[Wien] wien2wannier in WIEN2k_16

[Elias Assmann]

Dear wien2wannier users,

Please take note of the following *backward-incompatible changes* in
your favorite LAPW → MLWF interface:

 * The format of `case.inwplot' changed. Several outdated options have
   been removed, as has `write_inwplot'.  The new script
   `checkinwplot' converts old-style input files.  `x wplot' calls
   this script automatically, but to use a converted file, you must
   re-run `wplot':

      $ x wplot  # prints notification about converted file
      $ x wplot  # use converted file

 * In spin-polarized cases, `x w2w -up|-dn' now expects separate input
   files case.inwfup and case.inwfdn.  To re-run `w2w' in an existing
   directory, copy `case.inwf':

      $ cp -vi $(basename $PWD).inwf $(basename $PWD).inwfup \
        && mv -vi $(basename $PWD).inwf $(basename $PWD).inwfdn


This release incorporates a number of fixes and enhancements that have
accumulated since Wien2k 14.2.  For more details, see
https://git.io/w2w-NEWS-2.0 or the file $WIENROOT/SRC_w2w/NEWS.

Many of those changes were the direct result of users' feedback.  In
particular, I would like to thank Marc Höppner, Hong Jiang, Okan
Köksal, Gernot Kraberger, Laurence Marks, Oleg Rubel, Liang Si, Yundi
Quan, Ulrich Wedig, Jiaxu Yan, Jianxin Zhu, and Manuel Zingl for their
valuable comments on past versions.


	Elias Assmann

-- 
Elias Assmann

Wien2Wannier: maximally localized Wannier functions
              from linearized augmented plane waves

                     http://wien2wannier.github.io/
      https://github.com/wien2wannier/wien2wannier/

-------------- next part --------------
A non-text attachment was scrubbed...
Name: signature.asc
Type: application/pgp-signature
Size: 880 bytes
Desc: OpenPGP digital signature
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20161213/20686257/attachment.asc>