need help in VASP

Bader charge density analysis

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infocine
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Joined: Sat Mar 17, 2007 2:05 pm

need help in VASP

Post by infocine »

HELLO, i need help in the use of program of bader analysis, and i need somme example of file of charge density of any material because i need to create a data base of the charge density of maximum element in the VASP format(CHRCAR° who can exist for my project of study.
TANCK YOU
graeme
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Post by graeme »

Examples of CHGCAR files are on our Bader webpage:
http://theory.cm.utexas.edu/bader/
in the Examples section.
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