High magnesium mobility in ternary spinel chalcogenides

Canepa, Pieremanuele; Bo, Shou-Hang; Sai Gautam, Gopalakrishnan; Key, Baris; Richards, William D.; Shi, Tan; Tian, Yaosen; Wang, Yan; Li, Juchuan; Ceder, Gerbrand

doi:10.1038/s41467-017-01772-1

Title: High magnesium mobility in ternary spinel chalcogenides

Journal Article · Fri Nov 24 00:00:00 EST 2017 · Nature Communications

DOI:https://doi.org/10.1038/s41467-017-01772-1· OSTI ID:1417619

^[1]; Bo, Shou-Hang ^[2];

^[3]; Key, Baris ^[4]; Richards, William D. ^[5];

^[6]; Tian, Yaosen ^[6]; Wang, Yan ^[5];

^[7]; Ceder, Gerbrand ^[3]

Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). Materials Science Division; Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States). Dept. of Materials Science and Engineering
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). Materials Science Division; Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States). Dept. of Materials Science and Engineering; Shanghai Jiao Tong Univ. (China). Shanghai Jiao Tong Univ. Joint Inst.
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). Materials Science Division; Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States). Dept. of Materials Science and Engineering; Univ. of California, Berkeley, CA (United States). Dept. of Materials Science and Engineering
Argonne National Lab. (ANL), Argonne, IL (United States). Chemical Sciences and Engineering Division
Massachusetts Inst. of Technology (MIT), Cambridge, MA (United States). Dept. of Materials Science and Engineering
Univ. of California, Berkeley, CA (United States). Dept. of Materials Science and Engineering
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). Materials Science Division

Magnesium batteries appear a viable alternative to overcome the safety and energy density limitations faced by current lithium-ion technology. The development of a competitive magnesium battery is plagued by the existing notion of poor magnesium mobility in solids. Here we demonstrate by using ab initio calculations, nuclear magnetic resonance, and impedance spectroscopy measurements that substantial magnesium ion mobility can indeed be achieved in close-packed frameworks (similar to 0.01-0.1 mS cm(-1) at 298 K), specifically in the magnesium scandium selenide spinel. Our theoretical predictions also indicate that high magnesium ion mobility is possible in other chalcogenide spinels, opening the door for the realization of other magnesium solid ionic conductors and the eventual development of an all-solid-state magnesium battery.

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Research Organization:: Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States); Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES); USDOE Office of Science - Office of Basic Energy Sciences - Joint Center for Energy Storage Research (JCESR)

Grant/Contract Number:: AC02-05CH11231; AC02-06CH11357; 3F-31144

OSTI ID:: 1417619

Alternate ID(s):: OSTI ID: 1427174

Journal Information:: Nature Communications, Vol. 8, Issue 1; ISSN 2041-1723

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 170 works

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