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Chemical Science

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Edge Article

Ab initio molecular dynamics simulations of liquid water using high quality meta-GGA functionals

*
Corresponding authors
a
Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, USA
E-mail: thg@berkeley.edu
b
Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, USA
c
Departments of Chemistry, Bioengineering, Chemical and Biomolecular Engineering, University of California, Berkeley, USA
Chem. Sci., 2017, Advance Article

DOI: 10.1039/C6SC04711D
Received 22 Oct 2016, Accepted 24 Feb 2017
First published online 27 Feb 2017
This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.
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