Viewing all changes in revision 473.2.2.
- Committer: Alberto Garcia
- Date: 2015-07-06 10:02:54 UTC
- mto: This revision was merged to the branch mainline in revision 476.
- Revision ID: albertog@icmab.es-20150706100254-dbdo7r8ac6phh6tn
Added quenched MD example. New dynamics headings
* The headings for the beginning of the dynamics blocks are now
more concrete.
* New example for quenched MD relaxation.
added:
Tests/si2x1h-quench/
Tests/si2x1h-quench/makefile
Tests/si2x1h-quench/si2x1h-quench.fdf
Tests/si2x1h-quench/si2x1h-quench.pseudos
modified:
Src/siesta_move.F
Src/state_init.F
* The headings for the beginning of the dynamics blocks are now
more concrete.
* New example for quenched MD relaxation.
added:
Tests/si2x1h-quench/
Tests/si2x1h-quench/makefile
Tests/si2x1h-quench/si2x1h-quench.fdf
Tests/si2x1h-quench/si2x1h-quench.pseudos
modified:
Src/siesta_move.F
Src/state_init.F
- files added:
- Tests/si2x1h-quench
- files modified:
- Src/siesta_move.F
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