Sb 5s 2 lone pairs and band alignment of Sb 2 Se 3 : a photoemission and density functional theory study

The presence of a lone pair of 5s electrons at the valence band maximum (VBM) of Sb 2 Se 3 and the resulting band alignments are investigated using soft and hard X-ray photoemission spectroscopy in parallel with density functional theory (DFT) calculations. Vacuum-cleaved and exfoliated bulk crystal...

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Veröffentlicht in:Journal of materials chemistry. C, Materials for optical and electronic devices Materials for optical and electronic devices, 2020-09, Vol.8 (36), p.12615-12622
Hauptverfasser: Don, Christopher H., Shiel, Huw, Hobson, Theodore D. C., Savory, Christopher N., Swallow, Jack E. N., Smiles, Matthew J., Jones, Leanne A. H., Featherstone, Thomas J., Thakur, Pardeep K., Lee, Tien-Lin, Durose, Ken, Major, Jonathan D., Dhanak, Vinod R., Scanlon, David O., Veal, Tim D.
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Sprache:eng
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