Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules
Publication
, Journal Article
Mele, EJ; Socolar, J
Published in: International Journal of Quantum Chemistry
January 1, 1984
Two simple and manageable schemes for integrating the time evolution operator e−iHt are discussed and applied to study vibronic effects in photoemission and optical excitation of model conjugated molecules. Copyright © 1984 John Wiley & Sons, Inc.
Duke Scholars
Published In
International Journal of Quantum Chemistry
DOI
EISSN
1097-461X
ISSN
0020-7608
Publication Date
January 1, 1984
Volume
26
Issue
18 S
Start / End Page
347 / 358
Related Subject Headings
- Chemical Physics
- 3407 Theoretical and computational chemistry
- 3406 Physical chemistry
- 0307 Theoretical and Computational Chemistry
- 0306 Physical Chemistry (incl. Structural)
Citation
APA
Chicago
ICMJE
MLA
NLM
Mele, E. J., & Socolar, J. (1984). Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules. International Journal of Quantum Chemistry, 26(18 S), 347–358. https://doi.org/10.1002/qua.560260832
Mele, E. J., and J. Socolar. “Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules.” International Journal of Quantum Chemistry 26, no. 18 S (January 1, 1984): 347–58. https://doi.org/10.1002/qua.560260832.
Mele EJ, Socolar J. Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules. International Journal of Quantum Chemistry. 1984 Jan 1;26(18 S):347–58.
Mele, E. J., and J. Socolar. “Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules.” International Journal of Quantum Chemistry, vol. 26, no. 18 S, Jan. 1984, pp. 347–58. Scopus, doi:10.1002/qua.560260832.
Mele EJ, Socolar J. Numerical integration of the time evolution operator: Excited‐state dynamics in conjugated molecules. International Journal of Quantum Chemistry. 1984 Jan 1;26(18 S):347–358.
Published In
International Journal of Quantum Chemistry
DOI
EISSN
1097-461X
ISSN
0020-7608
Publication Date
January 1, 1984
Volume
26
Issue
18 S
Start / End Page
347 / 358
Related Subject Headings
- Chemical Physics
- 3407 Theoretical and computational chemistry
- 3406 Physical chemistry
- 0307 Theoretical and Computational Chemistry
- 0306 Physical Chemistry (incl. Structural)