4.6 Article

A theoretical evaluation of possible transition metal electro-catalysts for N-2 reduction

Related references

Note: Only part of the references are listed.
Article Engineering, Chemical

Scaling relationships for adsorption energies of C2 hydrocarbons on transition metal surfaces

Glenn Jones et al.

CHEMICAL ENGINEERING SCIENCE (2011)

Article Chemistry, Physical

Universal transition state scaling relations for (de)hydrogenation over transition metals

S. Wang et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)

Article Electrochemistry

The oxygen reduction reaction mechanism on Pt(111) from density functional theory calculations

Vladimir Tripkovic et al.

ELECTROCHIMICA ACTA (2010)

Article Chemistry, Multidisciplinary

How copper catalyzes the electroreduction of carbon dioxide into hydrocarbon fuels

Andrew A. Peterson et al.

ENERGY & ENVIRONMENTAL SCIENCE (2010)

Article Chemistry, Physical

Electrochemical chlorine evolution at rutile oxide (110) surfaces

Heine A. Hansen et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)

Review Chemistry, Multidisciplinary

Climbing Nitrogenase: Toward a Mechanism of Enzymatic Nitrogen Fixation

Brian M. Hoffman et al.

ACCOUNTS OF CHEMICAL RESEARCH (2009)

Review Chemistry, Multidisciplinary

Reactions at surfaces: From atoms to complexity (Nobel lecture)

Gerhard Ertl

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2008)

Article Chemistry, Analytical

Electrolysis of water on oxide surfaces

J. Rossmeisl et al.

JOURNAL OF ELECTROANALYTICAL CHEMISTRY (2007)

Article Physics, Multidisciplinary

Scaling properties of adsorption energies for hydrogen-containing molecules on transition-metal surfaces

F. Abild-Pedersen et al.

PHYSICAL REVIEW LETTERS (2007)

Article Chemistry, Physical

Estimations of electric field effects on the oxygen reduction reaction based on the density functional theory

G. S. Karlberg et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

Calculated phase diagrams for the electrochemical oxidation and reduction of water over Pt(111)

Jan Rossmeisl et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2006)

Review Chemistry, Physical

Predicting catalysis:: Understanding ammonia synthesis from first-principles calculations

A. Hellman et al.

JOURNAL OF PHYSICAL CHEMISTRY B (2006)

Article Chemistry, Physical

Water bilayer on the Pd/Au(111) overlayer system: Coadsorption and electric field effects

A Roudgar et al.

CHEMICAL PHYSICS LETTERS (2005)

Article Multidisciplinary Sciences

Ammonia synthesis from first-principles calculations

K Honkala et al.

SCIENCE (2005)

Article Chemistry, Physical

Ammonia synthesis over a Ru(0001) surface studied by density functional calculations

A Logadóttir et al.

JOURNAL OF CATALYSIS (2003)

Article Chemistry, Physical

Methanol at the water-platinum interface studied by ab initio molecular dynamics

TR Mattsson et al.

SURFACE SCIENCE (2003)

Article Multidisciplinary Sciences

Catalytic reduction of dinitrogen to ammonia at a single molybdenum center

DV Yandulov et al.

SCIENCE (2003)

Article Chemistry, Multidisciplinary

Electrolytic synthesis of ammonia in molten salts under atmospheric pressure

T Murakami et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2003)

Review Chemistry, Multidisciplinary

Catalytic synthesis of ammonia - A never-ending story?

R Schlogl

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2003)

Article Chemistry, Multidisciplinary

Modeling the nitrogenase FeMo cofactor

TH Rod et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2000)

Article Chemistry, Physical

Synthesis of ammonia at atmospheric pressure with the use of solid state proton conductors

G Marnellos et al.

JOURNAL OF CATALYSIS (2000)

Article Chemistry, Physical

Ammonia synthesis at low temperatures

TH Rod et al.

JOURNAL OF CHEMICAL PHYSICS (2000)