[Pw_forum] Orthogonalization of wave function in LDA+U calculations
Akmal Khan
khanakmal982 at gmail.com
Tue Nov 7 05:11:26 CET 2017
Dear QE users and experts,
What will be the effect on different results if the wave
functions are not orthogonalized and how we can achieve orthogonalization
in LDA+U calculation.
Thank you,
A.Khan
M.phil Research Student
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