Isobaric−Isothermal Molecular Dynamics Simulations Utilizing Density Functional Theory: An Assessment of the Structure and Density of Water at Near-Ambient Conditions
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| Description | scientific article published on 01 September 2009 |
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author: Christopher J. Mundy Joost VandeVondele Juerg Hutter |
| Publication date | September 1, 2009 |
| Language | English |
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