Combining the $\Delta$-Self-Consistent-Field and GW Methods for Predicting Core Electron Binding Energies in Periodic Solids
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Author(s):
J. Matthias Kahk; Johannes Lischner
Published in:
J. Chem. Theory Comput., Issue 19, 2023, Page(s) 3276-3283, ISSN 1549-9618
Publisher:
American Chemical Society
DOI:
10.1021/acs.jctc.3c00121
Plasmon-induced hot carriers from interband and intraband transitions in large noble metal nanoparticles
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Author(s):
Hanwen Jin; Juhan Matthias Kahk; Dimitrios A. Papaconstantopoulos; Aires Ferreira; Johannes Lischner
Published in:
PRX Energy, Issue 1, 2022, Page(s) 013006, ISSN 2768-5608
Publisher:
American Physical Society
DOI:
10.48550/arxiv.2201.10534
Predicting Core Electron Binding Energies in Elements of the First Transition Series Using the $Δ$-Self-Consistent-Field Method
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Author(s):
J. Matthias Kahk; Johannes Lischner
Published in:
Faraday Discussions, Issue 236, 2022, Page(s) 364, ISSN 1359-6640
Publisher:
Royal Society of Chemistry
DOI:
10.48550/arxiv.2112.04200
Combining time-dependent density functional theory and the $\Delta$SCF approach for accurate core-electron spectra
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Author(s):
Marcus Annegarn; Juhan Matthias Kahk; Johannes Lischner
Published in:
J. Chem. Theory Comput., Issue 18, 2022, Page(s) 7620-7629, ISSN 1549-9618
Publisher:
American Chemical Society
DOI:
10.48550/arxiv.2209.04253