Mechanistic insight into the hydrazine decomposition on Rh(111): effect of reaction intermediate on catalytic activity

Mechanistic Insight into Catalytic Oxidation of Ammonia on Clean, O- and OH-Assisted Ir(1 1 1) Surfaces

(2013) Xiaoqing Lu et al.   ChemCatChem

Ethanoldecomposition on a Pd(110) surface: a density functional theory investigation

(2012) Wenyue Guo et al.   DALTON TRANSACTIONS

Formaldehyde oxidation on the Pt/TiO2(101) surface: A DFT investigation

(2012) Shaoren Li et al.   JOURNAL OF ORGANOMETALLIC CHEMISTRY

Theoretical Study on Hydrazine Chemisorption on Transition Metal Surfaces

(2012) Mohammad Kemal Agusta et al.   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Initial Hydrogenations of Pyridine on MoP(001): A Density Functional Study

(2012) Yang Li et al.   LANGMUIR

Theoretical analysis of the conversion mechanism of acetylene to ethylidyne on Pt(111)

(2012) Xiaoqing Lu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

First principles investigations of hydrazine adsorption conformations on Ni(111) surface

(2012) Mohammad Kemal Agusta et al.   SURFACE SCIENCE

Density functional theory investigations on the catalytic mechanisms of hydrazine decompositions on Ir(111)

(2011) Ping-Xia Zhang et al.   CATALYSIS TODAY

Methanol dehydrogenation on Rh(111): A density functional and microkinetic modeling study

(2011) Ruibin Jiang et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Dissociative Chemisorption of Hydrazine on an Fe{211} Surface

(2011) Hayley L. McKay et al.   Journal of Physical Chemistry C

Theoretical study of hydrazine adsorption on Pt(111): Anti or cis?

(2011) Mohammad Kemal Agusta et al.   SURFACE SCIENCE

Mechanism of the Ethylene Conversion to Ethylidyne on Rh(111): A Density Functional Investigation

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

Decomposition of Methanthiol on Pt(111): A Density Functional Investigation

(2010) Houyu Zhu et al.   LANGMUIR

Methylamine decomposition on nickel surfaces: A density functional theory study

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

Room-Temperature Hydrogen Generation from Hydrous Hydrazine for Chemical Hydrogen Storage

(2009) Sanjay Kumar Singh et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hydrazine (N2H4) adsorption on Ni(100) – Density functional theory investigation

(2009) Mohammad Kemal Agusta et al.   SURFACE SCIENCE

A quantitative determination of reaction mechanisms from density functional theory calculations: Fischer–Tropsch synthesis on flat and stepped cobalt surfaces

(2008) J CHENG et al.   JOURNAL OF CATALYSIS

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