varadharajan.srinivasan at gmail.com
Sat Jun 6 10:48:02 CEST 2015
I was wondering if DFT+U+V option is available in the latest versions of
QE? I am testing this on some covalent systems. Also, is it possible to
calculate the V from linear response just like the U? If so, could anyone
point me to a good reference?
Asst. Prof., Chemistry
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