Input 01-casida.02-vib_modes.inp

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Run intel-serial: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Bond stretch 2.254370315750000e+03 2.254370315750000e+03 1.130000000000000e-07 0.000000000000000e+00 PASS
Libration 1 3.214091385500000e+02 3.214104111100000e+02 1.680000000000000e-02 -1.272560000018075e-03 PASS
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