Structural and optical properties of Ni atoms and Ni55 cluster adsorbed on a rutile TiO2 (110) surface
出版年份 2018 全文链接
标题
Structural and optical properties of Ni atoms and Ni55 cluster adsorbed on a rutile TiO2 (110) surface
作者
关键词
Electronic structure and bonding, Absorption spectra, Supported metallic nanoparticles
出版物
THEORETICAL CHEMISTRY ACCOUNTS
Volume 137, Issue 3, Pages -
出版商
Springer Nature
发表日期
2018-02-21
DOI
10.1007/s00214-018-2211-6
参考文献
相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。- Theoretical Study of the Structural, Energetic, and Electronic Properties of 55-Atom Metal Nanoclusters: A DFT Investigation within van der Waals Corrections, Spin–Orbit Coupling, and PBE+U of 42 Metal Systems
- (2016) Maurício J. Piotrowski et al. Journal of Physical Chemistry C
- Hubbard U calculations on optical properties of 3 d transition metal oxide TiO 2
- (2016) M.H. Samat et al. Results in Physics
- Investigating the Energetic Ordering of Stable and Metastable TiO2 Polymorphs Using DFT+U and Hybrid Functionals
- (2015) Matthew T. Curnan et al. Journal of Physical Chemistry C
- Ni cluster nucleation and growth on the anatase TiO2(101) surface: a density functional theory study
- (2015) Yanxin Wang et al. RSC Advances
- CO Oxidation Over TiO2-Supported Pt–Fe Catalysts Prepared by Coimpregnation Methods
- (2014) Hisahiro Einaga et al. CATALYSIS LETTERS
- Probing the Optical Property and Electronic Structure of TiO2 Nanomaterials for Renewable Energy Applications
- (2014) Mukes Kapilashrami et al. CHEMICAL REVIEWS
- A Study on the Mechanism for H2 Dissociation on Au/TiO2 Catalysts
- (2014) Keju Sun et al. Journal of Physical Chemistry C
- Electronic structures and optical properties of rutile TiO2 with different point defects from DFT+U calculations
- (2014) H.X. Zhu et al. PHYSICS LETTERS A
- Catalytic behavior of supported Ru nanoparticles on the (101) and (001) facets of anatase TiO2
- (2014) Fei Wang et al. RSC Advances
- Insights into Catalytic Oxidation at the Au/TiO2 Dual Perimeter Sites
- (2013) Isabel X. Green et al. ACCOUNTS OF CHEMICAL RESEARCH
- Nitrobenzene Hydrogenation on Au/TiO2 and Au/SiO2 Catalyst: Synthesis, Characterization and Catalytic Activity
- (2013) Cecilia Torres et al. CATALYSIS LETTERS
- Defect-Mediated Growth of Noble-Metal (Ag, Pt, and Pd) Nanoparticles on TiO2 with Oxygen Vacancies for Photocatalytic Redox Reactions under Visible Light
- (2013) Xiaoyang Pan et al. Journal of Physical Chemistry C
- Understanding the Nucleation and Growth of Metals on TiO2: Co Compared to Au, Ni, and Pt
- (2013) Randima P. Galhenage et al. Journal of Physical Chemistry C
- The Role of Reducible Oxide–Metal Cluster Charge Transfer in Catalytic Processes: New Insights on the Catalytic Mechanism of CO Oxidation on Au/TiO2 from ab Initio Molecular Dynamics
- (2013) Yang-Gang Wang et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Plasmonic enhancement of visible-light water splitting with Au–TiO2 composite aerogels
- (2013) Paul A. DeSario et al. Nanoscale
- Localized electronic states induced by oxygen vacancies on anatase TiO2 (101) surface
- (2013) N.S. Portillo-Vélez et al. SURFACE SCIENCE
- Growth of Ag and Au Nanoparticles on Reduced and Oxidized Rutile TiO2(110) Surfaces
- (2013) Estephania Lira et al. TOPICS IN CATALYSIS
- Growth mechanism of palladium clusters on rutile TiO2(110) surface
- (2012) Weina Zhao et al. Journal of Natural Gas Chemistry
