DFT Study with Inclusion of the Grimme Potential on Anatase TiO 2 : Structure, Electronic, and Vibrational Analyses

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Veröffentlicht in:The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory Molecules, spectroscopy, kinetics, environment, & general theory, 2012-11, Vol.116 (47), p.11731-11735
Hauptverfasser: Albuquerque, Anderson R., Garzim, Marcos L., Santos, Iêda M. G. dos, Longo, Valeria, Longo, Elson, Sambrano, Julio R.
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container_title The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
container_volume 116
creator Albuquerque, Anderson R.
Garzim, Marcos L.
Santos, Iêda M. G. dos
Longo, Valeria
Longo, Elson
Sambrano, Julio R.
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doi_str_mv 10.1021/jp308318j
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title DFT Study with Inclusion of the Grimme Potential on Anatase TiO 2 : Structure, Electronic, and Vibrational Analyses
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