Understanding the oxygen-vacancy-related catalytic cycle for H2 oxidation on ceria-based SOFC anode and the promotion effect of lanthanide doping from theoretical perspectives
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Title
Understanding the oxygen-vacancy-related catalytic cycle for H2 oxidation on ceria-based SOFC anode and the promotion effect of lanthanide doping from theoretical perspectives
Authors
Keywords
Hydrogen oxidation, Lanthanide-doped ceria, Oxygen vacancy, Solid oxide fuel cell, Density functional theory
Journal
APPLIED SURFACE SCIENCE
Volume 576, Issue -, Pages 151803
Publisher
Elsevier BV
Online
2021-11-06
DOI
10.1016/j.apsusc.2021.151803
References
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Note: Only part of the references are listed.- Enhancing Bifunctional Electrocatalytic Activities of Oxygen Electrodes via Incorporating Highly Conductive Sm3+ and Nd3+ Double-Doped Ceria for Reversible Solid Oxide Cells
- (2021) Jeong Hwa Park et al. ACS Applied Materials & Interfaces
- Interplay between Gd and oxygen vacancy on the electronic properties and defect chemistry of Gd-doped CeO2: A DFT+U study
- (2020) Xiaoping Han et al. CHEMICAL PHYSICS
- Comprehensive Study of the Ceria–H2 System: Effect of the Reaction Conditions on the Reduction Extent and Intermediates
- (2020) D. Schweke et al. Journal of Physical Chemistry C
- Theoretical investigation on H2 oxidation mechanisms over pristine and Sm-doped CeO2(1 1 1) surfaces
- (2020) Houyu Zhu et al. APPLIED SURFACE SCIENCE
- Theoretical Studies on the Stability and Reactivity of the Metal-Doped CeO2(100) Surface: Toward H2 Dissociation and Oxygen Vacancy Formation
- (2020) Wei Zhang et al. LANGMUIR
- Oxygen vacancies in metal oxides: recent progress towards advanced catalyst design
- (2020) Guoxin Zhuang et al. Science China-Materials
- CeO2(111) Surface with Oxygen Vacancy for Radical Scavenging: A Density Functional Theory Approach
- (2020) Robin Lawler et al. Journal of Physical Chemistry C
- Raman Scattering from Cerium Hydride Growth Centers Overlayered by Hydrogen-Incorporated Oxide
- (2020) Tsachi Livneh et al. Journal of Physical Chemistry C
- Validation of defect association energy on modulating oxygen ionic conductivity in low temperature solid oxide fuel cell
- (2020) Arunkumar Pandiyan et al. JOURNAL OF POWER SOURCES
- Building up a Picture of the Electrocatalytic Nitrogen Reduction Activity of Transition Metal Single Atom Catalysts
- (2019) xin liu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Electronic and geometric factors affecting oxygen vacancy formation on CeO2(111) surfaces: A first-principles study from trivalent metal doping cases
- (2019) Qian Gao et al. APPLIED SURFACE SCIENCE
- Calculation of Entropy of Adsorption for Small Molecules on Mineral Surfaces
- (2018) A. Budi et al. Journal of Physical Chemistry C
- A Linear Scaling Relation for CO Oxidation on CeO2-Supported Pd
- (2018) Jin-Xun Liu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- DFT insights into oxygen vacancy formation and CH4 activation over CeO2 surfaces modified by transition metals (Fe, Co and Ni)
- (2018) Dong Tian et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Highly Active and Stable CH4 Oxidation by Substitution of Ce4+ by Two Pd2+ Ions in CeO2(111)
- (2018) Ya-Qiong Su et al. ACS Catalysis
- First-Principles Based Microkinetic Modeling of CO2 Reduction at the Ni/SDC Cathode of a Solid Oxide Electrolysis Cell
- (2018) Bohua Ren et al. Journal of Physical Chemistry C
- Design of Effective Catalysts for Selective Alkyne Hydrogenation by Doping of Ceria with a Single-Atom Promotor
- (2018) Christopher Riley et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- H2 reduction of Gd- and Sm-doped ceria compared to pure CeO2 at high temperatures: effect on structure, oxygen nonstoichiometry, hydrogen solubility and hydroxyl chemistry
- (2018) Matthias Grünbacher et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- A brief review on ceria based solid electrolytes for solid oxide fuel cells
- (2018) Nandini Jaiswal et al. JOURNAL OF ALLOYS AND COMPOUNDS
- Direct Neutron Spectroscopy Observation of Cerium Hydride Species on a Cerium Oxide Catalyst
- (2017) Zili Wu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Stable Pd-Doped Ceria Structures for CH4 Activation and CO Oxidation
- (2017) Ya-Qiong Su et al. ACS Catalysis
- Enhanced electrical conductivity of doped CeO 2 under millimeter-wave irradiation heating
- (2017) Salmie Suhana Binti Che Abdullah et al. MATERIALS & DESIGN
- Impact of the Kohn–Sham Delocalization Error on the 4f Shell Localization and Population in Lanthanide Complexes
