[Wannier] Reg. choice of inner and outer energy windows of Wannier-90 code

Soumyadeep soumyadeep at rrcat.gov.in
Wed Mar 20 13:01:08 CET 2019


Dear W90 experts,

      Is there any thumb rule to choose inner and outer energy windows 
initially for generating MLWF's? Generally I choose energy values near 
to Fermi level since my interest is on low energy properties. But I have 
no idea about outer energy window.

      Any help will be very much appreciable.

with best regards
Soumyadeep



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Soumyadeep Ghosh,
Senior Research Fellow,
Indus Synchrotrons Utilization Division,
Raja Ramanna Centre for Advanced Technology, Indore, India-452013
Mob: (+91)9424664553
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Email: soumyadeepghosh35 at gmail.com, soumyadeep at rrcat.gov.in
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