Metal Cluster Models for Heterogeneous Catalysis: A Matrix-Isolation Perspective

A coordination strategy to realize a sextuply-bonded complex

(2017) Yue Chen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Catalysis by Design: Well-Defined Single-Site Heterogeneous Catalysts

(2016) Jérémie D. A. Pelletier et al.   ACCOUNTS OF CHEMICAL RESEARCH

Reactivity of Metal Clusters

(2016) Zhixun Luo et al.   CHEMICAL REVIEWS

High-resolution photoelectron imaging spectroscopy of cryogenically cooled Fe4O− and Fe5O−

(2016) Marissa L. Weichman et al.   JOURNAL OF CHEMICAL PHYSICS

Carbon Dioxide Activation by Scandium Atoms and Scandium Monoxide Molecules: Formation and Spectroscopic Characterization of ScCO3 and OCScCO3 in Solid Neon

(2016) Qingnan Zhang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Relativistic Effects Break Periodicity in Group 6 Diatomic Molecules

(2016) Yi-Lei Wang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

The Surface Science of Catalysis and More, Using Ultrathin Oxide Films as Templates: A Perspective

(2016) Hans-Joachim Freund   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Low-energy excited states of divanadium: a matrix isolation and MRCI study

(2016) Olaf Hübner et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Experimental and theoretical identification of the Fe(vii) oxidation state in FeO4−

(2016) Jun-Bo Lu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

From surface science to catalysis: The importance of methoxy and formate species on Cu single crystals and industrial catalysts

(2016) M. Bowker et al.   SURFACE SCIENCE

Bridging the pressure gap: Can we get local quantitative structural information at ‘near-ambient’ pressures?

(2016) D.P. Woodruff   SURFACE SCIENCE

Catalytic Reaction Processes Revealed by Scanning Probe Microscopy

(2015) Peng Jiang et al.   ACCOUNTS OF CHEMICAL RESEARCH

The electronic structure of VO in its ground and electronically excited states: A combined matrix isolation and quantum chemical (MRCI) study

(2015) Olaf Hübner et al.   JOURNAL OF CHEMICAL PHYSICS

Structural evolution of small ruthenium cluster anions

(2015) Eugen Waldt et al.   JOURNAL OF CHEMICAL PHYSICS

Photoelectron spectra and structure of the Mnn− anions (n = 2–16)

(2015) G. L. Gutsev et al.   JOURNAL OF CHEMICAL PHYSICS

Modeling Adsorption and Reactions of Organic Molecules at Metal Surfaces

(2014) Wei Liu et al.   ACCOUNTS OF CHEMICAL RESEARCH

Platinum Group Metal Clusters: From Gas-Phase Structures and Reactivities towards Model Catalysts

(2014) Dan J. Harding et al.   CHEMISTRY-A EUROPEAN JOURNAL

Threshold ionization, structural isomers, and electronic states of M2O2(M = Sc, Y, and La)

(2014) Lu Wu et al.   JOURNAL OF CHEMICAL PHYSICS

A Combined Experimental and Theoretical Study of the Ti2 + N2O Reaction

(2014) A. Marzouk et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Size-Dependent Catalytic Activity of Supported Vanadium Oxide Species: Oxidative Dehydrogenation of Propane

(2014) Xavier Rozanska et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structural Isomers of Ti2O4 and Zr2O4 Anions Identified by Slow Photoelectron Velocity-Map Imaging Spectroscopy

(2014) Jongjin B. Kim et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Experimental and theoretical studies of H2O oxidation by neutral Ti2O4,5 clusters under visible light irradiation

(2014) Shi Yin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interface-Confined Oxide Nanostructures for Catalytic Oxidation Reactions

(2013) Qiang Fu et al.   ACCOUNTS OF CHEMICAL RESEARCH

Towards Realistic Surface Science Models of Heterogeneous Catalysts: Influence of Support Hydroxylation and Catalyst Preparation Method

