License: In Copyright Keyword: First-principles calculation

2 records found.

23_2024-0023.pdf
Structure Prediction of Metal Nanoparticles Using Wulff Theorem and First Principles Calculation
Article
Creator
Miyu ONISHI ; Shota OHNO ; Ayako NAKATA SAMURAI ORCID ; Hiromi NAKAI
Keyword
Metal nanoparticle, Wulff construction, First-principles calculation, Surface energy, Plane index
Date published
2024-10-17
Updated at
2024-12-10 16:54:11 +0900

manuscript.pdf
Interfacial charge transfer and electronic structure of diamond/c-BN heterointerface
Article
Creator
Suna Jia ; Shiyang Fu ; Yaning Liu ; Nan Gao ; Hongdong Li ; Meiyong Liao SAMURAI ORCID
Keyword
Diamond, First-principles calculation
Date published
2022-12-07
Updated at
2024-01-05 22:14:02 +0900