Concepedia

CatMAP: A Software Package for Descriptor-Based Microkinetic Mapping of Catalytic Trends

Andrew J. Medford, Chuan Shi, Max J. Hoffmann, Adam C. Lausche, Sean Fitzgibbon, Thomas Bligaard, Jens K. Nørskov

Catalysis Letters · 2015 · 502 citations · 50 references

DOI

Concepts

References

50

Origin of the Overpotential for Oxygen Reduction at a Fuel-Cell Cathode

Jens K. Nørskov, Jan Rossmeisl, Á. Logadóttir et al. · The Journal of Physical Chemistry B · 2004 · 12.7K citations

, , +17

Improved adsorption energetics within density-functional theory using revised Perdew-Burke-Ernzerhof functionals

Bjørk Hammer, L. B. Hansen, Jens K. Nørskov · Physical review. B, Condensed matter · 1999 · 8.2K citations · Full text

, , +17

A generalized inverse for matrices

Roger Penrose · Mathematical Proceedings of the Cambridge Philosophical Society · 1955 · 4.5K citations · Full text

, , +12

Computational high-throughput screening of electrocatalytic materials for hydrogen evolution

Jeff Greeley, Thomas F. Jaramillo, Jacob Bonde et al. · Nature Materials · 2006 · 4.1K citations

, , +16

Why gold is the noblest of all the metals

Bjørk Hammer · Nature · 1995 · 3.8K citations

, , +6