Localized orbitals and the Fermi hole
Publication
, Journal Article
Luken, WL; Beratan, DN
Published in: Theoretica Chimica Acta
May 1, 1982
The relationship between localized orbitals and the Fermi hole is demonstrated with contour maps of the Fermi hole in the water molecule. These contour maps indicate the presence of regions in which the Fermi hole is relatively stable, regions in which the shape of the Fermi hole changes rapidly, and regions in which the Fermi hole follows the probe electron smoothly. If a single orbital dominates any region of space, the Fermi hole resembles that orbital for any position of the probe electron in the dominated region. © 1982 Springer-Verlag.
Duke Scholars
Published In
Theoretica Chimica Acta
DOI
EISSN
1432-2234
ISSN
0040-5744
Publication Date
May 1, 1982
Volume
61
Issue
3
Start / End Page
265 / 281
Citation
APA
Chicago
ICMJE
MLA
NLM
Luken, W. L., & Beratan, D. N. (1982). Localized orbitals and the Fermi hole. Theoretica Chimica Acta, 61(3), 265–281. https://doi.org/10.1007/BF00550971
Luken, W. L., and D. N. Beratan. “Localized orbitals and the Fermi hole.” Theoretica Chimica Acta 61, no. 3 (May 1, 1982): 265–81. https://doi.org/10.1007/BF00550971.
Luken WL, Beratan DN. Localized orbitals and the Fermi hole. Theoretica Chimica Acta. 1982 May 1;61(3):265–81.
Luken, W. L., and D. N. Beratan. “Localized orbitals and the Fermi hole.” Theoretica Chimica Acta, vol. 61, no. 3, May 1982, pp. 265–81. Scopus, doi:10.1007/BF00550971.
Luken WL, Beratan DN. Localized orbitals and the Fermi hole. Theoretica Chimica Acta. 1982 May 1;61(3):265–281.
Published In
Theoretica Chimica Acta
DOI
EISSN
1432-2234
ISSN
0040-5744
Publication Date
May 1, 1982
Volume
61
Issue
3
Start / End Page
265 / 281