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Journal article

Element-specific investigations of ultrafast dynamics in photoexcited Cu2ZnSnS4 nanoparticles in solution

From

Department of Energy Conversion and Storage, Technical University of Denmark1

Lund University2

Atomic Scale Materials Modelling, Department of Energy Conversion and Storage, Technical University of Denmark3

Argonne National Laboratory4

Japan Synchrotron Radiation Research Institute5

Department of Physics, Technical University of Denmark6

Neutrons and X-rays for Materials Physics, Department of Physics, Technical University of Denmark7

The Graduate University for Advanced Studies8

Imaging and Structural Analysis, Department of Energy Conversion and Storage, Technical University of Denmark9

Ultrafast, light-induced dynamics in copper–zinc–tin–sulfide (CZTS) photovoltaic nanoparticles are investigated through a combination of optical and x-ray transient absorption spectroscopy. Laser-pump, x-ray-probe spectroscopy on a colloidal CZTS nanoparticle ink yields element-specificity, which reveals a rapid photo-induced shift of electron density away from Cu-sites, affecting the molecular orbital occupation and structure of CZTS.

We observe the formation of a stable charge-separated and thermally excited structure, which persists for nanoseconds and involves an increased charge density at the Zn sites. Combined with density functional theory calculations, the results provide new insight into the structural and electronic dynamics of CZTS absorbers for solar cells.

Language: English
Publisher: AIP Publishing LLC and ACA
Year: 2021
Pages: 024501
ISSN: 23297778
Types: Journal article
DOI: 10.1063/4.0000055
ORCIDs: Rein, Christian , Carrasco de Busturia, David , Gertsen, Anders Skovbo , Moltke, Asbjørn Meldgaard , García Lastra, Juan Maria , Nielsen, Martin Meedom , Haldrup, Kristoffer , Andreasen, Jens Wenzel , 0000-0002-0528-0422 , 0000-0002-2166-0636 and 0000-0002-2681-8316
Other keywords

Crystallography QD901-999

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