJournal of Molecular Modeling|October 7, 2006
Natural orbitals for chemical valence as descriptors of chemical bonding in transition metal complexesMariusz Mitoraj, Artur MichalakJournal of Molecular Modeling|May 5, 2005
DFT studies on isomerization reactions in the copolymerization of ethylene and methyl acrylate catalyzed by Ni-diimine and Pd-diimine complexesMariusz Mitoraj, Artur MichalakInternational Journal of Molecular Sciences|December 11, 2022
Nature of Beryllium, Magnesium, and Zinc Bonds in Carbene⋯MX2 (M = Be, Mg, Zn; X = H, Br) Dimers Revealed by the IQA, ETS-NOCV and LED MethodsFilip Sagan, Mariusz Mitoraj, Mirosław JabłońskiPhysical Chemistry Chemical Physics : PCCP|May 8, 2010
Electronic view on ethene adsorption in Cu(I) exchanged zeolitesPawel Rejmak, Mariusz Mitoraj, Ewa BroclawikThe Journal of Physical Chemistry. A|February 13, 2008
Bond orbitals from chemical valence theoryArtur Michalak, Mariusz Mitoraj, Tom ZieglerThe Journal of Organic Chemistry|November 18, 2006
1,3 Geminal interactions as the possible trend setting factors for C-H and C-C bond energies in alkanes. Support from a density functional theory based bond energy decomposition studyMariusz Mitoraj, Hungjuan Zhu, Artur Michalak, et al.Journal of Molecular Modeling|December 4, 2024
ETS-NOCV description of chemical bonding: from covalent bonds to non-covalent interactionsMercedes Kukułka, Olga Żurowska, Mariusz Mitoraj, et al.The Journal of Physical Chemistry. A|January 1, 2014
Physical nature of interactions in Zn(II) complexes with 2,2'-bipyridyl: quantum theory of atoms in molecules (QTAIM), interacting quantum atoms (IQA), noncovalent interactions (NCI), and extended transition state coupled with natural orbitals for chemical valence (ETS-NOCV) comparative studiesIgnacy Cukrowski, Jurgens H de Lange, Mariusz MitorajJournal of Pharmaceutical and Biomedical Analysis|May 14, 2015
Determination of acid dissociation constants of warfarin and hydroxywarfarins by capillary electrophoresisPaweł Nowak, Paulina Olechowska, Mariusz Mitoraj, et al.Pageof 3