Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study

Journal article

Creator

Shengzhou Li (author) (Search by this author)

https://orcid.org/0000-0001-6973-3825

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

Shengzhou Li ;

Tsuyoshi Miyazaki (author) (Search by this author)

https://orcid.org/0000-0003-3534-4404

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

Tsuyoshi Miyazaki ;

Ayako Nakata (author) (Search by this author)

https://orcid.org/0000-0002-3311-6283

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

Ayako Nakata

Keyword

Large-scale DFT, gold nanoparticle, supported nanoparticle, statistic analysis, density of states, principal component analysis, first-principles calculation

Date published

2024-06-21

Updated at

2024-08-31 08:30:29 +0900