Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO2(111) thin films: The role of the ceria support

Peterson, Erik W.; Wang, Huanru; Liu, Zongyuan; Ara, Tasnim; Senanayake, Sanjaya D.; Rodriguez, Jose A.; Zhou, Jing

doi:10.1116/6.0001409

Title: Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO₂(111) thin films: The role of the ceria support

Abstract

Ceria-supported Ni has shown unique catalytic activity due to unique properties of small Ni particles and strong metal-support interaction. Identification of adsorption sites and understanding the chemical interaction over Ni-ceria at the fundamental level provide crucial insights into the reaction pathways of complex catalytic processes. In this study, to probe the surface sites, the adsorption of CO was carried out with model Ni/ceria systems consisting of Ni nanoparticles vapor-deposited on well-ordered CeO_x(111) (1.5 < x < 2) thin films using infrared reflection absorption spectroscopy (IRRAS) and temperature-programmed desorption (TPD) under ultrahigh vacuum (UHV) conditions. Fully oxidized CeO₂(111) (Ce⁴⁺) and partially reduced CeO_1.75(111) (Ce⁴⁺/Ce³⁺) thin films were grown on Ru(0001) to examine the role of the ceria support. Additionally, Ni with low coverages (e.g., 0.2 ML) grows forming small two-dimensional particles on ceria at 300 K, which develop into three-dimensional clusters after heating to 700 K. In the absence of Ni, CO adsorption at 1 mTorr at 100 K shows distinct IR bands at 2158 cm^-1 on CeO₂ and 2165 cm^-1 on CeO_1.75. Bridging and atop IR bands associated with CO adsorption over metallic Ni were observed on the Ni-CeO_1.75 surface at 300 K under UHV conditions. CO adsorption over Ni⁰more »« less

Authors:

Peterson, Erik W. ^[1]; Wang, Huanru ^[2]; Liu, Zongyuan ^[2]; Ara, Tasnim ^[1]; Senanayake, Sanjaya D. ^[2]; Rodriguez, Jose A. ^[2];

^[1]

Univ. of Wyoming, Laramie, WY (United States)
Brookhaven National Lab. (BNL), Upton, NY (United States)

Publication Date:: Mon Dec 06 00:00:00 EST 2021

Research Org.:: Brookhaven National Laboratory (BNL), Upton, NY (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES); National Science Foundation (NSF); National Aeronautics and Space Administration (NASA)

OSTI Identifier:: 1839209

Alternate Identifier(s):: OSTI ID: 1994455

Report Number(s):: BNL-222558-2021-JAAM
Journal ID: ISSN 0734-2101

Grant/Contract Number:: SC0012704; CHE 1151846; NNX15AI08H

Resource Type:: Accepted Manuscript

Journal Name:: Journal of Vacuum Science and Technology A

Additional Journal Information:: Journal Volume: 40; Journal Issue: 1; Journal ID: ISSN 0734-2101

Publisher:: American Vacuum Society / AIP

Country of Publication:: United States

Language:: English

Subject:: 36 MATERIALS SCIENCE; Redox reactions; Thin films; Temperature programmed desorption; Scanning tunneling microscopy; Infrared absorption spectroscopy; X-ray photoelectron spectroscopy; Catalysts and Catalysis; Oxides; Nanoparticles; Adsorption

Citation Formats


                    Peterson, Erik W., Wang, Huanru, Liu, Zongyuan, Ara, Tasnim, Senanayake, Sanjaya D., Rodriguez, Jose A., and Zhou, Jing. Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO2(111) thin films: The role of the ceria support.  United States: N. p., 2021. 
Web.  doi:10.1116/6.0001409.

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                    Peterson, Erik W., Wang, Huanru, Liu, Zongyuan, Ara, Tasnim, Senanayake, Sanjaya D., Rodriguez, Jose A., & Zhou, Jing. Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO2(111) thin films: The role of the ceria support.  United States.  https://doi.org/10.1116/6.0001409

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                    Peterson, Erik W., Wang, Huanru, Liu, Zongyuan, Ara, Tasnim, Senanayake, Sanjaya D., Rodriguez, Jose A., and Zhou, Jing. Mon .  
"Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO2(111) thin films: The role of the ceria support".  United States.  https://doi.org/10.1116/6.0001409.  https://www.osti.gov/servlets/purl/1839209.

