✦ LIBER ✦
Validation study of meta-GGA functionals and of a model exchange???correlation potential in density functional calculations of EPR parametersPresented at the annual meeting of the Deutsche Bunsen-Gesellschaft f??r Physikalische Chemie, Potsdam, Germany, May 9???11, 2002.Electronic supplementary information (ESI) available: Tables S1???S4 provide the detailed numerical data (g-shift and hyperfine coupling tensors) underlying the statistical and graphical analyses of the paper. See http://www.rsc.org/suppdata/cp/b2/b207171a/
✍ Scribed by Arbuznikov, Alexei V.; Kaupp, Martin; Malkin, Vladimir G.; Reviakine, Roman; Malkina, Olga L.
- Book ID
- 121251280
- Publisher
- Royal Society of Chemistry
- Year
- 2002
- Tongue
- English
- Weight
- 201 KB
- Volume
- 4
- Category
- Article
- ISSN
- 1463-9076
- DOI
- 10.1039/B207171A
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