Direct n-octanol amination by ammonia on supported Ni and Pd catalysts: activity is enhanced by “spectator” ammonia adsorbates

Towards more accurate prediction of activation energies for polyalcohol dehydrogenation on transition metal catalysts in water

(2016) Jérémie Zaffran et al.   Catalysis Science & Technology

Substitution of alcohols by N-nucleophiles via transition metal-catalyzed dehydrogenation

(2015) Qin Yang et al.   CHEMICAL SOCIETY REVIEWS

Trade-Off between Accuracy and Universality in Linear Energy Relations for Alcohol Dehydrogenation on Transition Metals

(2015) Jérémie Zaffran et al.   Journal of Physical Chemistry C

Density Functional Theory Comparison of Methanol Decomposition and Reverse Reactions on Metal Surfaces

(2015) Rodrigo Garcı́a-Muelas et al.   ACS Catalysis

Heterogeneous catalysis for the direct synthesis of chemicals by borrowing hydrogen methodology

(2015) Ken-ichi Shimizu   Catalysis Science & Technology

Redox Properties of CeO2at Low Temperature: The Direct Synthesis of Imines from Alcohol and Amine

(2014) Masazumi Tamura et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Reinvestigating Raney nickel mediated selective alkylation of amines with alcohols via hydrogen autotransfer methodology

(2014) Astha Mehta et al.   APPLIED CATALYSIS A-GENERAL

Role of water in metal catalyst performance for ketone hydrogenation: a joint experimental and theoretical study on levulinic acid conversion into gamma-valerolactone

(2014) Carine Michel et al.   CHEMICAL COMMUNICATIONS

Catalytic Amination of Biomass-Based Alcohols

(2014) Marc Pera-Titus et al.   ChemSusChem

Following Molecules through Reactive Networks: Surface Catalyzed Decomposition of Methanol on Pd(111), Pt(111), and Ni(111)

(2014) Zeb C. Kramer et al.   Journal of Physical Chemistry C

Theoretical study of the adsorption and dissociation mechanism for methylamine on Pd(111)

(2013) Jian-Hong Liu et al.   APPLIED SURFACE SCIENCE

Clean borrowing hydrogen methodology using hydrotalcite supported copper catalyst

(2013) Manish Dixit et al.   CATALYSIS COMMUNICATIONS

N-alkylation of ammonia and amines with alcohols catalyzed by Ni-loaded CaSiO3

(2013) Ken-ichi Shimizu et al.   CATALYSIS TODAY

Development of a General Non-Noble Metal Catalyst for the Benign Amination of Alcohols with Amines and Ammonia

(2013) Xinjiang Cui et al.   CHEMISTRY-A EUROPEAN JOURNAL

Tuning catalytic reactivity on metal surfaces: Insights from DFT

(2013) David Loffreda et al.   JOURNAL OF CATALYSIS

Applications of Acceptorless Dehydrogenation and Related Transformations in Chemical Synthesis

(2013) C. Gunanathan et al.   SCIENCE

Heterogeneous Ni Catalysts for N-Alkylation of Amines with Alcohols

(2013) Ken-ichi Shimizu et al.   ACS Catalysis

N-Alkylation of amines through hydrogen borrowing over a heterogeneous Cu catalyst

(2013) Federica Santoro et al.   RSC Advances

Reductive amination of 2-propanol to monoisopropylamine over Co/γ-Al2O3 catalysts

(2012) Jun Hee Cho et al.   APPLIED CATALYSIS A-GENERAL

Ni–Cu/γ-Al2O3 catalyzed N-alkylation of amines with alcohols

(2012) Jian Sun et al.   CATALYSIS COMMUNICATIONS

Reductive Amination of Ketones or Amination of Alcohols over Heterogeneous Cu Catalysts: Matching the Catalyst Support with the N-Alkylating Agent

(2012) Federica Santoro et al.   ChemCatChem

A first principles analysis of the hydrogenation of C1C4 aldehydes and ketones over Ru(0001)

