A new way to find better battery materials

March 26, 2018

A new approach to analyzing and designing new ion conductors — a key component of rechargeable batteries — could accelerate the development of high-energy lithium batteries, and possibly other energy storage and delivery devices such as fuel cells, researchers say.

The new approach relies on understanding the way vibrations move through the crystal lattice of lithium ion conductors and correlating that with the way they inhibit ion migration. This provides a way to discover new materials with enhanced ion mobility, allowing rapid charging and discharging. At the same time, the method can be used to reduce the material’s reactivity with the battery’s electrodes, which can shorten its useful life. These two characteristics — better ion mobility and low reactivity — have tended to be mutually exclusive.

Diagram illustrates the crystal lattice of a proposed battery electrolyte material called Li3PO4. The researchers found that measuring how vibrations of sound move through the lattice could reveal how well ions – electrically charged atoms or molecules – could travel through the solid material, and therefore how they would work in a real battery. In this diagram, the oxygen atoms are shown in red, the purple pyramid-like shapes are phosphate (PO4) molecules. The orange and green spheres are ions of lithium.

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