[DFTB-Plus-User] DFTB+ feature depreciation
Ben Hourahine
benjamin.hourahine at strath.ac.uk
Thu Nov 29 19:43:01 CET 2012
Hello everyone,
I'm in the process of revising the spin-orbit options for DFTB, and
considering whether dual
spin orbit should become the default method for this type of
calculation. I would like to find out
whether anyone is using spin orbit calculations at the moment, and if
they have an opinion
regarding this possible change.
Regards
Ben
--
Dr. B. Hourahine, SUPA, Department of Physics,
University of Strathclyde, John Anderson Building,
107 Rottenrow, Glasgow G4 0NG, UK.
+44 141 548 2325, benjamin.hourahine at strath.ac.uk
The University of Strathclyde is a charitable body,
registered in Scotland, with registration number SC015263
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