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Title: Study of Antisite Defects in Hydrothermally Prepared LiFePO4 by in Situ X-ray Diffraction

Journal Article · · ACS Applied Materials and Interfaces
DOI:https://doi.org/10.1021/am200141a· OSTI ID:1042268

Hydrothermal synthesis has proven to be a cost-effective, energy-efficient approach for the manufacture of lithium iron phosphate (LiFePO{sub 4}) and its related materials. However, hydrothermally prepared LiFePO{sub 4} typically suffers from antisite defects, where some of the iron resides on lithium sites and restricts lithium-ion mobility. A post-heat-treatment temperature of around 700 C is generally used to eliminate cation disorder, but little is known about these antisite defects or their concentration as a function of the post-heat-treatment temperature. In this study, time-resolved, synchrotron X-ray diffraction reveals that antisite defects are completely eliminated above 500 C, suggesting that the electrochemical performance may be significantly enhanced by a milder postsynthesis heat treatment. The preliminary electrochemical results show a significant enhancement in the electrochemical capacity with the defect-free material, with the specific capacity increasing by approximately 60% at a C/20 rate.

Research Organization:
Brookhaven National Lab. (BNL), Upton, NY (United States)
Sponsoring Organization:
USDOE SC OFFICE OF SCIENCE (SC)
DOE Contract Number:
DE-AC02-98CH10886
OSTI ID:
1042268
Report Number(s):
BNL-97946-2012-JA; TRN: US1202763
Journal Information:
ACS Applied Materials and Interfaces, Vol. 3, Issue 5; ISSN 1944-8244
Country of Publication:
United States
Language:
English