Practical approaches to simulating x-ray spectroscopy with quantum chemistry
Developments on simulating X-ray spectroscopy using quantum chemistry are presented. Topics are introduced in Chapter 1 via two separate reviews on X-ray spectroscopy and quantum chemistry. The introduction is followed by four independent investigations across four chapters, aimed at developing robu...
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| Format: | Thesis (University of Nottingham only) |
| Language: | English |
| Published: |
2020
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| Online Access: | https://eprints.nottingham.ac.uk/59889/ |