Raisins in a Hydrogen Pie: Ultrastable Cesium and Rubidium Polyhydrides

Fuente: arXiv
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Autores principales: Zhou, Di, Semenok, Dmitrii V., Galasso, Michele, Alabarse, Frederico Gil, Sannikov, Denis A., Troyan, Ivan A., Nakamoto, Yuki, Shimizu, Katsuya, Oganov, Artem R.
Formato: Preprint
Publicado: 2024
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author Zhou, Di
Semenok, Dmitrii V.
Galasso, Michele
Alabarse, Frederico Gil
Sannikov, Denis A.
Troyan, Ivan A.
Nakamoto, Yuki
Shimizu, Katsuya
Oganov, Artem R.
author_facet Zhou, Di
Semenok, Dmitrii V.
Galasso, Michele
Alabarse, Frederico Gil
Sannikov, Denis A.
Troyan, Ivan A.
Nakamoto, Yuki
Shimizu, Katsuya
Oganov, Artem R.
contents We proposed a new method for synthesis of metal polyhydrides via high-pressure thermal decomposition of corresponding amidoboranes in diamond anvil cells. Within this approach, we synthesized molecular semiconducting cesium ($\textit P4/nmm$-CsH$_7$, $\textit P$1-CsH$_{15+x}$) and rubidium (RbH$_{9-x}$) polyhydrides with a very high hydrogen content reaching 93 at%. Preservation of CsH$_7$ at near ambient conditions, confirmed both experimentally and theoretically, represents a significant advance in the stabilization of hydrogen-rich compounds. In addition, we synthesized two crystal modifications of RbH$_{9-x}$ with pseudo hexagonal and pseudo tetragonal structures identified by synchrotron X-ray diffraction and Raman measurements. Both phases are stable at 8-10 GPa. This is an unprecedented low stabilization pressure for polyhydrides. These discoveries open up possibilities for modifying existing hydrogen storage materials to increase their efficiency.
format Preprint
id arxiv_https___arxiv_org_abs_2401_00742
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Raisins in a Hydrogen Pie: Ultrastable Cesium and Rubidium Polyhydrides
Zhou, Di
Semenok, Dmitrii V.
Galasso, Michele
Alabarse, Frederico Gil
Sannikov, Denis A.
Troyan, Ivan A.
Nakamoto, Yuki
Shimizu, Katsuya
Oganov, Artem R.
Materials Science
Soft Condensed Matter
We proposed a new method for synthesis of metal polyhydrides via high-pressure thermal decomposition of corresponding amidoboranes in diamond anvil cells. Within this approach, we synthesized molecular semiconducting cesium ($\textit P4/nmm$-CsH$_7$, $\textit P$1-CsH$_{15+x}$) and rubidium (RbH$_{9-x}$) polyhydrides with a very high hydrogen content reaching 93 at%. Preservation of CsH$_7$ at near ambient conditions, confirmed both experimentally and theoretically, represents a significant advance in the stabilization of hydrogen-rich compounds. In addition, we synthesized two crystal modifications of RbH$_{9-x}$ with pseudo hexagonal and pseudo tetragonal structures identified by synchrotron X-ray diffraction and Raman measurements. Both phases are stable at 8-10 GPa. This is an unprecedented low stabilization pressure for polyhydrides. These discoveries open up possibilities for modifying existing hydrogen storage materials to increase their efficiency.
title Raisins in a Hydrogen Pie: Ultrastable Cesium and Rubidium Polyhydrides
topic Materials Science
Soft Condensed Matter
url https://arxiv.org/abs/2401.00742