AlphaThis version is a public (beta) release candidate and includes the following bug-fixes: - Added warning to parallel focusing
- Added several test cases and validated the current version of the code for all but one (see examples/README.html)
- Fixed atom partitioning bug and external energy evaluation during focusing
- Added new program for converting OpenDX format files to MOLMOL (by Jung-Hsin Lin)
You should definitely upgrade, the previous versions may produce unreliable results. |
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