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 |
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container_issue | 47 |
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container_title | The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory |
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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 |
format | Article |
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source | American Chemical Society Journals |
title | DFT Study with Inclusion of the Grimme Potential on Anatase TiO 2 : Structure, Electronic, and Vibrational Analyses |
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