[Pw_forum] Help for Calculating Organic Crystal Band Structure

[ANUP THOMAS]

Dear All

        I, Anup Thomas, a novice in this field of solid state structure
simulation. I would like to perform band structure calculations for some
organic crystals. In my limited knowledge i could not find any one using
Pwscf for organic crstals band structure. Would any one please let me know
Pwscf can simulate the data?

      I will appreciate very much if you can give me more advices.



-- 
Regards

Anup Thomas
SRF 7123
Computational Chemistry Lab of I and PC Division
Indian Institute of Chemical Technology
Hyderabad 500007
India


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For great is his love toward us, and the faithfulness of the Lord endures
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