Dear wien2k users, There is a small bug in run_lapw for cases without inversion symmetry.Most likely not critical except when the default case.in1c file would produce a QTL-B error, which would not be fixed automatically.
A new version is attached and the web-version has been corrected (release 1.2.23)
Regards -- -------------------------------------------------------------------------- Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna Phone: +43-1-58801-165300 Email: peter.bl...@tuwien.ac.at WIEN2k: http://www.wien2k.at WWW: http://www.imc.tuwien.ac.at -------------------------------------------------------------------------
run_lapw.gz
Description: GNU Zip compressed data
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