(2013) Martin Sterrer et al.   CATALYSIS LETTERS

O-atom transport catalysis by neutral manganese oxide clusters in the gas phase: Reactions with CO, C2H4, NO2, and O2

(2013) Shi Yin et al.   JOURNAL OF CHEMICAL PHYSICS

An all-electron density functional theory study of the structure and properties of the neutral and singly charged M12 and M13 clusters: M = Sc–Zn

(2013) G. L. Gutsev et al.   JOURNAL OF CHEMICAL PHYSICS

C–Cl Activation by Group IV Metal Oxides in Solid Argon Matrixes: Matrix Isolation Infrared Spectroscopy and Theoretical Investigations of the Reactions of MOx (M = Ti, Zr; x = 1, 2) with CH3Cl

(2013) Yanying Zhao   JOURNAL OF PHYSICAL CHEMISTRY A

Reactions of Vanadium Dioxide Molecules with Acetylene: Infrared Spectra of VO2(η2-C2H2)x (x = 1, 2) and OV(OH)CCH in Solid Neon

(2013) Xiaojie Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Isomers and Electronic States of Ni2O2H2 and Evaluation of the Effect of Charge on the Electronic Properties and Reactivity of Ni2O2

(2013) Olaf Hübner et al.   JOURNAL OF PHYSICAL CHEMISTRY A

High-resolution anion photoelectron spectra of TiO2−, ZrO2−, and HfO2− obtained by slow electron velocity-map imaging

(2013) Jongjin B. Kim et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Matrix isolation infrared spectra, assignment and DFT investigation on reactions of iron and manganese monoxides with CH3Cl

(2013) Yanying Zhao et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Nanoparticles for Heterogeneous Catalysis: New Mechanistic Insights

(2012) Swetlana Schauermann et al.   ACCOUNTS OF CHEMICAL RESEARCH

Model Catalysts: Simulating the Complexities of Heterogeneous Catalysts

(2012) Feng Gao et al.   Annual Review of Physical Chemistry

Fundamental Studies of Well-Defined Surfaces of Mixed-Metal Oxides: Special Properties of MOx/TiO2(110) {M = V, Ru, Ce, or W}

(2012) Darío J. Stacchiola et al.   CHEMICAL REVIEWS

Main group coordination chemistry at low temperatures: A review of matrix isolated Group 12 to Group 18 complexes

(2012) Nigel A. Young   COORDINATION CHEMISTRY REVIEWS

Cyclic and Linear NiO2: A Multireference Configuration Interaction Study

(2012) Olaf Hübner et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Matrix Isolation Spectroscopic and Theoretical Study of Carbon Dioxide Activation by Titanium Oxide Molecules

(2012) Jia Zhuang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Structure characterization of metal oxide clusters by vibrational spectroscopy: possibilities and prospects

(2012) Knut R. Asmis   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Gas phase metal cluster model systems for heterogeneous catalysis

(2012) Sandra M. Lang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Catalysis Science of Bulk Mixed Oxides

(2012) Israel E. Wachs et al.   ACS Catalysis

Experimental and theoretical study of the reactions of iron and manganese oxides with dinitrogen in a cryogenic matrix

(2011) Zhang-Hui Lu et al.   CHEMICAL PHYSICS LETTERS

Optical absorption of small copper clusters in neon: Cun, (n = 1–9)

(2011) S. Lecoultre et al.   JOURNAL OF CHEMICAL PHYSICS

Intermediates of CO oxidation on iron oxides: An experimental and theoretical study

(2011) Zhang-Hui Lu et al.   JOURNAL OF CHEMICAL PHYSICS

UV–visible absorption of small gold clusters in neon: Aun (n = 1–5 and 7–9)

(2011) S. Lecoultre et al.   JOURNAL OF CHEMICAL PHYSICS

Ultraviolet-visible absorption of small silver clusters in neon: Agn (n = 1–9)

(2011) S. Lecoultre et al.   JOURNAL OF CHEMICAL PHYSICS

Carbon Dioxide Coordination and Activation by Niobium Oxide Molecules

(2011) Mingfei Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Titanium Oxide Complexes with Dinitrogen. Formation and Characterization of the Side-On and End-On Bonded Titanium Oxide–Dinitrogen Complexes in Solid Neon

