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by DrMcTaco
Thu Nov 21, 2013 6:56 pm
Forum: Ground state
Topic: Trying to calculate DOS for Ce4O8
Replies: 1
Views: 2526

Trying to calculate DOS for Ce4O8

I have finished working through the initial 4 tutorials, read the tutorial on PAW DOS calculations, and read the prtdos variable info. And I cannot seem to recreate the DOS. I am getting a bit confused with the prtdos variable. It indicates I need to make a self consistent then a non consistent calc...