English

Hydrogen-Storing Salt NaCl(H$_2$) Synthesized at High Pressure and High Temperature

Materials Science 2019-09-30 v2 Chemical Physics

Abstract

X-ray diffraction and Raman scattering measurements, and first-principles calculations are performed to search for the formation of NaCl-hydrogen compound. When NaCl and H2_{2} mixture is laser-heated to above 1500 K at pressures exceeding 40 GPa, we observed the formation of NaClHx_{\textit{x}} with P\textit{P}63_{3}/mmc\textit{mmc} structure which accommodates H2_{2} molecules in the interstitial sites of NaCl lattice forming ABAC stacking. Upon the decrease of pressure at 300 K, NaClHx_\textit{x} remains stable down to 17 GPa. Our calculations suggest the observed NaClHx_{\textit{x}} is NaCl(H2_{2}). Besides, a hydrogen-richer phase NaCl(H2_{2})4_{4} is predicted to become stable at pressures above 40 GPa.

Keywords

Cite

@article{arxiv.1907.06997,
  title  = {Hydrogen-Storing Salt NaCl(H$_2$) Synthesized at High Pressure and High Temperature},
  author = {Takahiro Matsuoka and Shu Muraoka and Takahiro Ishikawa and Ken Niwa and Kenji Ohta and Naohisa Hirao and Saori Kawaguchi and Yasuo Ohishi and Katsuya Shimizu and Shigeo Sasaki},
  journal= {arXiv preprint arXiv:1907.06997},
  year   = {2019}
}