Deciphering Charge Transfer and Electronic Polarization Effects at Gold Nanocatalysts on Reduced Titania Support
Author(s) -
SuHyun Yoo,
Niklas Siemer,
Mira Todorova,
Dominik Marx,
Jörg Neugebauer
Publication year - 2019
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.8b12015
Subject(s) - cluster (spacecraft) , chemical physics , density functional theory , vacancy defect , charge (physics) , nanomaterial based catalyst , ab initio , electronic structure , materials science , ab initio quantum chemistry methods , electron transfer , nanoparticle , semiconductor , oxygen , polarization (electrochemistry) , nanotechnology , computational chemistry , chemistry , crystallography , molecule , physics , optoelectronics , computer science , organic chemistry , quantum mechanics , programming language
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