[Wien] New mixer on big systems

[Laurence Marks]

Dear All,

Hopefully the new mixer (MSEC1) is a little better than the older one,
and the version introduced in 8.1 (with a dynamic scaling of the plane
waves) is a little better than the first version. Of course no
algorithm is perfect. I would be interested in feedback (perhaps
better to my private email), preferably good reports and for bigger
systems but I would also be interested in problem cases.

-- 
Laurence Marks
Department of Materials Science and Engineering
MSE Rm 2036 Cook Hall
2220 N Campus Drive
Northwestern University
Evanston, IL 60208, USA
Tel: (847) 491-3996 Fax: (847) 491-7820
email: L-marks at northwestern dot edu
Web: www.numis.northwestern.edu
Commission on Electron Diffraction of IUCR
www.numis.northwestern.edu/IUCR_CED