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@article{osti_1839209,

  title        = {Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO2(111) thin films: The role of the ceria support},

  author       = {Peterson, Erik W. and Wang, Huanru and Liu, Zongyuan and Ara, Tasnim and Senanayake, Sanjaya D. and Rodriguez, Jose A. and Zhou, Jing},

  abstractNote = {Ceria-supported Ni has shown unique catalytic activity due to unique properties of small Ni particles and strong metal-support interaction. Identification of adsorption sites and understanding the chemical interaction over Ni-ceria at the fundamental level provide crucial insights into the reaction pathways of complex catalytic processes. In this study, to probe the surface sites, the adsorption of CO was carried out with model Ni/ceria systems consisting of Ni nanoparticles vapor-deposited on well-ordered CeOx(111) (1.5 < x < 2) thin films using infrared reflection absorption spectroscopy (IRRAS) and temperature-programmed desorption (TPD) under ultrahigh vacuum (UHV) conditions. Fully oxidized CeO2(111) (Ce4+) and partially reduced CeO1.75(111) (Ce4+/Ce3+) thin films were grown on Ru(0001) to examine the role of the ceria support. Additionally, Ni with low coverages (e.g., 0.2 ML) grows forming small two-dimensional particles on ceria at 300 K, which develop into three-dimensional clusters after heating to 700 K. In the absence of Ni, CO adsorption at 1 mTorr at 100 K shows distinct IR bands at 2158 cm-1 on CeO2 and 2165 cm-1 on CeO1.75. Bridging and atop IR bands associated with CO adsorption over metallic Ni were observed on the Ni-CeO1.75 surface at 300 K under UHV conditions. CO adsorption over Ni0 was also observed over as-deposited Ni on CeO2. However, a new IR band at 2146 cm-1 due to CO adsorption over Ni2+ species was detected at 100 K over the annealed Ni particles on CeO2. CO IRRAS data suggest the oxidation of Ni to Ni2+ on CeO2 and the formation of predominant Ni2+ species with heating, which is further confirmed with CO TPD data and previous x-ray photoelectron spectroscopy results.},

  doi          = {10.1116/6.0001409},

  journal      = {Journal of Vacuum Science and Technology A},

  number       = 1,

  volume       = 40,

  place        = {United States},

  year         = {Mon Dec 06 00:00:00 EST 2021},

  month        = {Mon Dec 06 00:00:00 EST 2021}

}

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An infrared reflection-absorption study of CO chemisorbed on clean and sulfided Ni(111) — Evidence for local surface interactions journal, July 1985

Infrared Study of Adsorbed Molecules on Metal Surfaces by Reflection Techniques journal, January 1966

Chemical activity of oxygen vacancies on ceria: a combined experimental and theoretical study on CeO 2 (111) journal, January 2014

Vibrational Frequencies of Cerium-Oxide-Bound CO: A Challenge for Conventional DFT Methods journal, December 2020

Morphology and chemical states of Ni supported on Ti-modified CeOx(111) interfaces journal, September 2020

Ordered cerium oxide thin films grown on Ru(0001) and Ni(111) journal, June 1999

Electron spectroscopy of single crystal and polycrystalline cerium oxide surfaces journal, July 1998

Morphology of size-selected Pt n clusters on CeO 2 (111) journal, March 2018

Growth, sintering, and chemical states of Co supported on reducible CeO2(111) thin films: The effects of the metal coverage and the nature of the support journal, January 2021

Low Pressure RAIRS Studies of Model Catalytic Systems journal, March 2010

Structural and Catalytic Properties of Model Supported Nickel Catalysts journal, January 1994

Influence of alloyed Sn atoms on the chemisorption properties of Ni(111) as probed by RAIRS and TPD studies of CO adsorption journal, April 1995

IRAS study of the adsorption of CO on Ni(111): Interrelation between various bonding modes of chemisorbed CO journal, January 1988

CO adsorption on nanoislands: Ni on Au(111) journal, June 2018

Adsorption of CO at Ni(100) surfaces: a FTIRAS - TDS study journal, December 1992

The C=O stretching vibration of CO on Ni(100) by infrared emission spectroscopy journal, May 1984

Infrared study of CO on NiO(100) journal, July 1994

The structure of CO on Ni(111) journal, January 1982

Surface Defect Characterization in Oxygen-Dosed Nickel Surfaces and in NiO Thin Films by CO Adsorption−Desorption Experiments journal, October 1997

Size-Dependent Molecular Dissociation on Mass-Selected, Supported Metal Clusters journal, September 1998

The surface chemistry of cerium oxide journal, March 2015

Title: Infrared reflection absorption spectroscopy and temperature-programmed desorption studies of CO adsorption on Ni/CeO₂(111) thin films: The role of the ceria support

Ceria-Based Materials in Hydrogenation and Reforming Reactions for CO2 Valorization
journal, February 2019

Insight into Ni/Ce1−xZrxO2−δ support interplay for enhanced methane steam reforming
journal, February 2019

Ambient pressure XPS and IRRAS investigation of ethanol steam reforming on Ni–CeO ₂ (111) catalysts: an in situ study of C–C and O–H bond scission
journal, January 2016

Dry Reforming of Methane on a Highly-Active Ni-CeO ₂ Catalyst: Effects of Metal-Support Interactions on C−H Bond Breaking
journal, May 2016

A review on reforming bio-ethanol for hydrogen production
journal, October 2007

Renewable Hydrogen from Ethanol by Autothermal Reforming
journal, February 2004

In Situ and Theoretical Studies for the Dissociation of Water on an Active Ni/CeO ₂ Catalyst: Importance of Strong Metal-Support Interactions for the Cleavage of O-H Bonds
journal, February 2015

Water–Gas Shift and CO Methanation Reactions over Ni–CeO2(111) Catalysts
journal, January 2011

