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A high-pressure induced stable phase of Li 2 MnSiO 4 as an effective poly-anion cathode material from simulations

Journal Article · · Journal of Materials Chemistry. A
DOI:https://doi.org/10.1039/c9ta03369f· OSTI ID:1610323
 [1];  [1];  [1];  [2];  [1];  [1];  [3]
  1. Department of Materials Science and Engineering; College of Engineering; Peking University; Beijing 100871; China
  2. Department of Materials Science and Engineering; Massachusetts Institute of Technology; Cambridge; USA
  3. Department of Physics; Virginia Commonwealth University; Richmond; USA
+ Show Author Affiliations

A novel poly-anion Li2MnSiO4material is predicted at high pressure using global crystal structure search combined with first-principles calculation, which shows great potentials as a high-performance cathode.

Research Organization:
Virginia Commonwealth Univ., Richmond, VA (United States)
Sponsoring Organization:
USDOE Office of Science (SC)
DOE Contract Number:
FG02-96ER45579
OSTI ID:
1610323
Journal Information:
Journal of Materials Chemistry. A, Vol. 7, Issue 27; ISSN 2050-7488
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English

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