Chemistry under extreme conditions: Pressure evolution of chemical bonding and structure in dense solids

Yoo, Choong-Shik

doi:10.1063/1.5127897

Title: Chemistry under extreme conditions: Pressure evolution of chemical bonding and structure in dense solids

Journal Article · 15 January 2020 · Matter and Radiation at Extremes

DOI: https://doi.org/10.1063/1.5127897 · OSTI ID:1598015

Yoo, Choong-Shik ^[1]

Washington State Univ., Pullman, WA (United States). Inst. of Shock Physics, and Materials Science and Engineering

Recent advances in high-pressure technologies and large-scale experimental and computational facilities have enabled scientists, at an unprecedented rate, to discover and predict novel states and materials under the extreme pressure-temperature conditions found in deep, giant-planet interiors. Based on a well-documented body of work in this field of high-pressure research, we elucidate the fundamental principles that govern the chemistry of dense solids under extreme conditions. These include: (i) the pressure-induced evolution of chemical bonding and structure of molecular solids to extended covalent solids, ionic solids and, ultimately, metallic solids, as pressure increases to the terapascal regime; (ii) novel properties and complex transition mechanisms, arising from the subtle balance between electron hybridization (bonding) and electrostatic interaction (packing) in densely packed solids; and (iii) new dense framework solids with high energy densities, and with tunable properties and stabilities under ambient conditions. Examples are taken primarily fromlow-Z molecular systems that have scientific implications for giant-planet models, condensed materials physics, and solid-state core-electron chemistry.

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Research Organization:: Argonne National Laboratory (ANL), Argonne, IL (United States). Advanced Photon Source (APS)

Sponsoring Organization:: Agency for Defense Development (ADD); Defense Advanced Research Projects Agency (DARPA); National Science Foundation (NSF); US Army Research Office (ARO); USDOE National Nuclear Security Administration (NNSA); USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Grant/Contract Number:: NA0003342

OSTI ID:: 1598015

Journal Information:: Matter and Radiation at Extremes, Journal Name: Matter and Radiation at Extremes Journal Issue: 1 Vol. 5; ISSN 2468-2047

Publisher:: China Academy of Engineering Physics (CAEP)/AIP PublishingCopyright Statement

Country of Publication:: United States

Language:: ENGLISH

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