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by michel.roger
Fri Sep 06, 2013 5:25 pm
Forum: Ground state
Topic: Projected DOS not normalized
Replies: 2
Views: 4553

Re: Projected DOS not normalized

I am a beginner in abinit. I have the same normalisation problem of the projected DOS on Co sites in Na0.5CoO2, with prtdos=3 pawprtdos=1 or pawprtdos=0 Coming back to the test program tpaw1_4.in in section 4 of the PAW1 tutorial The projected DOS is correct after running the program sequentially. W...