Cold SiO2-rich slabs reaching the CMB revealed by the seifertite phase boundary
- Journal article
- Creator
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;Ryosuke Sinmyo (author) (Search by this author);Saori Kawaguchi-Imada (author) (Search by this author);Rei Sato (author) (Search by this author);Keisuke Otsuru (author) (Search by this author);Kenji Kawai (author) (Search by this author)Hiroshi Sakuma (author) (Search by this author)
;
Shigeru Suehara (author) (Search by this author)
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;Takayuki Ishii (author) (Search by this author)Shuhou Maitani (author) (Search by this author) - Keyword
- DFT, Seifertite
- Date published
- 2026-05-30
- Updated at
- 2026-08-31 17:52:18 +0900
Unveiling dendrite-suppressing potential of alkali metal-based alloys in lithium metal batteries
- Journal article
- Creator
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;Kuan-Yu Lin (author) (Search by this author);Rui-Tong Kuo (author) (Search by this author)Tsuyoshi Miyazaki (author) (Search by this author)National Institute for Materials Science
;
;Bing Joe Hwang (author) (Search by this author)Jyh-Chiang Jiang (author) (Search by this author) - Keyword
- Li metal battery, DFT, solid electrolyte interface, MD
- Date published
- 2024-04-13
- Updated at
- 2024-08-20 10:48:14 +0900
Numerical atomic basis orbitals from H to Kr
- Journal article
- Creator
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;T. Ozaki (author) (Search by this author)H. Kino (author) (Search by this author)National Institute for Materials Science
- Keyword
- OpenMX, first-principles calculation, DFT, LCAO, numerical atomic basis, benchmark, molecules, bulks
- Date published
- 2004-05-28
- Updated at
- 2024-01-05 22:11:39 +0900
Engineering the electronic properties of MoTe2 via defect control
- Journal article
- Creator
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;Celal Yelgel (author) (Search by this author)Övgü C. Yelgel (author) (Search by this author)The Computational Modelling Laboratory, Recep Tayyip Erdogan University,
- Keyword
- Transition metal dichalcogenides, DFT, MoTe2, defect control, electronic properties
- Date published
- 2024-12-31
- Updated at
- 2025-07-16 16:14:08 +0900
Understanding the interplay of defects, oxygen, and strain in 2D materials for next-generation optoelectronics
- Journal article
- Creator
-
;Keerthana S Kumar (author) (Search by this author);Ajit Kumar Dash (author) (Search by this author);Hasna Sabreen H (author) (Search by this author);Manvi Verma (author) (Search by this author);Vivek Kumar (author) (Search by this author)Kenji Watanabe (author) (Search by this author)National Institute for Materials Science
;
Takashi Taniguchi (author) (Search by this author)National Institute for Materials Science
;
;Gopalakrishnan Sai Gautam (author) (Search by this author)Akshay Singh (author) (Search by this author)
- Keyword
- MoS2, strain, defects, 2D materials, optical spectroscopy, DFT, oxygen
- Date published
- 2024-10-01
- Updated at
- 2025-08-30 08:30:17 +0900