Journal Article PUBDB-2022-04010

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Formation and Stability of Dense Methane-Hydrogen Compounds

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2022
APS College Park, Md.

Physical review letters 128(21), 215702 () [10.1103/PhysRevLett.128.215702]
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Abstract: Through a series of x-ray diffraction, optical spectroscopy diamond anvil cell experiments, combined with density functional theory calculations, we explore the dense CH$_4$−H$_2$ system. We find that pressures as low as 4.8 GPa can stabilize CH$_4$(H$_2$)$_2$ and (CH$_4$)$_2$H$_2$, with the latter exhibiting extreme hardening of the intramolecular vibrational mode of H$_2$ units within the structure. On further compression, a unique structural composition, (CH$_4$)$_3$(H$_2$)$_{25}$, emerges. This novel structure holds a vast amount of molecular hydrogen and represents the first compound to surpass 50 wt % H$_2$. These compounds, stabilized by nuclear quantum effects, persist over a broad pressure regime, exceeding 160 GPa

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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)
Experiment(s):
  1. PETRA Beamline P02.2 (PETRA III)

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 Record created 2022-07-26, last modified 2025-07-24


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