[Wien] Calculations at moderate T

Laurence Marks L-marks at northwestern.edu
Tue Apr 9 19:38:10 CEST 2013


Does anyone know of methods to do calculations at T~1200K taking
account of bulk thermal expansion? I am interested in a surface
calculation where I suspect that it may be important to consider this,
and a moderately rational approach to doing this that has been
tested/published would be useful.

-- 
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu 1-847-491-3996
"Research is to see what everybody else has seen, and to think what
nobody else has thought"
Albert Szent-Gyorgi


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