Field-dependent chemisorption of carbon monoxide and nitric oxide on platinum-group (111) surfaces: Quantum chemical calculations compared with infrared spectroscopy at electrochemical and vacuum-based interfaces

Marc T. M. Koper; Rutger A. van Santen; Sally A. Wasileski; Michael J. Weaver

doi:10.1063/1.1288592

Field-dependent chemisorption of carbon monoxide and nitric oxide on platinum-group (111) surfaces: Quantum chemical calculations compared with infrared spectroscopy at electrochemical and vacuum-based interfaces

The Journal of Chemical Physics ◽

10.1063/1.1288592 ◽

2000 ◽

Vol 113 (10) ◽

pp. 4392-4407 ◽

Cited By ~ 113

Author(s):

Marc T. M. Koper ◽

Rutger A. van Santen ◽

Sally A. Wasileski ◽

Michael J. Weaver

Keyword(s):

Nitric Oxide ◽

Carbon Monoxide ◽

Infrared Spectroscopy ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Field Dependent ◽

Platinum Group

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Intermediates of Carbon Monoxide Oxidation on Praseodymium Monoxide Molecules: Insights from Matrix-Isolation IR Spectroscopy and Quantum-Chemical Calculations

Inorganic Chemistry ◽

10.1021/acs.inorgchem.0c03607 ◽

2021 ◽

Author(s):

Zhen Pu ◽

Jianwei Qin ◽

Bingyun Ao ◽

Haopeng Dong ◽

Maobing Shuai ◽

...

Keyword(s):

Carbon Monoxide ◽

Ir Spectroscopy ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Matrix Isolation ◽

Carbon Monoxide Oxidation

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Potential-dependent chemisorption of carbon monoxide on platinum electrodes: new insight from quantum-chemical calculations combined with vibrational spectroscopy

Journal of Electroanalytical Chemistry ◽

10.1016/s0022-0728(00)00420-4 ◽

2001 ◽

Vol 500 (1-2) ◽

pp. 344-355 ◽

Cited By ~ 42

Author(s):

Sally A. Wasileski ◽

Michael J. Weaver* ◽

Marc T.M. Koper*

Keyword(s):

Carbon Monoxide ◽

Quantum Chemical Calculations ◽

Vibrational Spectroscopy ◽

Quantum Chemical ◽

Platinum Electrodes

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Three different kinds of weak C-H⋯O=C inter- and intramolecular interactions in poly(ε-caprolactone) studied by using terahertz spectroscopy, infrared spectroscopy and quantum chemical calculations

Polymer ◽

10.1016/j.polymer.2018.01.025 ◽

2018 ◽

Vol 137 ◽

pp. 245-254 ◽

Cited By ~ 15

Author(s):

Chihiro Funaki ◽

Shigeki Yamamoto ◽

Hiromichi Hoshina ◽

Yukihiro Ozaki ◽

Harumi Sato

Keyword(s):

Infrared Spectroscopy ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Terahertz Spectroscopy ◽

Intramolecular Interactions

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Quantum Chemical Calculations and Experimental Evidence for O-Bonding of Carbon Monoxide to Alkali Metal Cations in Zeolites

The Journal of Physical Chemistry B ◽

10.1021/jp982078w ◽

1999 ◽

Vol 103 (23) ◽

pp. 4839-4846 ◽

Cited By ~ 46

Author(s):

P. Ugliengo ◽

E. Garrone ◽

A. M. Ferrari ◽

A. Zecchina ◽

C. Otero Areán

Keyword(s):

Carbon Monoxide ◽

Alkali Metal ◽

Experimental Evidence ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Metal Cations ◽

Alkali Metal Cations

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QUANTUM CHEMICAL STUDY OF CHEMISORPTION OF NITRIC OXIDE AND CARBON MONOXIDE ON ALUMINUM (111) SURFACE

10.31357/fapsmph.2006.00593 ◽

2006 ◽

Author(s):

G PARTHIBAN

Keyword(s):

Nitric Oxide ◽

Carbon Monoxide ◽

Quantum Chemical ◽

Quantum Chemical Study ◽

Chemical Study

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Hydrogen-bond structures in poly(2-hydroxyethyl methacrylate): Infrared spectroscopy and quantum chemical calculations with model compounds

Vibrational Spectroscopy ◽

10.1016/j.vibspec.2008.09.008 ◽

2009 ◽

Vol 51 (1) ◽

pp. 28-33 ◽

Cited By ~ 27

Author(s):

Shigeaki Morita ◽

Kuniyuki Kitagawa ◽

Yukihiro Ozaki

Keyword(s):

Hydrogen Bond ◽

Infrared Spectroscopy ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Hydroxyethyl Methacrylate ◽

Model Compounds

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Field-Dependent Chemisorption of Carbon Monoxide on Platinum-Group (111) Surfaces: Relationships between Binding Energetics, Geometries, and Vibrational Properties as Assessed by Density Functional Theory

The Journal of Physical Chemistry B ◽

10.1021/jp003263o ◽

2001 ◽

Vol 105 (17) ◽

pp. 3518-3530 ◽

Cited By ~ 68

Author(s):

Sally A. Wasileski ◽

Marc T. M. Koper ◽

Michael J. Weaver

Keyword(s):

Density Functional Theory ◽

Carbon Monoxide ◽

Density Functional ◽

Vibrational Properties ◽

Functional Theory ◽

Field Dependent ◽

Binding Energetics ◽

Platinum Group

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Matrix Infrared Spectroscopy and Quantum-Chemical Calculations for the Coinage-Metal Fluorides: Comparisons of ArAuF, NeAuF, and Molecules MF2and MF3

Chemistry - A European Journal ◽

10.1002/chem.201203306 ◽

2012 ◽

Vol 19 (4) ◽

pp. 1397-1409 ◽

Cited By ~ 50

Author(s):

Xuefeng Wang ◽

Lester Andrews ◽

Felix Brosi ◽

Sebastian Riedel

Keyword(s):

Infrared Spectroscopy ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Coinage Metal ◽

Metal Fluorides

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Infrared Spectroscopy of Mixed Nitric-Oxide−Carbon-Monoxide Adlayers on Ordered Iridium(111) in Aqueous Solution: A Model Study of Coadsorbate Vibrational Interactions

The Journal of Physical Chemistry B ◽

10.1021/jp982603r ◽

1998 ◽

Vol 102 (43) ◽

pp. 8546-8556 ◽

Cited By ~ 14

Author(s):

Catherine Tang ◽

Shouzhong Zou ◽

Mark W. Severson ◽

Michael J. Weaver

Keyword(s):

Nitric Oxide ◽

Aqueous Solution ◽

Carbon Monoxide ◽

Infrared Spectroscopy ◽

Model Study

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Coadsorbate vibrational interactions within mixed carbon monoxide-nitric oxide adlayers on ordered low-index platinum-group electrodes

Journal of Electroanalytical Chemistry ◽

10.1016/s0022-0728(98)00421-5 ◽

1999 ◽

Vol 467 (1-2) ◽

pp. 92-104 ◽

Cited By ~ 10

Author(s):

Catherine Tang ◽

Shouzhong Zou ◽

Si-Chung Chang ◽

Michael J Weaver

Keyword(s):

Nitric Oxide ◽

Carbon Monoxide ◽

Platinum Group

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