Input 01-casida.02-vib_modes.inp

Commits > Commit 97b4f3224f9be7c1ae7006b6639b45be6cefbdcd > Run spack_foss-2022a_ppc

Matches

Name	Value	Reference	Precision	Difference	Status
Bond stretch	2.254405750350000e+03	2.254405750090000e+03	2.970000000000000e-07	2.599999788799323e-07	PASS
Libration 1	3.213521354600000e+02	3.213565269400000e+02	3.610000000000000e-02	-4.391479999981129e-03	PASS

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