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Finite Temperature DFT

This folder holds the following references to publications, sorted by year and author.

There are 2 references in this bibliography folder.


Alavi, A, Hu, P, Deutsch, T, Silvestrelli, PL, and Hutter, J (1998).
CO Oxidation on Pt(111): An Ab Initio Density Functional Theory Study
Physical Review Letters, 80(16):3650.


Alavi, A, Kohanoff, J, Parrinello, M, and Frenkel, D (1994).
Ab Initio Molecular Dynamics with Excited Electrons
Physical Review Letters, 73(19):2599.

 
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