- (2016) Thomas J. Duignan et al. Journal of Chemical Theory and Computation
- Redox Kinetics Study of Fuel Reduced Ceria for Chemical-Looping Water Splitting
- (2016) Zhenlong Zhao et al. Journal of Physical Chemistry C
- On the Nature of Support Effects of Metal Dioxides MO2 (M = Ti, Zr, Hf, Ce, Th) in Single-Atom Gold Catalysts: Importance of Quantum Primogenic Effect
- (2016) Yan Tang et al. Journal of Physical Chemistry C
- A DFT+U study on the contribution of 4f electrons to oxygen vacancy formation and migration in Ln-doped CeO2
- (2016) M. Alaydrus et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- First-principle study of CO adsorption and oxidation on Sm-doped CeO2(111) surface
- (2016) Tao Xie et al. RSC Advances
- Synergistic effects towards H2 oxidation on the Cu–CeO2 electrode: a combination study with DFT calculations and experiments
- (2016) Shuang Wang et al. Journal of Materials Chemistry A
- Enhanced ceria based electrolytes by codoping samaria and scandia for intermediate temperature solid oxide fuel cells
- (2015) Yun Gan et al. MATERIALS CHEMISTRY AND PHYSICS
- Role of oxygen vacancies in the surface evolution of H at CeO2(111): a charge modification effect
- (2015) Xin-Ping Wu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Progress in material selection for solid oxide fuel cell technology: A review
- (2015) Neelima Mahato et al. PROGRESS IN MATERIALS SCIENCE
- Hydrogen activation, diffusion, and clustering on CeO2(111): A DFT+U study
- (2014) Delia Fernández-Torre et al. JOURNAL OF CHEMICAL PHYSICS
- Homolytic Products from Heterolytic Paths in H2 Dissociation on Metal Oxides: The Example of CeO2
- (2014) Max García-Melchor et al. Journal of Physical Chemistry C
- Theoretical Investigation of H2 Oxidation on the Sr2Fe1.5Mo0.5O6 (001) Perovskite Surface under Anodic Solid Oxide Fuel Cell Conditions
- (2014) Suwit Suthirakun et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Oxygen Defects and Surface Chemistry of Ceria: Quantum Chemical Studies Compared to Experiment
- (2013) Joachim Paier et al. CHEMICAL REVIEWS
- Recent progress on solid oxide fuel cell: Lowering temperature and utilizing non-hydrogen fuels
- (2013) Yicheng Zhao et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
- A “nano-windmill” driven by a flux of water vapour: a comparison to the rotating ATPase
- (2013) Patrycja Nitoń et al. Nanoscale
- Activity Descriptor for Catalytic Reactions on Doped Cerium Oxide
- (2013) M. Aryanpour et al. ACS Catalysis
- CO oxidation over CuO/Ce1−xCuxO2−δ and Ce1−xCuxO2−δ catalysts: Synergetic effects and kinetic study
- (2012) Ai-Ping Jia et al. JOURNAL OF CATALYSIS
- The Entropies of Adsorbed Molecules
- (2012) Charles T. Campbell et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Design and optimization of a combined fuel reforming and solid oxide fuel cell system with anode off-gas recycling
- (2011) Tae Seok Lee et al. ENERGY CONVERSION AND MANAGEMENT
- In search of enhanced electrolyte materials: a case study of doubly doped ceria
- (2011) Pratik P. Dholabhai et al. JOURNAL OF MATERIALS CHEMISTRY
- Chemistry of Doped Oxides: The Activation of Surface Oxygen and the Chemical Compensation Effect
- (2011) Zhenpeng Hu et al. Journal of Physical Chemistry C
- Effect of Dopants on the Energy of Oxygen-Vacancy Formation at the Surface of Ceria: Local or Global?
- (2011) Zhenpeng Hu et al. Journal of Physical Chemistry C
- A DFT+U study of defect association and oxygen migration in samarium-doped ceria
- (2011) Arif Ismail et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Lowering the Temperature of Solid Oxide Fuel Cells
- (2011) E. D. Wachsman et al. SCIENCE
- Oxygen vacancy migration in ceria and Pr-doped ceria: A DFT+U study
- (2010) Pratik P. Dholabhai et al. JOURNAL OF CHEMICAL PHYSICS
- Defect Structure of Ultrathin Ceria Films on Pt(111): Atomic Views from Scanning Tunnelling Microscopy
- (2010) David C. Grinter et al. Journal of Physical Chemistry C
- A density functional study of defect migration in gadolinium doped ceria
- (2010) Pratik P. Dholabhai et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Strategies for Lowering Solid Oxide Fuel Cells Operating Temperature
- (2009) Albert Tarancón Energies
- Covalent radii revisited
- (2008) Beatriz Cordero et al. DALTON TRANSACTIONS
- Development of LSCF–GDC composite cathodes for low-temperature solid oxide fuel cells with thin film GDC electrolyte
- (2008) Y LENG et al. INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
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