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Launchpad Id:
nickpapior
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Member since:
2012-07-08
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Danish, English
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nicpa@ntch-linux.nanotech.dtu.dk
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All assigned blueprints Assigned blueprints

Reference-counted data structures and containers are used sparingly in the current version. More data structure templates should be implemented to extend their use. We can make it into a library.
Implementation of distributed diagonalization on orbitals+k-points+spin degrees. This will implement a new parallelization of the diagonalization routines for increase efficiency for many k-points, for example.
Implement ESM model (with accept from original authors).

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