An Accurate and Transferable Intermolecular Diatomic Hydrogen Potential for Condensed Phase Simulation-Reference-Cited by-同舟云学术

An Accurate and Transferable Intermolecular Diatomic Hydrogen Potential for Condensed Phase Simulation

Published:2008-07-17 Issue:8 Volume:4 Page:1332-1337
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Belof Jonathan L.¹,Stern Abraham C.¹,Space Brian¹

Affiliation:

1. Department of Chemistry, University of South Florida, 4202 East Fowler Avenue, CHE205, Tampa, Florida 33620-5250

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct800155q

Reference50 articles.

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2. Long, J. R., Alivisatos, A. P., Cohen, M. L., Frechet, J. M. J., Head-Gordon, M., Louie, S. G., Zettl, A., Richardson, T. J., Mao, S. S., Read, C., and Alkire, J.A Synergistic Approach to the Development of New Classes of Hydrogen Storage Materials, 2005; Department of Energy Hydrogen Program.http://www.hydrogen.energy.gov(accessed Mar 3, 2008).

3. Adsorption of Gases in Metal Organic Materials: Comparison of Simulations and Experiments

4. On the Mechanism of Hydrogen Storage in a Metal−Organic Framework Material

5. The equation of state of hydrogen from anab initiopotential surface

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