Keyword: All-electron GW calculation
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I-56_a11_6131130.pdf
All-electron GW calculation of the electronic structure in light-element-doped TiO2
Conference presentation
Creator
Ryoji Sahara (author) (Search by this author)
Research Center for Structural Materials/Materials Evaluation Field/Computational Structural Materials Group, National Institute for Materials Science
ORCID SAMURAI ;
Takashi Ishikawa (author) (Search by this author)
Tohoku University
;
Kaoru Ohno (author) (Search by this author)
Yokohama National University
;
Kyosuke Ueda (author) (Search by this author)
Tohoku University
;
Takayuki Narushima (author) (Search by this author)
Tohoku University
Keyword
All-electron GW calculation, C/N doped anatase TiO2, band gap narrowing, first-principles calculations
Date published
Updated at
2025-12-10 16:30:22 +0900