Search results
- 1.0367004 - FZÚ 2012 RIV DE eng J - Journal Article
Welsch, S. - Bodensteiner, M. - Dušek, Michal - Sierka, M. - Scheer, M.
A novel soluble Inl precursor for Pn ligand coordination chhemistry.
Chemistry - A European Journal. Roč. 16, č. 44 (2010), s. 13041-13045. ISSN 0947-6539. E-ISSN 1521-3765
Grant - others:AV ČR(CZ) AP0701
Program: Akademická prémie - Praemium Academiae
Institutional research plan: CEZ:AV0Z10100521
Keywords : coordination polymers * Group 13 elements * indium * phosphorus * weakly coordinating anions
Subject RIV: BM - Solid Matter Physics ; Magnetism
Impact factor: 5.476, year: 2010
Permanent Link: http://hdl.handle.net/11104/0201806 - 2.0322929 - ÚFCH JH 2009 RIV GB eng J - Journal Article
Sklenák, Štěpán - Dědeček, Jiří - Li, Chengbin - Wichterlová, Blanka - Gábová, Vendula - Sierka, M. - Sauer, J.
Aluminium siting in the ZSM-5 framework by combination of high resolution Al-27 NMR and DFT/MM calculations.
[Pozice hliníku v ZSM-5 zeolitu v kombinaci s 27Al 3Q MAS NMR spektroskopie a QM/MM výpočtu.]
Physical Chemistry Chemical Physics. Roč. 11, č. 8 (2009), s. 1237-1247. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA AV ČR 1ET400400413; GA ČR GA203/06/1449
Institutional research plan: CEZ:AV0Z40400503
Keywords : MQ MAS NMR * approximate Coulomb potentials * ab-initio calculations
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 4.116, year: 2009
Permanent Link: http://hdl.handle.net/11104/0171054 - 3.0322907 - ÚFCH JH 2009 RIV US eng J - Journal Article
Dědeček, Jiří - Sklenák, Štěpán - Li, Chengbin - Wichterlová, Blanka - Gábová, Vendula - Brus, Jiří - Sierka, M. - Sauer, J.
Effect of Al-Si-Al and Al-Si-Si-Al Pairs in the ZSM-5 Zeolite Framework on the Al-27 NMR Spectra. A Combined High-Resolution Al-27 NMR and DFT/MM Study.
[Efekt přítomnosti Al-O-Si-O-Al a Al-O-Si-O-Si-O-Al sekvencí v ZSM-5 zeolitovém skeletu na lokální geometrii AlO4- tetrahedru a 27Al NMR parametry byl vyšetřován za použití 27Al 3Q MAS NMR spektroskopie a DFT/MM výpočtu.]
Journal of Physical Chemistry C. Roč. 113, č. 4 (2009), s. 1447-1458. ISSN 1932-7447. E-ISSN 1932-7455
R&D Projects: GA AV ČR 1ET400400413; GA AV ČR IAA400400812; GA AV ČR KAN100400702
Institutional research plan: CEZ:AV0Z40400503; CEZ:AV0Z40500505
Keywords : zeolites * ab-initio calculation * MAS NMR
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 4.224, year: 2009
Permanent Link: http://hdl.handle.net/11104/0171040 - 4.0180634 - UFCH-W 990046 RIV GB eng J - Journal Article
Nachtigallová, Dana - Nachtigall, Petr - Sierka, M. - Sauer, J.
Coordination and Siting of Cu + Ions in ZSM-5: A Combined Quantum Mechanics/Interatomic Potential Function Study.
Physical Chemistry Chemical Physics. Roč. 1, č. 1 (1999), s. 2019-2026. ISSN 1463-9076. E-ISSN 1463-9084
R&D Projects: GA ČR GA203/97/P011
Grant - others:VW Stiftung(DE) I/72937
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 0.000, year: 1999
Permanent Link: http://hdl.handle.net/11104/0077283 - 5.0090513 - ÚFCH JH 2008 RIV DE eng J - Journal Article
Sklenák, Štěpán - Dědeček, Jiří - Li, Chengbin - Wichterlová, Blanka - Gábová, Vendula - Sierka, M. - Sauer, J.
Aluminum siting in silicon-rich zeolite frameworks: A combined high-resolution Al-27 NMR spectroscopy and quantum mechanics/molecular mechanics study of ZSM-5.
[Pozice hliníku v zeolitickém skeletu: ALNMR spektroskopie a kvantová mechanika/studie molekulární mechaniky na ZSM-5.]
Angewandte Chemie - International Edition. Roč. 46, č. 38 (2007), s. 7286-7289. ISSN 1433-7851. E-ISSN 1521-3773
R&D Projects: GA AV ČR 1ET400400413; GA ČR GA203/06/1449; GA AV ČR IAA4040308
Institutional research plan: CEZ:AV0Z40400503
Keywords : MQ MAS NMR * chemical-shifts * ab-initio * catalysts
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 10.031, year: 2007
Permanent Link: http://hdl.handle.net/11104/0151383