Input 01-casida.02-vib_modes.inp

Commits > Commit f4bc596bdcf3afff33b833944576bfd5457df1bc > Run foss-mpi-debug: [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 3.214099742300000e+02 3.214104111100000e+02 1.680000000000000e-02 -4.368800000520423e-04 PASS
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