Input 01-casida.02-vib_modes.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_intel-2022a_serial_omp

Matches

Name	Value	Reference	Precision	Difference	Status
Bond stretch	2.254405750300000e+03	2.254405750090000e+03	2.970000000000000e-07	2.100000529026147e-07	PASS
Libration 1	3.213678279800000e+02	3.213565269400000e+02	3.610000000000000e-02	1.130104000003485e-02	PASS

Compare to other inputs