[Wien] Version 7.1
Peter Blaha
pblaha at theochem.tuwien.ac.at
Fri Jan 26 21:18:43 CET 2007
Dear WIEN2k users,
A new version, WIEN2k_07.1 is ready for download.
Highlights:
batch-mode for init_lapw;
hybrid-methods for correlated electrons (may replace LDA+U)
SRC_lapw0: fixes for charged cells, electric field, speedup
SRC_lapwdm: more accurate orbital and dipolar hyperfine fields
SRC_lcore: increased precision in printout. Much more stable (in
particular for heavier elements), but may change :ENE in comparison to
previous versions
Please see the update page of www.wien2k.at for details.
Thanks to all contributions
Best regards
PS: Since a new year has started a reminder: Please submit your papers
where WIEN2k was used into our website at http://www.wien2k.at/papers
More information about the Wien
mailing list