| 1 |
Heterogeneity of Bronsted acidic sites in faujasite type zeolites due to aluminum content and framework structure
Sierka M, Eichler U, Datka J, Sauer J
Journal of Physical Chemistry B, 102(33), 6397, 1998 |
| 2 |
Diversity of bonding in methyl ate anions of the first- and second-row elements
Cioslowski J, Piskorz P, Schimeczek M, Boche G
Journal of the American Chemical Society, 120(11), 2612, 1998 |
| 3 |
A high-resolution(17)O NMR study of siliceous zeolite faujasite
Bull LM, Cheetham AK, Anupold T, Reinhold A, Samoson A, Sauer J, Bussemer B, Lee Y, Gann S, Shore J, Pines A, Dupree R
Journal of the American Chemical Society, 120(14), 3510, 1998 |
| 4 |
Calculation of Si-29 and Al-27 MAS NMR chemical shifts in zeolite-beta using density functional theory : Correlation with lattice structure
Valerio G, Goursot A, Vetrivel R, Malkina O, Malkin V, Salahub DR
Journal of the American Chemical Society, 120(44), 11426, 1998 |
| 5 |
NMR Chemical-Shifts of Zr-at-C-28 - How Shielded Can Zr-91 Get
Buhl M
Journal of Physical Chemistry A, 101(13), 2514, 1997 |
| 6 |
Predicting Absolute and Site-Specific Acidities for Zeolite Catalysts by a Combined Quantum-Mechanics Interatomic Potential Function-Approach
Eichler U, Brandle M, Sauer J
Journal of Physical Chemistry B, 101(48), 10035, 1997 |
| 7 |
Molecular-Structure of Free Molecules of the Fullerene C-70 from Gas-Phase Electron-Diffraction
Hedberg K, Hedberg L, Buhl M, Bethune DS, Brown CA, Johnson RD
Journal of the American Chemical Society, 119(23), 5314, 1997 |
| 8 |
Electronic Excitation-Energies in Copper Selenide Clusters
Schafer A, Kollwitz M, Ahlrichs R
Journal of Chemical Physics, 104(18), 7113, 1996 |
| 9 |
Theoretical-Study of the Vibrational-Spectra of the Transition-Metal Carbonyl Hydrides HM(Co)(5) (M=mn, Re), H(2)M(Co)(4) (M=fe, Ru, Os), and HM(Co)(4) (M=co, Rh, Ir)
Jonas V, Thiel W
Journal of Chemical Physics, 105(9), 3636, 1996 |
| 10 |
Coordination, Structure, and Vibrational-Spectra of Titanium in Silicates and Zeolites in Comparison with Related Molecules - An Ab-Initio Study
Deman AJ, Sauer J
Journal of Physical Chemistry, 100(12), 5025, 1996 |
