Effect of concentration on the energetics and dynamics of Li ion transport in anatase and amorphous TiO2

Journal of Physical Chemistry C

Volumn 115, Issue 31, 2011, Pages 15661-15673

  Yildirim, Handan ^a   Greeley, Jeffrey ^a   Sankaranarayanan, Subramanian K R S ^a  

^a ARGONNE NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMORPHOUS NETWORKS; AMORPHOUS TIO; AMORPHOUS TITANIA; ANATASE TIO; BULK ANATASE; CONCENTRATION EFFECTS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DIFFUSION CHARACTERISTICS; DIFFUSION MECHANISMS; ENERGY STORAGE APPLICATIONS; ENERGY WELLS; ION CONCENTRATIONS; ION CONDUCTION; ION TRANSPORTS; LI DIFFUSION; LI DIFFUSIVITY; LI INTERCALATION; MD SIMULATION; MOLECULAR DYNAMICS SIMULATIONS; MONOTONIC DECREASE; NON-MONOTONIC VARIATION; OCTAHEDRAL SITES; STRONG CORRELATION; TRANSPORT CHARACTERISTICS;

CONCENTRATION (PROCESS); DENSITY FUNCTIONAL THEORY; DIFFUSION BARRIERS; DYNAMICS; IONS; MOLECULAR DYNAMICS; SOLID STATE DEVICES;

TITANIUM DIOXIDE;

EID: 79961238929     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp202514j     Document Type: Article

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