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Merge pull request #423 from mir-group/jon/fix-run-dft #497

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Run time

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Job	Run time
(OpenMP, Lapack, Python) = (OFF, OFF, 3.7)	22m 42s
(OpenMP, Lapack, Python) = (OFF, OFF, 3.8)	21m 39s
(OpenMP, Lapack, Python) = (OFF, ON, 3.7)	22m 59s
(OpenMP, Lapack, Python) = (OFF, ON, 3.8)	22m 31s
(OpenMP, Lapack, Python) = (ON, OFF, 3.7)	22m 32s
(OpenMP, Lapack, Python) = (ON, OFF, 3.8)	22m 4s
(OpenMP, Lapack, Python) = (ON, ON, 3.7)	22m 47s
(OpenMP, Lapack, Python) = (ON, ON, 3.8)	22m 20s
	2h 59m 34s