THz dynamics of hydrogen sulfide: Search for collective modes of a non-hydrogen-bonded analog of water
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Updated: Aug 23, 2026

Multiscale Sampling of a Heterogeneous Water/Metal Catalyst Interface using Density Functional Theory and Force-Field Molecular Dynamics
Published on: April 12, 2019
Ferdinando Formisano1, Alessio De Francesco1, Francesco Sacchetti2
1ILL, IOM, CNR-, and INSIDE@, Operative Group in Grenoble, 71 avenue des Martyrs, F-38042 Grenoble, France, and ILL, 71 avenue des Martyrs, F-38042 Grenoble, France.
Abstract:
Understanding the atomic-scale dynamics of liquids in the terahertz (THz) regime remains challenging because liquids sustain phonon-like collective excitations governed by complex interactions. To clarify the role of hydrogen bonding in such dynamics, we performed inelastic neutron scattering on hydrogen sulfide (H_{2}S) and its deuterated form (D_{2}S), molecular analogues of water without a hydrogen-bonded network. By combining coherent and incoherent measurements, we show that liquid H_{2}S exhibits a clear fast-sound mode, with a propagation velocity about twice the adiabatic sound speed, as in water. In contrast to hydrogen-bonded liquids, which display a secondary, nearly momentum-independent mode at 6-7 meV, no corresponding feature is observed in liquid D_{2}S. This absence highlights the central role of hydrogen bonding in enabling additional low-energy excitations. Overall, while fast sound is not exclusive to hydrogen-bonded systems, the detailed vibrational spectrum is strongly shaped by the local bonding environment.
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