Ab initio design of light absorption through silver atomic cluster decoration of TiO2
Author(s) -
María Pilar de LaraCastells,
C. Cabrillo,
David A. Micha,
Alexander O. Mitrushchenkov,
Tijo Vazhappilly
Publication year - 2018
Publication title -
physical chemistry chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.053
H-Index - 239
eISSN - 1463-9084
pISSN - 1463-9076
DOI - 10.1039/c8cp02853b
Subject(s) - cluster (spacecraft) , ab initio , absorption (acoustics) , ab initio quantum chemistry methods , materials science , infrared , visible spectrum , chemistry , nanotechnology , molecular physics , atomic physics , optoelectronics , optics , physics , molecule , organic chemistry , computer science , programming language , composite material
This first-principles study reveals how stable subnanometer silver clusters on a TiO 2 (110) surface lead to the onset of absorption bands in the near-infrared and visible regions.
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