Published November 2016
| Submitted
Journal Article
Open
First-principles dynamics of electrons and phonons
- Creators
-
Bernardi, Marco
Abstract
First-principles calculations combining density functional theory and many-body perturbation theory can provide microscopic insight into the dynamics of electrons and phonons in materials. We review this theoretical and computational framework, focusing on perturbative treatments of scattering, dynamics, and transport of electrons and phonons. Application of these first-principles calculations in electronics, lighting, spectroscopy, and renewable energy are discussed.
Additional Information
© 2016 EDP Sciences, SIF, Springer-Verlag Berlin Heidelberg. Received 27 June 2016; Received in final form 3 September 2016; Published online 2 November 2016. The author thanks Jamal Mustafa, Luis Agapito, and Jin-Jian Zhou for fruitful discussions, and Davide Sangalli, Vatsal Jhalani, Nien-En Lee, Bolin Liao, and Celene Barrera for feedback on the manuscript. This work was supported by a start-up fund from the California Institute of Technology.Attached Files
Submitted - 1607.00080v1.pdf
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1607.00080v1.pdf
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Additional details
- Eprint ID
- 71449
- Resolver ID
- CaltechAUTHORS:20161025-114155978
- Caltech
- Created
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2016-10-25Created from EPrint's datestamp field
- Updated
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2021-11-11Created from EPrint's last_modified field