Effect of the components' interface on the synthesis of methanol over Cu/ZnO from CO2/H2: a microkinetic analysis based on DFT + U calculations

Quantification of Zinc Atoms in a Surface Alloy on Copper in an Industrial-Type Methanol Synthesis Catalyst

(2014) Sebastian Kuld et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Counting of Oxygen Defects versus Metal Surface Sites in Methanol Synthesis Catalysts by Different Probe Molecules

(2014) Matthias B. Fichtl et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Cu-Based Catalyst Resulting from a Cu,Zn,Al Hydrotalcite-Like Compound: A Microstructural, Thermoanalytical, and In Situ XAS Study

(2014) Stefanie Kühl et al.   CHEMISTRY-A EUROPEAN JOURNAL

Kinetic modeling of methanol synthesis over commercial catalysts based on three-site adsorption

(2014) Nonam Park et al.   FUEL PROCESSING TECHNOLOGY

Highly active copper-ceria and copper-ceria-titania catalysts for methanol synthesis from CO2

(2014) J. Graciani et al.   SCIENCE

The Role of the Oxide Component in the Development of Copper Composite Catalysts for Methanol Synthesis

(2013) Stefan Zander et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Chemical Activity of Thin Oxide Layers: Strong Interactions with the Support Yield a New Thin-Film Phase of ZnO

(2013) Vadim Schott et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

CO2 hydrogenation to methanol over Cu/ZnO nanocatalysts prepared via a chitosan-assisted co-precipitation method

(2013) Thongthai Witoon et al.   FUEL PROCESSING TECHNOLOGY

Study on the modification of Cu-based catalysts with cupric silicate for methanol synthesis from synthesis gas

(2013) Fang Wang et al.   FUEL PROCESSING TECHNOLOGY

H2S splitting on Cu(110): Insight from combined periodic density functional theory calculations and microkinetic simulation

(2013) Qian-Lin Tang   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Effects of oxide carriers on surface functionality and process performance of the Cu–ZnO system in the synthesis of methanol via CO2 hydrogenation

(2013) Francesco Arena et al.   JOURNAL OF CATALYSIS

Thermochemistry and micro-kinetic analysis of methanol synthesis on ZnO (0001)

(2013) Andrew J. Medford et al.   JOURNAL OF CATALYSIS

Adsorption of CO2 at ZnO: A Surface Structure Effect from DFT+U Calculations

(2013) Qian-Lin Tang et al.   Journal of Physical Chemistry C

Tuning the Reactivity of aCu/ZnONanocatalyst via Gas Phase Pressure

(2013) Luis Martínez-Suárez et al.   PHYSICAL REVIEW LETTERS

Methanol synthesis from CO2 hydrogenation over copper based catalysts

(2013) Hania Ahouari et al.   Reaction Kinetics Mechanisms and Catalysis

Adsorption and Deactivation Characteristics of Cu/ZnO-Based Catalysts for Methanol Synthesis from Carbon Dioxide

(2013) Sittichai Natesakhawat et al.   TOPICS IN CATALYSIS

New and revisited insights into the promotion of methanol synthesis catalysts by CO2

(2013) Oliver Martin et al.   Catalysis Science & Technology

Insights into the effect of surface hydroxyls on CO2 hydrogenation over Pd/γ-Al2O3 catalyst: A computational study

(2012) Riguang Zhang et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Can methanol be synthesized from CO by direct hydrogenation over Cu/ZnO catalysts?

(2012) Zhi-Jun Zuo et al.   APPLIED SURFACE SCIENCE

Methanol Synthesis

(2012) K. C. Waugh   CATALYSIS LETTERS

CO and CO2 Hydrogenation to Methanol Calculated Using the BEEF-vdW Functional

(2012) Felix Studt et al.   CATALYSIS LETTERS

Effect of the structural and morphological properties of Cu/ZnO catalysts prepared by citrate method on their activity toward methanol synthesis from CO2 and H2 under mild reaction conditions

(2012) Alejandro Karelovic et al.   CATALYSIS TODAY

Influence of Step Defects on the H2S Splitting on Copper Surfaces from First-Principles Microkinetic Modeling