(2011) Mingfei Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Matrix Isolation Infrared Spectroscopic and Theoretical Study of the Reactions of Tantalum Oxide Molecules with Methanol

(2011) Guanjun Wang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Matrix Isolation Spectroscopic and Theoretical Study of Water Adsorption and Hydrolysis on Molecular Tantalum and Niobium Oxides

(2011) Mingfei Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Vibrational Spectrum and Structure of CoO6: A Model Compound for Molecular Oxygen Reversible Binding on Cobalt Oxides and Salts; A Combined IR Matrix Isolation and Theoretical Study

(2011) Asma Marzouk et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Tuning Cluster Reactivity by Charge State and Composition: Experimental and Theoretical Investigation of CO Binding Energies to AgnAum+/−(n+m= 3)

(2011) Denisia M. Popolan et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Is rhodium tetroxide in the formal oxidation state VIII stable? a quantum chemical and matrix isolation investigation of rhodium oxides

(2011) Yu Gong et al.   THEORETICAL CHEMISTRY ACCOUNTS

Spontaneous Dihydrogen Activation by Neutral TaO4 Complex at Cryogenic Temperatures

(2010) Mingfei Zhou et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Infrared spectra of zinc and cadmium dioxide anions in solid neon

(2010) Yu Gong et al.   CHEMICAL PHYSICS LETTERS

Model Studies in Heterogeneous Catalysis

(2010) H.-J. Freund   CHEMISTRY-A EUROPEAN JOURNAL

Matrix Isolation Infrared Spectroscopic and Density Functional Theoretical Study of the Reactions of Scandium and Yttrium Monoxides with Monochloromethane

(2010) Yongfei Huang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Preparation and Characterization of the Agostic Bonding Molecules between Metal and Chlorine from the Reactions of Niobium and Tantalum Monoxide and Dioxide Molecules with Monochloromethane in Solid Argon

(2010) Yanying Zhao et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Tantalum Dioxide Complexes with Dinitrogen. Formation and Characterization of the Side-on and End-on Bonded TaO2(NN)x(x= 1−3) Complexes

(2010) Caixia Wang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Formation and Structure of Co2O4: A Combined IR Matrix Isolation and Theoretical Study

(2010) Sidi Ould Souvi et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Matrix Isolation Spectroscopic and Theoretical Study of Dihydrogen Activation by Group V Metal Dioxide Molecules

(2010) Mingfei Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Determining the size-dependent structure of ligand-free gold-cluster ions

(2010) D. Schooss et al.   PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES

MRCI investigation of different isomers of Ni2O2H2+

(2010) Olaf Hübner et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Small nickel clusters: Two low-lying Ni3 states

(2010) D. I. Davlyatshin et al.   Russian Journal of Physical Chemistry A

Formation and Characterization of the Iridium Tetroxide Molecule with Iridium in the Oxidation State +VIII

(2009) Yu Gong et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Spectroscopic and Theoretical Studies of Transition Metal Oxides and Dioxygen Complexes

(2009) Yu Gong et al.   CHEMICAL REVIEWS

Formation and Characterization of ZrO3 and HfO3 Molecules in Solid Argon

(2009) Yu Gong et al.   CHINESE JOURNAL OF CHEMICAL PHYSICS

Dinitrogen Activation by the Ti2N2Molecule: A Matrix Isolation Study

(2009) Laurent Manceron et al.   EUROPEAN JOURNAL OF INORGANIC CHEMISTRY

Gold dimer in neon: an absorption and fluorescence study

(2009) S. Lecoultre et al.   EUROPEAN PHYSICAL JOURNAL D

Pd2N2, a proteiform molecule: Matrix isolation spectroscopy and density functional theory calculations

(2009) S. M. Souvi et al.   JOURNAL OF CHEMICAL PHYSICS

The electronic spectrum of vanadium monoxide across the visible: New bands and new insight

