  The intramolecular vibrational relaxation dynamics of formic acid and its
deuterated isotopologues is simulated on the full-dimensional potential energy
surface of Richter and Carbonniere [F. Richter and P. Carbonniere, J. Chem.
Phys., 148, 064303 (2018)] using the Heidelberg MCTDH package. Mode couplings
with the torsion coordinate capturing most of the trans-cis isomerisation are
identified in the dynamics of artificially excited vibrational mode overtones.
The C-O stretch bright vibrational mode is coupled to the out-of-the plane
torsion mode in HCOOH, where this coupling could be exploited for laser-induced
trans-to-cis isomerisation. Strong isotopic effects are observed: deuteration
of the hydroxyl group, i.e., in HCOOD and DCOOD, destroys the C-O stretch to
torsion mode coupling whereas in DCOOH, little to no effect is observed.
