[Wannier] Projections

Mark Mazar mazar83 at gmail.com
Fri May 21 01:11:52 CEST 2010


Hello,

I was wondering, is it possible to find wannier functions with bond
projections?

For example, one of the features of my system is a Ta-C bond. How can
I specify the projections in the *.win file in order to capture the
bonding behavior between these two atoms?

Thank you,

-- 
Mark Mazar
PhD Candidate in Materials Science
Chemical Engineering and Materials Science
University of Minnesota
Cell: (732)939-2898
Office: (612)624-3311



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