Four challenges for nickel steam-reforming catalysts
journal, January 2006

A theoretical study of CH ₄ dissociation on pure and gold‐alloyed Ni(111) surfaces
journal, October 1996

A review on catalyst development for dry reforming of methane to syngas: Recent advances
journal, July 2019

Progress in Synthesis of Highly Active and Stable Nickel-Based Catalysts for Carbon Dioxide Reforming of Methane
journal, October 2015

Room-Temperature Activation of Methane and Dry Re-forming with CO ₂ on Ni-CeO ₂ (111) Surfaces: Effect of Ce ³⁺ Sites and Metal–Support Interactions on C–H Bond Cleavage
journal, November 2016

Ceria Maintains Smaller Metal Catalyst Particles by Strong Metal-Support Bonding
journal, August 2010

Nature of the Active Sites on Ni/CeO ₂ Catalysts for Methane Conversions
journal, August 2021

Effect of Ceria Support on the Structure of Ni Nanoparticles
journal, April 2010

Reaction Pathway for Coke-Free Methane Steam Reforming on a Ni/CeO ₂ Catalyst: Active Sites and the Role of Metal–Support Interactions
journal, June 2021

Catalytic Properties of Ceria and CeO ₂ -Containing Materials
journal, November 1996

Structure and surface properties of ceria-modified Ni-based catalysts for hydrogen production
journal, June 2018

Methane Activation at the Metal–Support Interface of Ni ₄ –CeO ₂ (111) Catalyst: A Theoretical Study
journal, March 2019

Interactions of Ni Nanoparticles with Reducible CeO ₂ (111) Thin Films
journal, April 2012

Growth of Pt Nanoparticles on Reducible CeO ₂ (111) Thin Films: Effect of Nanostructures and Redox Properties of Ceria
journal, June 2010

Ni Nanoparticles on CeO ₂ (111): Energetics, Electron Transfer, and Structure by Ni Adsorption Calorimetry, Spectroscopies, and Density Functional Theory
journal, April 2020

The Electronic Structure and Chemical Properties of a Ni/CeO ₂ Anode in a Solid Oxide Fuel Cell: A DFT + U Study
journal, November 2010

Reduction property and catalytic activity of Ce1−XNiXO2 mixed oxide catalysts for CH4 oxidation
journal, June 2003

Vibrational excitations and structure of CO adsorbed on Ni(100)
journal, January 1977

Adsorption of CO on a Ni(111) surface
journal, June 1974

Adsorption of carbon monoxide on nickel
journal, June 1977

Theoretical Studies of the Adsorption of CO and C on Ni(111) and Ni/CeO ₂ (111): Evidence of a Strong Metal–Support Interaction
journal, April 2013

The adsorption sites of CO on Ni(111) as determined by infrared reflection-absorption spectroscopy
journal, April 1979

An infrared reflection-absorption study of CO chemisorbed on clean and sulfided Ni(111) — Evidence for local surface interactions
journal, July 1985

Infrared Study of Adsorbed Molecules on Metal Surfaces by Reflection Techniques
journal, January 1966

Chemical activity of oxygen vacancies on ceria: a combined experimental and theoretical study on CeO ₂ (111)
journal, January 2014

Vibrational Frequencies of Cerium-Oxide-Bound CO: A Challenge for Conventional DFT Methods
journal, December 2020

Morphology and chemical states of Ni supported on Ti-modified CeOx(111) interfaces
journal, September 2020

Ordered cerium oxide thin films grown on Ru(0001) and Ni(111)
journal, June 1999

Electron spectroscopy of single crystal and polycrystalline cerium oxide surfaces
journal, July 1998

Morphology of size-selected Pt _n clusters on CeO ₂ (111)
journal, March 2018

Growth, sintering, and chemical states of Co supported on reducible CeO₂(111) thin films: The effects of the metal coverage and the nature of the support
journal, January 2021

Low Pressure RAIRS Studies of Model Catalytic Systems
journal, March 2010

Structural and Catalytic Properties of Model Supported Nickel Catalysts
journal, January 1994

Influence of alloyed Sn atoms on the chemisorption properties of Ni(111) as probed by RAIRS and TPD studies of CO adsorption
journal, April 1995

IRAS study of the adsorption of CO on Ni(111): Interrelation between various bonding modes of chemisorbed CO
journal, January 1988

CO adsorption on nanoislands: Ni on Au(111)
journal, June 2018

Adsorption of CO at Ni(100) surfaces: a FTIRAS - TDS study
journal, December 1992

The C=O stretching vibration of CO on Ni(100) by infrared emission spectroscopy
journal, May 1984

Infrared study of CO on NiO(100)
journal, July 1994

The structure of CO on Ni(111)
journal, January 1982

Surface Defect Characterization in Oxygen-Dosed Nickel Surfaces and in NiO Thin Films by CO Adsorption−Desorption Experiments
journal, October 1997

Size-Dependent Molecular Dissociation on Mass-Selected, Supported Metal Clusters
journal, September 1998

The surface chemistry of cerium oxide
journal, March 2015