Keyword: DFT calculation

2 records found.

manuscript_SI_MDR.pdf
Unraveling the Origin of Unusual Cs Atom Disorder in Cesium Octahedral Molybdenum Halide Cluster Compounds, Cs2[{Mo6Xi8}Xa6] (X = Cl and Br)
Journal article
Creator
Norio Saito (author) (Search by this author)
National Institute for Materials Science
ORCID ;
Stéphane Cordier (author) (Search by this author)
;
Takeo Ohsawa (author) (Search by this author)
ORCID SAMURAI ;
Noriko Saito (author) (Search by this author)
ORCID SAMURAI ;
Takahiro Takei (author) (Search by this author)
;
Fabien Grasset (author) (Search by this author)
;
Jeffrey Scott Cross (author) (Search by this author)
;
Naoki Ohashi (author) (Search by this author)
ORCID SAMURAI
Keyword
molybdenum halide, metal cluster, disordered structure, DFT calculation, luminescence
Date published
2025-02-03
Updated at
2025-04-02 15:09:44 +0900

d2nr03596k1.pdf
Single-molecule detection with enhanced Raman scattering of tungsten oxide nanostructure
Journal article
Creator
Yoshitaka Shingaya (author) (Search by this author)
ORCID SAMURAI ;
Hirokazu Takaki (author) (Search by this author)
;
Nobuhiko Kobayashi (author) (Search by this author)
;
Masakazu Aono (author) (Search by this author)
ORCID SAMURAI ;
Tomonobu Nakayama (author) (Search by this author)
ORCID SAMURAI
Keyword
WOx nanorod, Raman enhancement, single-molecule detection, DFT calculation
Date published
2022-09-23
Updated at
2024-09-18 12:30:23 +0900