Eric Cancès et al 2008 Nonlinearity 21 T165 doi:10.1088/0951-7715/21/9/T03
Molecular simulation and related topics: some open mathematical problems
Eric Cancès1,2, C Le Bris1,2 and P-L Lions3,4
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This paper presents some open mathematical questions in molecular simulation and related topics. Molecular simulation is a broad field, of major practical interest, which has received little attention from the mathematical community for years. The situation is rapidly changing. We review here some mathematical questions that we find the most challenging ones among the many that remain unsolved.
- PACS
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31.15.ve Electron correlation calculations for atoms and ions: ground state
- MSC
- Subjects
- Dates
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Issue 9 (September 2008)
Received 19 May 2008, in final form 18 June 2008
Published 11 July 2008
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Molecular simulation and related topics: some open mathematical problems
Eric Cancès et al 2008 Nonlinearity 21 T165
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-
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-
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-
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-
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-
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-
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-
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-
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