Version 2.7.0
·
56 commits
to master
since this release
Since 2.6.0 never got past beta, this wraps in those changes.
Features:
- Logger can now print to a file, or an open file stream, so you can integrate it into your code
- Pivoted cholesky decomposition for generating localized orbitals
Bug Fixes:
- Fixed code hang when openmp threads are capped to 1
- Fixed a bug that can emerge in the PM solver when exact convergence leads to division by zero