Dear Jeff, Thanks for the explanation and for your time. What you have explained is true to understand PDOS. But, I need "projected-Bandstructure" not projected-DOS.
For your information: For each L there is information inside the PDOS files (i.e. #atm files) for each 'm' value. The last 3 coloumns if l=1 i.e. for p-orbitals. Thank you once again for your time, Sincerely, Sharma. ******************************************************** *Chaitanya Sharma,* *Prof. Pati'*s group, Chemistry and Physics Materials unit, JNCASR, BANGLORE, Lab:: (080-2208) 2581, 2809 https://sites.google.com/site/sharmasrkcyamijala/ ********************************************************* On Mon, Sep 14, 2015 at 3:28 PM, Sharma SRK Chaitanya Yamijala < [email protected]> wrote: > Dear all, > > Can some one guide me on how to achieve orbital projected band structure. > I have seen projwfc.x and I only k-resolved dos. > > Thanking you for your help, > Sincerely, > Sharma. > > > > > > > > ******************************************************** > *Chaitanya Sharma,* > *Prof. Pati'*s group, > Chemistry and Physics Materials unit, > JNCASR, BANGLORE, > Lab:: (080-2208) 2581, 2809 > https://sites.google.com/site/sharmasrkcyamijala/ > ********************************************************* >
_______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