(2012) Qian-Lin Tang et al.   Journal of Physical Chemistry C

Cu dimer formation mechanism on the ZnO(101¯0) surface

(2012) Matti Hellström et al.   PHYSICAL REVIEW B

Effect of Zr and pH in the preparation of Cu/ZnO catalysts for the methanol synthesis by CO2 hydrogenation

(2012) Heondo Jeong et al.   Reaction Kinetics Mechanisms and Catalysis

The Active Site of Methanol Synthesis over Cu/ZnO/Al2O3 Industrial Catalysts

(2012) M. Behrens et al.   SCIENCE

Active Sites and Structure–Activity Relationships of Copper-Based Catalysts for Carbon Dioxide Hydrogenation to Methanol

(2012) Sittichai Natesakhawat et al.   ACS Catalysis

Mixing Copper Nanoparticles and ZnO Nanocrystals: A Route towards Understanding the Hydrogenation of CO2 to Methanol?

(2011) Frederic C. Meunier   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Morphology-Dependent Interactions of ZnO with Cu Nanoparticles at the Materials’ Interface in Selective Hydrogenation of CO2 to CH3OH

(2011) Fenglin Liao et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Effect of promoter SiO2, TiO2 or SiO2-TiO2 on the performance of CuO-ZnO-Al2O3 catalyst for methanol synthesis from CO2 hydrogenation

(2011) Luxiang Zhang et al.   APPLIED CATALYSIS A-GENERAL

CO2 hydrogenation to methanol over Cu/ZnO/ZrO2 catalysts prepared via a route of solid-state reaction

(2011) Xiaoming Guo et al.   CATALYSIS COMMUNICATIONS

Recent advances in catalytic hydrogenation of carbon dioxide

(2011) Wei Wang et al.   CHEMICAL SOCIETY REVIEWS

Insight into methanol synthesis from CO2 hydrogenation on Cu(111): Complex reaction network and the effects of H2O

(2011) Ya-Fan Zhao et al.   JOURNAL OF CATALYSIS

Mechanism of Methanol Synthesis on Cu through CO2and CO Hydrogenation

(2011) L. C. Grabow et al.   ACS Catalysis

Identification of the Active Cu Phase in the Water−Gas Shift Reaction over Cu/ZrO2 from First Principles

(2010) Qian-Lin Tang et al.   Journal of Physical Chemistry C

(Non)formation of Methanol by Direct Hydrogenation of Formate on Copper Catalysts

(2010) Yong Yang et al.   Journal of Physical Chemistry C

Fundamental studies of methanol synthesis from CO2 hydrogenation on Cu(111), Cu clusters, and Cu/ZnO(0001̄)

(2010) Yixiong Yang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Modeling of the Kinetics for Methanol Synthesis using Cu/ZnO/Al2O3/ZrO2Catalyst: Influence of Carbon Dioxide during Hydrogenation

(2009) Hye-Won Lim et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

CO2 fixation into methanol at Cu/ZrO2 interface from first principles kinetic Monte Carlo

(2009) Qian-Lin Tang et al.   JOURNAL OF CATALYSIS

Copper Deposition and Growth over ZnO Nonpolar (101̅0) and (112̅0) Surfaces: A Density Functional Theory Study

(2009) Jia Hu et al.   Journal of Physical Chemistry C

Solid-state interactions, adsorption sites and functionality of Cu-ZnO/ZrO2 catalysts in the CO2 hydrogenation to CH3OH

(2008) Francesco Arena et al.   APPLIED CATALYSIS A-GENERAL

Carbon nanotube-supported Pd–ZnO catalyst for hydrogenation of CO2 to methanol

(2008) Xue-Lian Liang et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Correlations between synthesis, precursor, and catalyst structure and activity of a large set of CuO/ZnO/Al2O3 catalysts for methanol synthesis

(2008) C BALTES et al.   JOURNAL OF CATALYSIS

Electronic properties and stability of ZnO from computational study

(2008) Y. Azzaz et al.   PHYSICA B-CONDENSED MATTER

On the structural stability of ZnO phases

(2008) Jan Wróbel et al.   SOLID STATE COMMUNICATIONS

Preparation of mesoporous Cu/ZnO catalyst and its application in low-temperature methanol synthesis

(2007) Jun Bao et al.   CATALYSIS COMMUNICATIONS