[Pw_forum] Difference in implementation in matdyn.x between versions 4.2.1 and 5.0.0?
Paolo Giannozzi
giannozz at democritos.it
Fri Aug 17 11:07:24 CEST 2012
Try with v.5.0.1. Note the following in Doc/release-notes:
Fixed in 5.0.1 version
* Funny frequencies from matdyn.x if masses were read from file
P.
---
Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
More information about the users
mailing list