Density functional theory study ofp-chloroaniline adsorption on Pd surfaces and clusters

Size-Dependent Halogenated Nitrobenzene Hydrogenation Selectivity of Pd Nanoparticles

(2014) Jinghui Lyu et al.   Journal of Physical Chemistry C

A theoretical study of the effects of transition metal dopants on the adsorption and dissociation of hydrogen on nickel clusters

(2013) Natarajan Sathiyamoorthy Venkataramanan et al.   INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY

Brønsted–Evans–Polanyi Relations for H2O2 Synthesis on Gold Surfaces

(2012) Yao-guang Wang et al.   CATALYSIS LETTERS

The role of water in the adsorption of oxygenated aromatics on Pt and Pd

(2012) Jin Yang et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Adsorption of Dichlorobenzene on Au and Pt Stepped Surfaces Using van der Waals Density Functional Theory

(2012) Rengin Peköz et al.   Journal of Physical Chemistry C

The effect of CNTs on structures and catalytic properties of AuPd clusters for H2O2 synthesis

(2012) Hua-feng Yang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effect of carbonaceous supports on the Pd-catalyzed aqueous-phase trichloroethylene hydrodechlorination

(2011) Eva Díaz et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Highly selective hydrogenation of 3,4-dichloronitrobenzene over Pd/C catalysts without inhibitors

(2011) Lei Ma et al.   CATALYSIS TODAY

Selectivity difference between hydrogenation of acetophenone over CNTs and ACs supported Pd catalysts

(2011) Yi-zhi Xiang et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL

Quantum chemical studies on structure of 1-3-dibromo-5-chlorobenzene

(2011) M. Arivazhagan et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Binding of polycyclic aromatic hydrocarbons and graphene dimers in density functional theory

(2010) Svetla D Chakarova-Käck et al.   NEW JOURNAL OF PHYSICS

Selective hydrogenation of chloronitrobenzene to chloroaniline in supercritical carbon dioxide over Ni/TiO2: Significance of molecular interactions

(2009) Xiangchun Meng et al.   JOURNAL OF CATALYSIS

Charge redistribution in core-shell nanoparticles to promote oxygen reduction

(2009) Wenjie Tang et al.   JOURNAL OF CHEMICAL PHYSICS

A DFT Study of the Adhesion of Pd Clusters on ZnO SWNTs and Adsorption of Gas Molecules on Pd/ZnO SWNTs

(2009) Yan Su et al.   Journal of Physical Chemistry C

Linear-scaling self-consistent implementation of the van der Waals density functional

(2009) Andris Gulans et al.   PHYSICAL REVIEW B

Clean production of chloroanilines by selective gas phase hydrogenation over supported Ni catalysts

(2007) Fernando Cárdenas-Lizana et al.   APPLIED CATALYSIS A-GENERAL

Polysugar-Stabilized Pd Nanoparticles Exhibiting High Catalytic Activities for Hydrodechlorination of Environmentally Deleterious Trichloroethylene

(2007) Liu et al.   LANGMUIR