A Density Functional Theory Study of the Adsorption of Benzene on Hematite (α-Fe2O3) Surfaces
Published 2014 View Full Article
- Home
- Publications
- Publication Search
- Publication Details
Title
A Density Functional Theory Study of the Adsorption of Benzene on Hematite (α-Fe2O3) Surfaces
Authors
Keywords
-
Journal
Minerals
Volume 4, Issue 1, Pages 89-115
Publisher
MDPI AG
Online
2014-02-15
DOI
10.3390/min4010089
References
Ask authors/readers for more resources
Related references
Note: Only part of the references are listed.- Adsorption of methylamine on mackinawite (FES) surfaces: A density functional theory study
- (2013) N. Y. Dzade et al. JOURNAL OF CHEMICAL PHYSICS
- Water adsorption and dissociation on α-Fe2O3(0001): PBE+U calculations
- (2013) Manh-Thuong Nguyen et al. JOURNAL OF CHEMICAL PHYSICS
- The Role of Hydrogen Bonding and Proton Transfer in the Formation of Uracil Networks on the Gold (100) Surface: A Density Functional Theory Approach
- (2013) Simona Irrera et al. Journal of Physical Chemistry C
- Thermodynamics of native point defects in α-Fe2O3: an ab initio study
- (2013) Joohee Lee et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Surface potentials of (001), (012), (113) hematite (α-Fe2O3) crystal faces in aqueous solution
- (2013) Shawn Chatman et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- First-principles simulation of arsenate adsorption on the (11¯2) surface of hematite
- (2012) Marc Blanchard et al. GEOCHIMICA ET COSMOCHIMICA ACTA
- Recent advances in surface engineering of superparamagnetic iron oxide nanoparticles for biomedical applications
- (2012) M. Mahmoudi et al. Journal of the Iranian Chemical Society
- Use of iron oxide nanomaterials in wastewater treatment: A review
- (2012) Piao Xu et al. SCIENCE OF THE TOTAL ENVIRONMENT
- Density functional theory characterization of phosphate and sulfate adsorption on Fe-(hydr)oxide: Reactivity, pH effect, estimation of Gibbs free energies, and topological analysis of hydrogen bonds
- (2012) Nancy Y. Acelas et al. Computational and Theoretical Chemistry
- Enhanced photoelectrochemical activity for Cu and Ti doped hematite: The first principles calculations
- (2011) X. Y. Meng et al. APPLIED PHYSICS LETTERS
- Solar Water Splitting: Progress Using Hematite (α-Fe2O3) Photoelectrodes
- (2011) Kevin Sivula et al. ChemSusChem
- Preparation of Fe2O3/graphene composite and its electrochemical performance as an anode material for lithium ion batteries
- (2011) Gang Wang et al. JOURNAL OF ALLOYS AND COMPOUNDS
- α-Fe2O3 as an anode material with capacity rise and high rate capability for lithium-ion batteries
- (2011) Mohd Faiz Hassan et al. MATERIALS RESEARCH BULLETIN
- Electron Transport in Pure and Doped Hematite
- (2011) Peilin Liao et al. NANO LETTERS
- Density functional theory study of Al-doped hematite
- (2011) Richard Rivera et al. PHYSICA SCRIPTA
- Testing variations of the GW approximation on strongly correlated transition metal oxides: hematite (α-Fe2O3) as a benchmark
- (2011) Peilin Liao et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- DFT study of Sb(III) and Sb(V) adsorption and heterogeneous oxidation on hydrated oxide surfaces
- (2011) Sara E. Mason et al. Computational and Theoretical Chemistry
- Preparation and properties of hybrid monodispersed magnetic α-Fe2O3 based chitosan nanocomposite film for industrial and biomedical applications
- (2010) Jay Singh et al. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES
- Electronic, structural, and magnetic effects of 3d transition metals in hematite
- (2010) Muhammad N. Huda et al. JOURNAL OF APPLIED PHYSICS
- Integrin-targeting thermally cross-linked superparamagnetic iron oxide nanoparticles for combined cancer imaging and drug delivery
- (2010) Mi Kyung Yu et al. NANOTECHNOLOGY
- Templates for wax deposition?
- (2010) Miguel A. San-Miguel et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Evidence for Different Surface Speciation of Arsenite and Arsenate on Green Rust: An EXAFS and XANES Study
- (2009) Yuheng Wang et al. ENVIRONMENTAL SCIENCE & TECHNOLOGY
- Surface complexation modeling of dual-mode adsorption of organic acids: Phthalic acid adsorption onto hematite
- (2009) Yu Sik Hwang et al. JOURNAL OF COLLOID AND INTERFACE SCIENCE
- A LEED analysis of the clean surfaces of α-Fe2O3(0001) and α-Cr2O3(0001) bulk single crystals
- (2009) Maike Lübbe et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- DFT studies of Cr(VI) complex adsorption on hydroxylated hematite () surfaces
- (2009) Shuxia Yin et al. SURFACE SCIENCE
- Model study on sorption of polycyclic aromatic hydrocarbons to goethite
- (2008) Daniel Tunega et al. JOURNAL OF COLLOID AND INTERFACE SCIENCE
- Synthesis, properties, and applications of magnetic iron oxide nanoparticles
- (2008) Amyn S. Teja et al. PROGRESS IN CRYSTAL GROWTH AND CHARACTERIZATION OF MATERIALS
- Synthesis and magnetic properties of iron oxide nanoparticles/C and α-Fe/iron oxide nanoparticles/C composites
- (2007) Ying Xiong et al. JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS
Publish scientific posters with Peeref
Peeref publishes scientific posters from all research disciplines. Our Diamond Open Access policy means free access to content and no publication fees for authors.
Learn MoreFind the ideal target journal for your manuscript
Explore over 38,000 international journals covering a vast array of academic fields.
Search