(2009) W. Scott Hopkins et al.   JOURNAL OF CHEMICAL PHYSICS

Investigation of the reactions of small neutral iron oxide clusters with methanol

(2009) Yan Xie et al.   JOURNAL OF CHEMICAL PHYSICS

On the performance of the hybrid TPSS meta-GGA functional to study the singlet open-shell structures: A combined theoretical and experimental investigations of the Ni2O2 molecule

(2009) F. Allouti et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

Spectroscopic Characterization of a Copper(III) Trisuperoxide Complex Bearing Both Side-On and End-On Ligands

(2009) Yu Gong et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Infrared Spectra of Oxygen-Rich Yttrium and Lanthanum Dioxygen/Ozonide Complexes in Solid Argon

(2009) Yu Gong et al.   JOURNAL OF PHYSICAL CHEMISTRY A

MRCI investigation of Ni2O2 and Ni2O2+

(2009) Olaf Hübner et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Neon-matrix spectroscopic and theoretical studies of the reactivity of titanium dimer with diatomic ligands: comparison of reactions with nitrogen and carbon monoxide

(2009) S. M. Souvi et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Formation and characterization of the CuO5, CuO4 and CuO4− complexes in solid argon

(2009) Yu Gong et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

A prospective: Surface science and catalysis at the nanoscale

(2009) Michael Bowker   SURFACE SCIENCE

Bridging the Gap between Surface Science and Industrial Catalysis

(2008) Frederic C. Meunier   ACS Nano

Coordination of niobium and tantalum oxides by Ar, Xe and O2: Matrix isolation infrared spectroscopic and theoretical study of NbO2(Ng)2 (Ng=Ar, Xe) and MO4(X) (M=Nb, Ta; X=Ar, Xe, O2) in solid argon

(2008) Yanying Zhao et al.   CHEMICAL PHYSICS

A theoretical study of the electronic structure of the Co2O2 molecule

(2008) V. Staemmler et al.   CHEMICAL PHYSICS

Electronic absorption spectrum of titanium dioxide in neon matrices

(2008) I. Garkusha et al.   CHEMICAL PHYSICS

V4O10: Spectroscopic Fingerprint of a Well-Defined, Molecular Metaloxo Aggregate†

(2008) Christian Herwig et al.   INORGANIC CHEMISTRY

Probing the intermediates in the MO + CH4↔ M + CH3OH reactions by matrix isolation infrared spectroscopy

(2008) Guanjun Wang et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

Matrix Infrared Spectra and Density Functional Calculations of TiO3and TiO5in Solid Argon

(2008) Yu Gong et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Noble-Gas-Induced Disproportionation Reactions: Facile Superoxo-to-Peroxo Conversion on Chromium Dioxide

(2008) Yanying Zhao et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Is the FeO2−Anion Bent or Linear?

(2008) Zhen Hua Li et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Formation and Characterization of Two FeO3Isomers in Solid Argon

(2008) Yu Gong et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Formation and Characterization of Mononuclear and Dinuclear Manganese Oxide-Dioxygen Complexes in Solid Argon

(2008) Yu Gong et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Matrix Isolation Infrared Spectroscopic Studies and Density Functional Theory Calculations of the MNN, (MN)2(M = Y and La), and Y3NN Molecules

(2008) Yun-Lei Teng et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A Complete Reactant−Product Analysis of the Oxygen Transfer Reaction in [V4O11·C3H6]−: A Cluster Complex for Modeling Surface Activation and Reactivity

(2008) Shaohui Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Experimental and Theoretical Study of the Reactions between Small Neutral Iron Oxide Clusters and Carbon Monoxide

(2008) Wei Xue et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Structures of Neutral Au7, Au19, and Au20 Clusters in the Gas Phase

(2008) P. Gruene et al.   SCIENCE

Submillimeter-wave spectroscopy of VN (X3Δr) and VO (X4Σ−): A study of the hyperfine interactions

(2007) M.A. Flory et al.   JOURNAL OF MOLECULAR SPECTROSCOPY