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Andrew G. Taube
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I am currently working as a post-doctoral fellow in the Multiscale Dynamic Materials Modeling group at Sandia National Laboratories in Albuquerque, NM.  Among other projects, I am working on combining coupled-cluster theory and molecular dynamics.  I received my Ph.D. in physical chemistry from the University of Florida working with Professor Rodney J. Bartlett on high-level electronic structure methods, in particular improved coupled-cluster theory for potential energy surfaces and gradients.

My general interests are on improving high-level electronic structure methods and using those methods in areas of computational science where they have not been used before, e.g. molecular dynamics and solids.

Please feel free to contact with any questions or for a copy of my cv.

2008 - present: John von Neumann Post-doctoral Research Fellow in Computational Science, Sandia National Laboratories
2003 - 2008: Ph. D., Physical Chemistry, Quantum Theory Project, University of Florida
1999 - 2003: B.S., Chemistry and Mathematics, Duke University
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Andrew


Contact
email:
Phone: (505) 845-7897
Fax: (505) 845-7442
mailing address:
P.O. Box 5800
MS-1322
Albuquerque, NM 87185


Related Links
Sandia CCIM

Sandia Multiscale Modeling

Sandia CSRI