Theoretical design of MoO3-based high-rate lithium ion battery electrodes: the effect of dimensionality reduction
Abstract
By means of density functional theory computations, we systematically investigated the behavior of lithium (Li) adsorption and diffusion on MoO3with different dimensions: including three-dimensional (3D) bulk, two-dimensional (2D) double-layer, 2D monolayer and one-dimensional (1D) nanoribbons.
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 01, 2014
- Source ID
- 10.1039/c4ta04340e
Entities
People
- Carlos R. Cabrera
- Fengyu Li
- Zhongfang Chen
Organizations
- Army Research Office
- University of Puerto Rico
- Yusuf Hamied Department of Chemistry