Input 01-casida.02-vib_modes.inp

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run foss_mpi_autotools: [foss2023a-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
Bond stretch	2.254370315750000e+03	2.254370315750000e+03	1.130000000000000e-07	0.000000000000000e+00	PASS
Libration 1	3.214082439400000e+02	3.214002369900000e+02	8.810000000000000e-03	8.006949999980861e-03	PASS

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