Ota Bludský
Ota Bludský
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Investigation of the benzene-dimer potential energy surface: DFT/CCSD (T) correction scheme
O Bludský, M Rubeš, P Soldán, P Nachtigall
The Journal of chemical physics 128 (11), 114102, 2008
Water adsorption on coordinatively unsaturated sites in CuBTC MOF
L Grajciar, O Bludsky, P Nachtigall
The Journal of Physical Chemistry Letters 1 (23), 3354-3359, 2010
Ab initio second‐ and fourth‐order Mo/ller–Plesset study on structure, stabilization energy, and stretching vibration of benzene⋅⋅⋅X (X=He,Ne,Ar,Kr,Xe …
P Hobza, O Bludský, HL Selzle, EW Schlag
The Journal of chemical physics 97 (1), 335-340, 1992
Amino groups in nucleic acid bases, aniline, aminopyridines, and aminotriazine are nonplanar: Results of correlated ab initio quantum chemical calculations and …
O Bludský, J Šponer, J Leszczynski, V Špirko, P Hobza
The Journal of chemical physics 105 (24), 11042-11050, 1996
Structure and stability of the water− graphite complexes
M Rubes, P Nachtigall, J Vondrasek, O Bludsky
The Journal of Physical Chemistry C 113 (19), 8412-8419, 2009
DFT/CC investigation of physical adsorption on a graphite (0001) surface
M Rubeš, J Kysilka, P Nachtigall, O Bludský
Physical Chemistry Chemical Physics 12 (24), 6438-6444, 2010
Reliable theoretical treatment of molecular clusters: Counterpoise-corrected potential energy surface and anharmonic vibrational frequencies of the water dimer
P Hobza, O Bludský, S Suhai
Physical Chemistry Chemical Physics 1 (13), 3073-3078, 1999
Combined DFT/CC and IR spectroscopic studies on carbon dioxide adsorption on the zeolite H-FER
A Pulido, MR Delgado, O Bludský, M Rubeš, P Nachtigall, CO Areán
Energy & Environmental Science 2 (11), 1187-1195, 2009
Experimental and theoretical determination of adsorption heats of CO 2 over alkali metal exchanged ferrierites with different Si/Al ratio
A Zukal, A Pulido, B Gil, P Nachtigall, O Bludský, M Rubeš, J Čejka
Physical Chemistry Chemical Physics 12 (24), 6413-6422, 2010
Adsorption of CO2 in FAU zeolites: Effect of zeolite composition
HV Thang, L Grajciar, P Nachtigall, O Bludský, CO Areán, E Frýdová, ...
Catalysis Today 227, 50-56, 2014
Anharmonic treatment of the lowest-energy conformers of glycine: A theoretical study
O Bludský, J Chocholoušová, J Vacek, F Huisken, P Hobza
The Journal of Chemical Physics 113 (11), 4629-4635, 2000
Computational and FTIR spectroscopic studies on carbon monoxide and dinitrogen adsorption on a high-silica H-FER zeolite
P Nachtigall, O Bludský, L Grajciar, D Nachtigallova, MR Delgado, ...
Physical Chemistry Chemical Physics 11 (5), 791-802, 2009
The vibrational dynamics of carbon monoxide in a confined space—CO in zeolites
D Nachtigallová, O Bludský, CO Areán, R Bulánek, P Nachtigall
Physical Chemistry Chemical Physics 8 (42), 4849-4852, 2006
Theoretical investigation of CO interaction with copper sites in zeolites: Periodic DFT and hybrid quantum mechanical/interatomic potential function study
O Bludský, M Silhan, P Nachtigall, T Bucko, L Benco, J Hafner
The journal of physical chemistry B 109 (19), 9631-9638, 2005
Calculations of site-specific CO stretching frequencies for copper carbonyls with the “near spectroscopic accuracy”: CO interaction with Cu+/MFI
O Bludský, M Šilhan, D Nachtigallová, P Nachtigall
The Journal of Physical Chemistry A 107 (48), 10381-10388, 2003
Accurate description of argon and water adsorption on surfaces of graphene-based carbon allotropes
J Kysilka, M Rubes, L Grajciar, P Nachtigall, O Bludsky
The Journal of Physical Chemistry A 115 (41), 11387-11393, 2011
Vibrational dynamics of the benzene… argon complex
O Bludský, V S̆pirko, V Hrouda, P Hobza
Chemical physics letters 196 (5), 410-416, 1992
Investigation of the benzene–naphthalene and naphthalene–naphthalene potential energy surfaces: DFT/CCSD (T) correction scheme
M Rubeš, O Bludský, P Nachtigall
ChemPhysChem 9 (12), 1702-1708, 2008
DFT/CCSD (T) investigation of the interaction of molecular hydrogen with carbon nanostructures
M Rubeš, O Bludský
ChemPhysChem 10 (11), 1868-1873, 2009
Intermolecular π–π interactions in solids
M Rubeš, O Bludský
Physical Chemistry Chemical Physics 10 (19), 2611-2615, 2008
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