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- 1.0454987 - ÚOCHB 2016 CZ eng A - Abstract
Novák, Vít - Bouř, Petr
Modelling of vibrational spectra using combination of molecular and quantum mechanics.
Modeling Interactions in Biomolecules 7th. Praha: MATFYZPRESS, 2015 - (Burda, J.). s. 62. ISBN 978-80-7378-303-7.
[Modeling Interactions in Biomolecules /7./. 14.09.2015-18.09.2015, Praha]
R&D Projects: GA ČR GA15-09072S; GA ČR GAP208/11/0105
Institutional support: RVO:61388963
Keywords : Raman scattering * molecular dynamics * autocorrelation function
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0255647 - 2.0443505 - ÚOCHB 2016 CZ eng A - Abstract
Novák, Vít - Bouř, Petr
Spectra modelling combining molecular dynamics and quantum mechanics.
Materials Structure in Chemistry, Biology, Physics and Technology. Czech and Slovak Crystallographic Association. Roč. 22, č. 1 (2015), s. 48. ISSN 1211-5894.
[Discussions in Structural Molecular Biology. Annual Meeting of the Czech Society for Structural Biology /13./. 19.03.2015-21.03.2015, Nové Hrady]
R&D Projects: GA ČR GAP208/11/0105; GA ČR GA15-09072S
Grant - others:GA MŠk(CZ) LM2010005; GA MŠk(CZ) ED3.2.00/08.0144
Institutional support: RVO:61388963
Keywords : Raman scattering * molecular dynamics * autocorrelation function
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0246310 - 3.0381671 - ÚOCHB 2013 CH eng A - Abstract
Novák, Vít - Šebestík, Jaroslav - Bouř, Petr
Theoretical modeling of the surface-enhanced Raman optical activity.
Workshop CECAM 2012. Vibrational optical activity: Interplay of theory and experiment. Lausanne: CECAM, 2012. s. 51-51.
[Workshop CECAM 2012. Vibrational optical activity: Interplay of theory and experiment. 23.09.2012-27.09.2012, Pisa]
Institutional research plan: CEZ:AV0Z40550506
Keywords : SEROA * CID * SERS
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0212087