- TiO2 photocatalysis: Design and applications
- (2012) Kazuya Nakata et al. JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY C-PHOTOCHEMISTRY REVIEWS
- Strong Interaction between Gold and Anatase TiO2(001) Predicted by First Principle Studies
- (2012) Chenghua Sun et al. Journal of Physical Chemistry C
- Nucleation, Growth, and Adsorbate-Induced Changes in Composition for Co–Au Bimetallic Clusters on TiO2
- (2012) Randima P. Galhenage et al. Journal of Physical Chemistry C
- Growth of Pt Particles on the Anatase TiO2 (101) Surface
- (2012) Yun Zhou et al. Journal of Physical Chemistry C
- Photocatalytic Activity of Ag/TiO2 Nanotube Arrays Enhanced by Surface Plasmon Resonance and Application in Hydrogen Evolution by Water Splitting
- (2012) Feng Wu et al. Plasmonics
- In situ controlled growth of well-dispersed gold nanoparticles in TiO2nanotube arrays as recyclable substrates for surface-enhanced Raman scattering
- (2011) Yajie Chen et al. DALTON TRANSACTIONS
- DFT+U calculations of crystal lattice, electronic structure, and phase stability under pressure of TiO2 polymorphs
- (2011) M. E. Arroyo-de Dompablo et al. JOURNAL OF CHEMICAL PHYSICS
- Theoretical Studies of the Stability and Oxidation of Pdn (n = 1–7) Clusters on Rutile TiO2(110): Adsorption on the Stoichiometric Surface
- (2011) S. Vincent Ong et al. Journal of Physical Chemistry C
- First-principles calculation of electronic structure of V-doped anatase TiO2
- (2010) Run Long et al. CHEMPHYSCHEM
- Electronic Structure of TiO2 Surfaces and Effect of Molecular Adsorbates Using Different DFT Implementations
- (2010) Natalia Martsinovich et al. Journal of Physical Chemistry C
- Hydrogen Production by Photocatalytic Water Splitting over Pt/TiO2 Nanosheets with Exposed (001) Facets
- (2010) Jiaguo Yu et al. Journal of Physical Chemistry C
- A first-principles study of the dielectric properties of TiO2polymorphs
- (2010) A Thilagam et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Electronic correlation effects in reduced rutileTiO2within theLDA+Umethod
- (2010) Seong-Geon Park et al. PHYSICAL REVIEW B
- Small polarons in Nb- and Ta-doped rutile and anatase TiO2
- (2009) Benjamin J. Morgan et al. JOURNAL OF MATERIALS CHEMISTRY
- Surface and subsurface oxygen vacancies in anataseTiO2and differences with rutile
- (2009) Hongzhi Cheng et al. PHYSICAL REVIEW B
- Structural and Electronic Properties of Selected Rutile and Anatase TiO2Surfaces: An ab Initio Investigation
- (2008) Frédéric Labat et al. Journal of Chemical Theory and Computation
- Nucleation and Growth of Palladium Clusters on Anatase TiO2(101) Surface: A First Principle Study
- (2008) Jinli Zhang et al. Journal of Physical Chemistry C
- First-principles study of anatase and rutileTiO2doped with Eu ions: A comparison of GGA andLDA+Ucalculations
- (2008) A. Rubio-Ponce et al. PHYSICAL REVIEW B
- Effect of on-site Coulomb repulsion termUon the band-gap states of the reduced rutile (110)TiO2surface
- (2008) Carmen J. Calzado et al. PHYSICAL REVIEW B
- Small Au and Pt Clusters at the Anatase TiO2(101) Surface: Behavior at Terraces, Steps, and Surface Oxygen Vacancies
- (2007) Xue-Qing Gong et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
Find Funding. Review Successful Grants.
Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.
ExplorePublish 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 More