Exchange and Correlation – cause and effects
Matt Probert
Condensed Matter Dynamics Group Department of Physics, University of York, U.K.
http://www-users.york.ac.uk/~mijp1
To download the lecture click on the link below:
http://www-users.york.ac.uk/~mijp1/teaching/grad_FPMM/lecture_notes/lec9_xc.pdf
Condensed Matter Dynamics Group Department of Physics, University of York, U.K.
http://www-users.york.ac.uk/~mijp1
- What is Exchange? And correlation?
- LDA and GGA
- Van der Waals bonding
- Beyond GGA
- CASTEP details
- Examples
To download the lecture click on the link below:
http://www-users.york.ac.uk/~mijp1/teaching/grad_FPMM/lecture_notes/lec9_xc.pdf
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