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- 1.0312992 - ÚOCHB 2009 AU eng A - Abstract
Kaminský, Jakub - Kapitán, Josef - Bouř, Petr
Interpretation of Raman and Raman optical activity spectra of flexible acyclic sugar derivatives.
[Interpretace Ramanových a ROA spekter flexibilních acyklických cukerných derivátů.]
Proceedings of the Eighth Triennial Congress of the World Association of the Theoretical and Computational Chemists. Sydney: World Association of Theoretical and Computational Chemists, 2008 - (Jordan, M.). s. 185-185. ISBN 978-0-646-50151-2.
[WATOC 08. Congress of the World Association of Theoretical and Computational Chemists /8./. 14.09.2008-19..09.2008, Sydney]
R&D Projects: GA ČR GA203/06/0420; GA ČR GA202/07/0732; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : ROA spectroscopy * DFT * MD
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0163924 - 2.0311111 - ÚOCHB 2009 CZ eng A - Abstract
Horníček, Jan - Kaprálová, Petra - Bouř, Petr
Vibrational optical activity spectra simulation from classical trajectories.
[Simulace vibračních spekter z klasických trajektorií.]
Materials Structure in Chemistry, Biology, Physics and Technology. Czech and Slovak Crystallographic Association. Roč. 14, č. 1 (2007), s. 36-36. ISSN 1211-5894.
[Discussions in Structural Molecular Biology /6./. 29.03.2007-31.03.2007, Nové Hrady]
R&D Projects: GA ČR GA203/06/0420; GA ČR GA202/07/0732; GA AV ČR IAA400550702
Institutional research plan: CEZ:AV0Z40550506
Keywords : infrared absorption * vibrational circular dichroism * Raman optical activity
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0162810