First-Principles Study of Photoinduced Water-Splitting on Fe2O3
Journal article, 2011
alpha-fe2o3(0001)
basis-set
total-energy calculations
hematite
oxide
h2o adsorption
hydrogen
metals
0001
surface
augmented-wave method
Author
Anders Hellman
Chalmers, Applied Physics, Chemical Physics
Competence Centre for Catalysis (KCK)
R. G. S. Pala
Indian Institute of Technology Kanpur
Journal of Physical Chemistry C
1932-7447 (ISSN) 1932-7455 (eISSN)
Vol. 115 26 12901-12907Areas of Advance
Nanoscience and Nanotechnology
Energy
Materials Science
Subject Categories
Physical Sciences
Chemical Sciences
DOI
10.1021/jp200751j