Journal Article PUBDB-2025-03882

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Unexpected compound reformation in the dense selenium-hydrogen system

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2025
Springer Nature London

Communications materials 6(1), 193 () [10.1038/s43246-025-00899-9]
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Abstract: The H$_2$Se molecule and the van der Waals compound (H$_2$Se)$_2$H$_2$ are both unstable upon room temperature compression, dissociating into their constituent elements above 22 GPa. Through a series of high pressure-high temperature diamond anvil cell experiments, we report the unexpected formation of a novel compound, SeH$_2$(H$_2$)$_2$ at pressures above 94 GPa. X-ray diffraction reveals the metallic sublattice to adopt a tetragonal (I4$_1$/amd) structure with density functional theory calculations finding a small distortion due to the orientation of H$_2$ molecules. The structure comprises of a network of zig-zag H-Se chains with quasi-molecular H$_2$ molecular units hosted in the prismatic Se interstices. Electrical resistance measurements demonstrate that SeH$_2$(H$_2$)$_2$ is non-metallic up to pressures of 148 GPa. Investigations into the Te-H system up to pressures of 165 GPa and 2000 K yielded no compound formation. The combined results suggest that the high pressure phase behavior of each chalcogen hydride is unique and more complex than previously thought.

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Contributing Institute(s):
  1. DOOR-User (DOOR ; HAS-User)
Research Program(s):
  1. 6G3 - PETRA III (DESY) (POF4-6G3) (POF4-6G3)
  2. MetElOne - The Metallization Conditions of Element One (948895) (948895)
  3. FS-Proposal: I-20230232 (I-20230232) (I-20230232)
Experiment(s):
  1. PETRA Beamline P02.2 (PETRA III)

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 Record created 2025-09-02, last modified 2025-09-08


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