[Pw_forum] charge density map

Tram Bui trambui at u.boisestate.edu
Thu Sep 22 22:54:32 CEST 2011


Dear Everyone,
    I have done my charge density calculation and the contour maps for my
bulk SiC. I also see the scale based on the thermometer around each atom
(Si, C). But my questions is what should I focus on in order to help me
understand the charge density map ? what information can I get out of the
charge density contour maps?

Regards,

Tram Bui

M.S. Materials Science & Engineering
trambui at u.boisestate.edu
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