| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A density functional theory study of the oxidation of methanol to formaldehyde over vanadia supported on silica, titania and zirconia
|
Zhanpeisov, N. U.
|
|
2004
|
30 |
1 |
p. 133-141
|
artikel
|
| 2 |
Adsorption of NO, NH3 and H2O on V2O5/TiO2 catalysts
|
Bredow, Thomas
|
|
2004
|
30 |
1 |
p. 65-73
|
artikel
|
| 3 |
Closed and open-shell atomic oxygen on silver: two distinct patterns of the O1s binding energy and X-ray absorption O K-edge spectra as revealed by density functional theory
|
Ruzankin, Sergei
|
|
2004
|
30 |
1 |
p. 75-85
|
artikel
|
| 4 |
Comparative energies of Zn(II) cation localization as a function of the distance between two forming cation position aluminium ions in high-silica zeolites
|
Kachurovskaya, Nelly
|
|
2004
|
30 |
1 |
p. 99-103
|
artikel
|
| 5 |
Estimates of magnetic resonance parameters in semi-empirical quantum chemistry
|
Chuvylkin, N. D.
|
|
2004
|
30 |
1 |
p. 105-120
|
artikel
|
| 6 |
Exchange kernel of density functional response theory from the common energy denominator approximation (CEDA) for the Kohn–Sham Green's function
|
Gritsenko, O. V.
|
|
2004
|
30 |
1 |
p. 87-98
|
artikel
|
| 7 |
Intrinsic band gap in semiconductor oxides and Ti-silicalite: ab initio and DFT study
|
Zhanpeisov, N. U.
|
|
2004
|
30 |
1 |
p. 121-132
|
artikel
|
| 8 |
List of publications of Professor G. M. Zhidomirov
|
|
|
2004
|
30 |
1 |
p. 5-39
|
artikel
|
| 9 |
Models of finely dispersed MgO and V2O5 on silica. Theoretical analysis of optical properties using TDDFT
|
Avdeev, Vasilii
|
|
2004
|
30 |
1 |
p. 41-64
|
artikel
|
| 10 |
Preface
|
Zilberberg, Igor
|
|
2004
|
30 |
1 |
p. 1-4
|
artikel
|
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