Open AccessHydrogen Abstraction Energies and Ammonia Binding to BEA, ZSM-5, and α-Quartz Doped with Al, Sc, B, or Ga
Author(s) -
Vishal Agarwal,
Horia Metiu
Publication year - 2015
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.5b04171
Subject(s) - quartz , catalysis , doping , ammonia , density functional theory , hydrogen , zeolite , monolayer , chemistry , inorganic chemistry , materials science , chemical engineering , organic chemistry , computational chemistry , nanotechnology , composite material , optoelectronics , engineering
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