[Wannier] Initial guesses in projection block of .win file to generate Maximally localized wannier functions(MLWF)?
Soumyadeep
soumyadeep at rrcat.gov.in
Mon Mar 4 05:45:52 CET 2019
Dear All,
Is there any thumb rule to take initial guesses for defining
projection block of wannier-90 input file which generates MLWF's? How
could I ensure that generated WF's are maximally localized from *.wout
file?
with best regards
Soumyadeep
-------------------------------------------------------------------
Soumyadeep Ghosh,
Senior Research Fellow,
Indus Synchrotrons Utilization Division,
Raja Ramanna Centre for Advanced Technology, Indore, India-452013
Mob: (+91)9424664553
User Lab: 0731244-2580
Email: soumyadeepghosh35 at gmail.com, soumyadeep at rrcat.gov.in
-------------------------------------------------------------------
More information about the Wannier
mailing list