[Wien] Born charges with hybrids?

Laurence Marks laurence.marks at gmail.com
Mon Aug 10 23:00:10 CEST 2020


Has anyone run across calculations of Born charges using hybrids (e.g.
HSE)? Maybe they are buried somewhere, or this is just not an area people
have worked on....

(N.B., I do not mean Born charge calculations with Wien2k & hybrids.)

-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
Corrosion in 4D: www.numis.northwestern.edu/MURI
Co-Editor, Acta Cryst A
"Research is to see what everybody else has seen, and to think what nobody
else has thought"
Albert Szent-Gyorgi
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