uu.seUppsala University Publications
Change search
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • ieee
  • modern-language-association
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf
Structure and dynamics of the silacyclobutane radical cation, studied by ab initio and density functional theory and electron spin resonance spectroscopy
Uppsala University, Teknisk-naturvetenskapliga vetenskapsområdet, Physics, Department of Quantum Chemistry.
Show others and affiliations
1997 (English)In: JOURNAL OF CHEMICAL PHYSICS, ISSN 0021-9606, Vol. 107, no 2, 297-306 p.Article in journal (Other scientific) Published
Abstract [en]

The geometric structure, the proton isotropic hyperfine coupling constants and temperature dependence of the isotropic hyperfine coupling constants have been investigated for the silacyclobutane radical cation using Moller-Plesset perturbation theory to s

Place, publisher, year, edition, pages
1997. Vol. 107, no 2, 297-306 p.
Keyword [en]
MOLECULAR-ORBITAL METHODS; HYPERFINE COUPLING-CONSTANTS; GAUSSIAN-BASIS SETS; CONFIGURATION-INTERACTION; ESR EVIDENCE; METHYL; ENERGIES; ELEMENTS; ABINITIO
Identifiers
URN: urn:nbn:se:uu:diva-41582OAI: oai:DiVA.org:uu-41582DiVA: diva2:69483
Note
Fangstrom T, UNIV UPPSALA, DEPT QUANTUM CHEM, BOX 518, S-75120 UPPSALA, SWEDEN. UNIV BONN, DEPT PHYS & THEORET CHEM, D-53115 BONN, GERMANY. UNIV STOCKHOLM, DEPT PHYS, S-11385 STOCKHOLM, SWEDEN. HIROSHIMA UNIV, FAC ENGN, DEPT APPL CHEM, HIGASHIHIROSHIMA 73Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-15

Open Access in DiVA

No full text

By organisation
Department of Quantum Chemistry

Search outside of DiVA

GoogleGoogle Scholar

urn-nbn

Altmetric score

urn-nbn
Total: 767 hits
CiteExportLink to record
Permanent link

Direct link
Cite
Citation style
  • apa
  • ieee
  • modern-language-association
  • vancouver
  • Other style
More styles
Language
  • de-DE
  • en-GB
  • en-US
  • fi-FI
  • nn-NO
  • nn-NB
  • sv-SE
  • Other locale
More languages
Output format
  • html
  • text
  • asciidoc
  • rtf