[XtalOpt-devel] [dlonie/XtalOpt] 846639: Added a VASP optimization scheme for XtalOpt.

noreply at github.com noreply at github.com
Tue Jun 22 08:31:03 PDT 2010


Branch: refs/heads/master
Home:   https://github.com/dlonie/XtalOpt

Commit: 846639fbc60ba3696d2a04de5826e83f19005dd8
    https://github.com/dlonie/XtalOpt/commit/846639fbc60ba3696d2a04de5826e83f19005dd8
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A samples/vasp-xtalopt.scheme

Log Message:
-----------
Added a VASP optimization scheme for XtalOpt.


Commit: c5534949ac848c42a9901bfafa24ac506d516080
    https://github.com/dlonie/XtalOpt/commit/c5534949ac848c42a9901bfafa24ac506d516080
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  M Doxyfile

Log Message:
-----------
Changes to the doxyfile


Commit: 02fd3a1d93f34aa565ab67c88803a2527fd8b8c2
    https://github.com/dlonie/XtalOpt/commit/02fd3a1d93f34aa565ab67c88803a2527fd8b8c2
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A samples/pwscf-xtalopt.scheme

Log Message:
-----------
Added a PWscf optimization scheme for XtalOpt.


Commit: 8a8d6c71166603ab6ae094b698b4ae56b15f6689
    https://github.com/dlonie/XtalOpt/commit/8a8d6c71166603ab6ae094b698b4ae56b15f6689
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A docs/images/cell-init.png
  A docs/images/opt-set.png
  A docs/images/opt-temp-gulp.png
  A docs/images/opt-temp-pwscf.png
  A docs/images/opt-temp-vasp.png
  A docs/images/prog-mon.png
  A docs/images/prog-start.png
  A docs/images/sys-set-vasp.png
  A docs/images/sys-set.png
  A docs/images/trend-view.png

Log Message:
-----------
Added images for the tutorials.


Commit: 707647a2b120f773e2d2d111797d54f559bcad4f
    https://github.com/dlonie/XtalOpt/commit/707647a2b120f773e2d2d111797d54f559bcad4f
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A docs/tutorials/xtalopt/gulp.dox

Log Message:
-----------
Added a doxygen'd GULP tutorial.


Commit: d05b6461afc677a6def2b40b8b98ec9c26edacd4
    https://github.com/dlonie/XtalOpt/commit/d05b6461afc677a6def2b40b8b98ec9c26edacd4
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A docs/tutorials/xtalopt/vasp.dox

Log Message:
-----------
Added a doxygen'd VASP tutorial.


Commit: 042838f942b4839e0427fd8e7e7f1d8c2801ea96
    https://github.com/dlonie/XtalOpt/commit/042838f942b4839e0427fd8e7e7f1d8c2801ea96
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  A docs/tutorials/xtalopt/pwscf.dox

Log Message:
-----------
Added a doxygen'd PWscf tutorial.


Commit: 1494427a02bce41ed066c4521d2f01ed0513d606
    https://github.com/dlonie/XtalOpt/commit/1494427a02bce41ed066c4521d2f01ed0513d606
Author: David Lonie <loniedavid at gmail.com>
Date:   2010-06-22 (Tue, 22 Jun 2010)

Changed paths:
  M Doxyfile
  A docs/images/cell-init.png
  A docs/images/opt-set.png
  A docs/images/opt-temp-gulp.png
  A docs/images/opt-temp-pwscf.png
  A docs/images/opt-temp-vasp.png
  A docs/images/prog-mon.png
  A docs/images/prog-start.png
  A docs/images/sys-set-vasp.png
  A docs/images/sys-set.png
  A docs/images/trend-view.png
  A docs/tutorials/xtalopt/gulp.dox
  A docs/tutorials/xtalopt/pwscf.dox
  A docs/tutorials/xtalopt/vasp.dox
  A samples/pwscf-xtalopt.scheme
  A samples/vasp-xtalopt.scheme

Log Message:
-----------
Merge branch 'tutorials'





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