Computational electrochemical and {sup 7}Li NMR studies of lithiated disordered carbons electrodes in lithium ion cells
Disordered carbons that deliver high reversible capacity in electrochemical cells have been synthesized by using inorganic clays as templates to control the pore size and the surface area. The capacities obtained were much higher than those calculated if the resultant carbon had a graphitic-like structure. Computational chemistry was used to investigate the nature of lithium bonding in a carbon lattice unlike graphite. The lithium intercalated fullerene Li{sub 8}-C{sub 60} was used as a model for the (nongraphitic) disordered carbon lattice. A dilithium-C{sub 60} system with a charge and multiplicity of (0,1) and a trilithium-C{sub 60} system with a charge and multiplicity of (0,4) were investigated. The spatial distribution of lithium ions in an electrochemical cell containing this novel disordered carbon material was investigated in situ by Li-7 NMR using an electrochemical cell that was incorporated into a toroid cavity nuclear magnetic resonance (NMR) imager. The concentration of solvated Li{sup +} ions in the carbon anode appears to be larger than in the bulk electrolyte, is substantially lower near the copper/carbon interface, and does not change with cell charging.
- Research Organization:
- Argonne National Lab., IL (US)
- Sponsoring Organization:
- USDOE
- DOE Contract Number:
- W-31109-ENG-38
- OSTI ID:
- 20019128
- Resource Relation:
- Conference: 1997 Materials Research Society Fall Meeting, Boston, MA (US), 12/01/1997--12/05/1997; Other Information: PBD: 1998; Related Information: In: Materials for electrochemical energy storage and conversion II -- Batteries, capacitors and fuel cells. Materials Research Society symposium proceedings, Volume 496, by Ginley, D.S.; Doughty, D.H.; Scrosati, B.; Takamura, T.; Zhang, Z.J. [eds.], 702 pages.
- Country of Publication:
- United States
- Language:
- English
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