화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Electronic Structure and Reactivity of Cobalt Oxide Dimers and Their Hexacarbonyl Complexes: A Density Functional Study
Uzunova EL, Mikosch H
Journal of Physical Chemistry A, 116(12), 3295, 2012
2 Electronic Structure of Trioxide, Oxoperoxide, Oxosuperoxide, and Ozonide Clusters of the 3d Elements: Density Functional Theory Study
Uzunova EL
Journal of Physical Chemistry A, 115(8), 1320, 2011
3 Density Functional Study of the Stable Oxidation States and the Binding of Oxygen in MO4 Clusters of the 3d Elements
Uzunova EL
Journal of Physical Chemistry A, 115(39), 10665, 2011
4 Intersystem Crossings of the Triplet and Singlet States in Cobalt and Copper Mononitrosyls
Uzunova EL
Journal of Physical Chemistry A, 113(42), 11266, 2009
5 Interaction of molecular nitrogen and oxygen with extraframework cations in zeolites with double six-membered rings of oxygen-bridged silicon and aluminum atoms: A DFT study
Mikosch H, Uzunova EL, St Nikolov G
Journal of Physical Chemistry B, 109(22), 11119, 2005
6 Electronic structure and stability of double six-membered rings of oxygen-bridged silicon and aluminum atoms related to cation site occupancy in FAU zeolites: a DFT study
Uzunova EL, Mikosch H
Journal of Physical Chemistry B, 108(22), 6981, 2004
7 Vibrational modes of double six-member rings of oxygen-bridged silicon and aluminum atoms in zeolites: A DFT study
Mikosch H, Uzunova EL, Nikolov GS
Journal of Physical Chemistry B, 108(35), 13200, 2004
8 Cation-deficient nano-dimensional particle size cobalt-manganese spinel mixed oxides
Klissurski DG, Uzunova EL
Applied Surface Science, 214(1-4), 370, 2003
9 Electronic structure and vibrational modes of cobalt oxide clusters CoOn (n=1-4) and their monoanions
Uzunova EL, St Nikolov G, Mikosch H
Journal of Physical Chemistry A, 106(16), 4104, 2002
10 DFT study of zeolite LTA structural fragments: Double four-member rings of oxygen-bridged silicon and aluminum atoms
Uzunova EL, Nikolov GS
Journal of Physical Chemistry A, 104(22), 5302, 2000