Development and Validation of ReaxFF Reactive Force Field for Hydrocarbon Chemistry Catalyzed by Nickel

By J. Mueller, Adri C. T. van Duin, William A. Goddard III. 2010

342 citations recorded by the source corpus.

Subfields: Atmospheric Science, Atomic and Molecular Physics, and Optics, Materials Chemistry

View Paper: https://www.semanticscholar.org/paper/386aa0189dab4af7dc89bd78865b3bbb31cb9bbf

How researchers see this paper

The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.

In Atomic and Molecular Physics, and Optics

1. S Gowtham
2. Gregory M. Odegard

In Materials Chemistry

1. Jianying He
2. Gregory M. Odegard
3. Zhiliang Zhang

Citations in the corpus

• Predicting mechanical response of crosslinked epoxy using ReaxFF (2014, background): “The ReaxFF has been shown to accurately describe a wide range of carbon-based systems [10-20], including bulk polymer systems [21-23].”