Fastest DFT Dirac - #21

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certik wants to merge 8 commits into

atomic-solvers:mainfrom

Commits on Oct 20, 2023

Add an interface to DSYGVX
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dcd9fa8
Use dsygvx
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44d32e9
Simplify
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aa40851
Hardwire accurate_eigensolver = .false.
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Do not copy matrices
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a9ce4b2

Commits on Oct 25, 2023

Do not check symmetry
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310aeb8
Reduce SCF accuracy
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cedfa6a

Commits on Nov 4, 2023

Only compute the states we need
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b3fd362