Ustynyuk Leila Yur'evna

Publications in Math-Net.Ru

1. DFT modeling of the carbon dioxide and alkene oxide reaction catalyzed by a Cr^III complex
   
   Mendeleev Commun., 33:5 (2023),  611–613
2. DFT modeling of active particles with one and two Mg atoms in post-titanocene catalytic systems for ethylene polymerization
   
   Mendeleev Commun., 28:6 (2018),  648–650
3. DFT modeling of the first step of plastoquinol oxidation by the iron–sulfur protein of the cytochrome b₆f complex
   
   Mendeleev Commun., 28:2 (2018),  170–172
4. Ti–C bond formation reactions in post-titanocene catalytic systems for alkene polymerization: a DFT study
   
   Mendeleev Commun., 26:6 (2016),  488–490
5. Magnesium dichloride effect in ethylene polymerization reactions: a comparative DFT study of Mg-containing and Mg-free post-titanocene catalytic systems
   
   Mendeleev Commun., 26:1 (2016),  45–48
6. DFT modeling of the effect of magnesium dichloride on the catalytic activity of post-titanocene complexes in ethylene polymerization
   
   Mendeleev Commun., 25:1 (2015),  24–26
7. DFT study of new binuclear zirconium(IV) hydride complexes as prospective catalysts for alkane hydrogenolysis under mild conditions
   
   Mendeleev Commun., 20:6 (2010),  337–339
8. DFT study of the activation of dimethylzirconocenes by aluminium-containing activators
   
   Mendeleev Commun., 20:5 (2010),  266–268
9. DFT study of dimethylzirconocene activation by one or two Al(C₆F₅)₃ molecules, formation of ion pairs and their reactions with ethylene
   
   Mendeleev Commun., 19:4 (2009),  182–184
10. Isotropic hyperfine splitting in the nitroxide radicals 4-amino-2,2,5,5-tetramethyl-3-imidazoline-N-oxyl and 4-amino-2,2,6,6-tetramethylpiperidine-N-oxyl
    
    Mendeleev Commun., 14:5 (2004),  195–197
11. A theoretical DFT study of the mechanism of C–C bond hydrogenolysis in alkanes on silica-supported zirconium hydrides
    
    Mendeleev Commun., 12:5 (2002),  173–175