Electronic Structure and Band Alignments of Various Phases of Titania Using the Self-Consistent Hybrid Density Functional and DFT+U Methods - Université de Lorraine Access content directly
Journal Articles Frontiers in Chemistry Year : 2019

Electronic Structure and Band Alignments of Various Phases of Titania Using the Self-Consistent Hybrid Density Functional and DFT+U Methods

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hal-03603441 , version 1 (09-03-2022)

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Won June Kim, Myung Hoon Han, Sébastien Lebègue, Eok Kyun Lee, Hyungjun Kim. Electronic Structure and Band Alignments of Various Phases of Titania Using the Self-Consistent Hybrid Density Functional and DFT+U Methods. Frontiers in Chemistry, 2019, 7, pp.47. ⟨10.3389/fchem.2019.00047⟩. ⟨hal-03603441⟩
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