dzzz2001
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issues of
dzzz2001
### Linked Issue fix #3809, fix #3424, fix #3426, fix #3430 ### Unit Tests and/or Case Tests for my changes - Unit tests have been added for "spherical harmonics" and...
GPU & DCU & HPC
### What's changed? - add cusolver support for lcao kpar. However, tests show that on small-scale systems, using the kpar algorithm with the cusolver solver does not provide significant acceleration....
Features Needed
Refactor