Towards high-resolution X-ray scattering as a probe of electron correlation
<p>X-ray scattering cross sections are calculated using a range of increasingly correlated methods: Hartree–Fock (HF), complete active space self-consistent field (CASSCF), Monte Carlo configuration interaction (MCCI), and full configuration interaction (FCI). Even for the seemingly...
| Main Authors: | , , , , |
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| Format: | Journal article |
| Language: | English |
| Published: |
Royal Society of Chemistry
2022
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