(2012) Nishant K. Sinha et al.   JOURNAL OF CATALYSIS

Solvent effects in the hydrogenation of 2-butanone

(2012) B.S. Akpa et al.   JOURNAL OF CATALYSIS

Influence of Step Defects on Methanol Decomposition: Periodic Density Functional Studies on Pd(211) and Kinetic Monte Carlo Simulations

(2012) Sen Lin et al.   Journal of Physical Chemistry C

Early stages of water/hydroxyl phase generation at transition metal surfaces – synergetic adsorption and O–H bond dissociation assistance

(2012) Carine Michel et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Heterogeneous Ni Catalyst for Direct Synthesis of Primary Amines from Alcohols and Ammonia

(2012) Ken-ichi Shimizu et al.   ACS Catalysis

Catalytic Amination of Octanol for Synthesis of Trioctylamine and Catalyst Characterization

(2011) Yunling Li et al.   CATALYSIS LETTERS

The Catalytic Amination of Alcohols

(2011) Sebastian Bähn et al.   ChemCatChem

Unravelling the Mechanism of Glycerol Hydrogenolysis over Rhodium Catalyst through Combined Experimental-Theoretical Investigations

(2011) Florian Auneau et al.   CHEMISTRY-A EUROPEAN JOURNAL

The Rate-Determining Step is Dead. Long Live the Rate-Determining State!

(2011) Sebastian Kozuch et al.   CHEMPHYSCHEM

Comprehensive Benchmarking of a Density-Dependent Dispersion Correction

(2011) Stephan N. Steinmann et al.   Journal of Chemical Theory and Computation

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

C–H versus O–H Bond Dissociation for Alcohols on a Rh(111) Surface: A Strong Assistance from Hydrogen Bonded Neighbors

(2011) Carine Michel et al.   ACS Catalysis

Silver cluster-promoted heterogeneous copper catalyst for N-alkylation of amines with alcohols

(2011) Ken-ichi Shimizu et al.   RSC Advances

Catalytic Organometallic Reactions of Ammonia

(2010) Jessica L. Klinkenberg et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Selective Synthesis of Secondary Amines via N-Alkylation of Primary Amines and Ammonia with Alcohols by Supported Copper Hydroxide Catalysts

(2010) Jinling He et al.   CHEMISTRY LETTERS

The “Borrowing Hydrogen Strategy” by Supported Ruthenium Hydroxide Catalysts: Synthetic Scope of Symmetrically and Unsymmetrically Substituted Amines

(2010) Kazuya Yamaguchi et al.   CHEMISTRY-A EUROPEAN JOURNAL

Density Functional Study of Ethanol Decomposition on Rh(111)

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

Methylamine decomposition on nickel surfaces: A density functional theory study

(2010) Cun-Qin Lv et al.   SURFACE SCIENCE

Hydrogen Autotransfer in theN-Alkylation of Amines and Related Compounds using Alcohols and Amines as Electrophiles

(2009) Gabriela Guillena et al.   CHEMICAL REVIEWS

Dehydrogenation as a Substrate-Activating Strategy in Homogeneous Transition-Metal Catalysis

(2009) Graham E. Dobereiner et al.   CHEMICAL REVIEWS

Amination of Alcohols Catalyzed by Copper-Aluminium Hydrotalcite: A Green Synthesis of Amines

(2009) Pravin R. Likhar et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

Mechanism of Ethanol Reforming: Theoretical Foundations

(2009) Jeng-Han Wang et al.   Journal of Physical Chemistry C

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

(2009) Ming Li et al.   LANGMUIR

Transition metal catalysed reactions of alcohols using borrowing hydrogen methodology

(2008) Tracy D. Nixon et al.   DALTON TRANSACTIONS

Comprehensive Mechanism and Structure-Sensitivity of Ethanol Oxidation on Platinum: New Transition-State Searching Method for Resolving the Complex Reaction Network

(2008) Hui-Fang Wang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY