For Band structure calculations, Can I use same KPOINTS for both bulk and surface?. If not, could you please tell me how to find KPOINTS for surface band structure calculations from bulk.
Thank you.
Band structure calcualtions
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sunny
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Band structure calcualtions
Last edited by sunny on Tue Feb 05, 2013 3:36 pm, edited 1 time in total.
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admin
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Band structure calcualtions
Have a look at discussions in older threads, e.g:
http://cms.mpi.univie.ac.at/vasp-forum/ ... php?3.5348
http://cms.mpi.univie.ac.at/vasp-forum/ ... php?3.5348
Last edited by admin on Tue Feb 05, 2013 4:49 pm, edited 1 time in total.