Decomposition of Ethanol Over Ru(0001): A DFT Study

Production of levulinic acid from cellulose by hydrothermal decomposition combined with aqueous phase dehydration with a solid acid catalyst

(2012) Ronen Weingarten et al.   Energy & Environmental Science

A perspective on the modeling of biomass processing

(2012) Na Guo et al.   Energy & Environmental Science

Comment on “Towards understanding the bifunctional hydrodeoxygenation and aqueous phase reforming of glycerol” [J. Catal. 269 (2010) 411–420]

(2012) Duygu Basaran et al.   JOURNAL OF CATALYSIS

Density Functional Theory Study of Selectivity Considerations for C–C Versus C–O Bond Scission in Glycerol Decomposition on Pt(111)

(2012) Bin Liu et al.   TOPICS IN CATALYSIS

Understanding of ethanol decomposition on Rh(111) from density functional theory and kinetic Monte Carlo simulations

(2011) YongMan Choi et al.   CATALYSIS TODAY

Transformations of biomass-derived platform molecules: from high added-value chemicals to fuels via aqueous-phase processing

(2011) Juan Carlos Serrano-Ruiz et al.   CHEMICAL SOCIETY REVIEWS

Decomposition of ethylene on transition metal surfaces M(111). A comparative DFT study of model reactions for M=Pd, Pt, Rh, Ni

(2011) Duygu Basaran et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Decomposition Pathways of Glycerol via C–H, O–H, and C–C Bond Scission on Pt(111): A Density Functional Theory Study

(2011) Bin Liu et al.   Journal of Physical Chemistry C

Density Functional Theory Studies of Ethanol Decomposition on Rh(211)

(2011) Jia Zhang et al.   Journal of Physical Chemistry C

Chemocatalytic conversion of cellulose: opportunities, advances and pitfalls

(2011) Jan A. Geboers et al.   Catalysis Science & Technology

Recent Advances in the Catalytic Conversion of Cellulose

(2010) Stijn Van de Vyver et al.   ChemCatChem

Catalytic conversion of biomass to biofuels

(2010) David Martin Alonso et al.   GREEN CHEMISTRY

Towards understanding the bifunctional hydrodeoxygenation and aqueous phase reforming of glycerol

(2010) A. Wawrzetz et al.   JOURNAL OF CATALYSIS

CO activation pathways and the mechanism of Fischer–Tropsch synthesis

(2010) Manuel Ojeda et al.   JOURNAL OF CATALYSIS

Transformations of Ethylene on the Pd(111) Surface: A Density Functional Study

(2010) Zhao-Xu Chen et al.   Journal of Physical Chemistry C

Kinetically Relevant Steps and H2/D2 Isotope Effects in Fischer−Tropsch Synthesis on Fe and Co Catalysts

(2010) Manuel Ojeda et al.   Journal of Physical Chemistry C

Density Functional Study of Ethanol Decomposition on Rh(111)

(2010) Ming Li et al.   Journal of Physical Chemistry C

Ethylidyne Formation from Ethylene over Pt(111): A Mechanistic Study from First-Principle Calculations

(2010) Zhi-Jian Zhao et al.   Journal of Physical Chemistry C

Reactivity of the Gold/Water Interface During Selective Oxidation Catalysis

(2010) B. N. Zope et al.   SCIENCE

Partial and complete reduction of O2 by hydrogen on transition metal surfaces

(2010) Denise C. Ford et al.   SURFACE SCIENCE

Density Functional Theory Study of the CO Insertion Mechanism for Fischer−Tropsch Synthesis over Co Catalysts

(2009) Mingkun Zhuo et al.   Journal of Physical Chemistry C

Ethylene Conversion to Ethylidyne over Pd(111): Revisiting the Mechanism with First-Principles Calculations

(2009) Lyudmila V. Moskaleva et al.   Journal of Physical Chemistry C

Ethylidyne Formation from Ethylene over Pd(111): Alternative Routes from a Density Functional Study

(2009) Lyudmila V. Moskaleva et al.   Journal of Physical Chemistry C

Direct versus Hydrogen-Assisted CO Dissociation

(2009) Sharan Shetty et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Modeling Ethanol Decomposition on Transition Metals: A Combined Application of Scaling and Brønsted−Evans−Polanyi Relations

(2009) P. Ferrin et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Decomposition of Ethanol on Pd(111): A Density Functional Theory Study

(2009) Ming Li et al.   LANGMUIR

CO Dissociation on the Ru(112̅1) Surface

(2008) S. Shetty et al.   Journal of Physical Chemistry C

Fischer−Tropsch Mechanism Revisited:  Alternative Pathways for the Production of Higher Hydrocarbons from Synthesis Gas

(2008) Oliver R. Inderwildi et al.   Journal of Physical Chemistry C

How the C−O Bond Breaks during Methanol Decomposition on Nanocrystallites of Palladium Catalysts

(2008) Ilya V. Yudanov et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY