Basis-set optimization for first-principles simulation of liquid water.

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Bibliographic Details
Title: Basis-set optimization for first-principles simulation of liquid water.
Authors: Kumar, Santosh1 (AUTHOR), Schelling, Patrick K.1 (AUTHOR) pschell@mail.ucf.edu
Source: International Journal of Quantum Chemistry. 2007, Vol. 107 Issue 3, p556-566. 11p. 1 Diagram, 2 Charts, 8 Graphs.
Database: Academic Search Ultimate
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ISSN:00207608
DOI:10.1002/qua.21180