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Theoretical Investigation of CO Interaction with Copper Sites in Zeolites: Periodic DFT and Hybrid Quantum Mechanical/Interatomic Potential Function Study
Bludský, Ota, Silhan, Martin, Nachtigall, Petr, Bucko, T., Benco, L., Hafner, J.Volume:
109
Language:
english
Journal:
The Journal of Physical Chemistry B
DOI:
10.1021/jp0506538
Date:
May, 2005
File:
PDF, 230 KB
english, 2005