Dataset for "Role of electron-phonon coupling and thermal expansion on band gaps, carrier mobility, and interfacial offsets in kesterite thin-film solar cells"

Park, Ji-Sang; Monserrat, Bartomeu; Kim, Sunghyun; Walsh, Aron

doi:https://doi.org/10.5281/zenodo.1242903

Author(s)

Park, Ji-Sang

Monserrat, Bartomeu

Kim, Sunghyun

Walsh, Aron

Type

Dataset

Abstract

Dataset for "Role of electron-phonon coupling and thermal expansion on band gaps, carrier mobility, and interfacial offsets in kesterite thin-film solar cells"

Date Issued

2018-05-14

Citation

2018

URI

http://hdl.handle.net/10044/1/64500

DOI

https://doi.org/10.5281/zenodo.1242903

Copyright Statement

https://creativecommons.org/licenses/by/4.0/

Sponsor

Commission of the European Communities

Grant Number

720907

Is Referenced By

10.1063/1.5028186

Subjects

First-principles

VASP

DFT

kesterite

solar cells

Notes

We are grateful to the UK Materials and Molecular Modelling Hub for computational resources, which is partially funded by EPSRC (EP/P020194/1). The research was supported by the Royal Society and the EU Horizon2020 Framework (STARCELL, Grant No. 720907). B.M. thanks Robinson College, Cambridge, and the Cambridge Philosophical Society for a Henslow Research Fellowship. J.-S.P. thanks the Royal Society for Shooter International Fellowship.