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ORCA: singly-excited state calculation with over 1000 MOs #86

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ORCA: singly-excited state calculation with over 1000 MOs

ORCA: singly-excited state calculation with over 1000 MOs #86

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Run time

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Job	Run time
nix / nix-build	45s
prechecks / pre-commit	28s
all	4s
	1m 17s

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