Article ID Journal Published Year Pages File Type
1562363 Computational Materials Science 2011 5 Pages PDF
Abstract
► The article concerns the calculation of electron-phonon coupling properties of the Mg2Si materials. ► The calculations are performed using Density-Functional Response Theory. ► The results show that by replacing part of the silicon atoms in the structure by heavier atoms the thermoelectric properties of the materials can be enhanced.
Related Topics
Physical Sciences and Engineering Engineering Computational Mechanics
Authors
, , , , ,