Keyword: density functional theory calculation
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2 records found.

JCP21-AR-COMMA2021-00971.pdf
Combination of recommender system and single-particle diagnosis for accelerated discovery of novel nitrides
Journal article
Creator
ORCID SAMURAI ;
SEKO, Atsuto (author) (Search by this author)
ORCID ;
TANAKA, Isao (author) (Search by this author)
ORCID ; ORCID SAMURAI ; ORCID SAMURAI
Keyword
materials informatics, density functional theory calculation, materials search
Date published
2021-06-14
Updated at
2024-01-05 22:12:06 +0900
Manuscript.pdf
Atomic-Scale Observation of Moiré potential in Twisted Hexagonal Boron Nitride Layers by Electron Microscopy
Journal article
Creator
Rina Mishima (author) (Search by this author)
Graduate School of Science, Kobe University
;
Takuro Nagai (author) (Search by this author)
Research Network and Facility Services Division/Materials Fabrication and Analysis Platform/Electron Microscopy Unit, National Institute for Materials Science
ORCID SAMURAI ;
Hiroyo Segawa (author) (Search by this author)
Research Center for Electronic and Optical Materials/Functional Materials Field/Amorphous Material Group, National Institute for Materials Science
ORCID SAMURAI ;
Masahiro Ehara (author) (Search by this author)
Institute for Molecular Science
;
Takashi Uchino (author) (Search by this author)
Graduate School of Science, Kobe University
Keyword
hexagonal boron nitride (hBN), Moiré superlattices, Moiré potential, two-dimensional functional material, aberration-corrected TEM, density functional theory calculation
Date published
2025-04-24
Updated at
2025-04-17 16:15:36 +0900