Jan E. Almlöf
Affiliations: | Chemistry and Chemical Physics | University of Minnesota, Twin Cities, Minneapolis, MN |
Area:
Quantum chemistryWebsite:
http://www.chem.umn.edu/alumni/IndFacPages/Almlof.htmlGoogle:
"Jan E. Almlöf"Bio:
(1945 - 1996)
http://static.msi.umn.edu/general/Bulletin/Vol.12-No.3/Obit.html
http://www.chem.umn.edu/alumni/PDF%20WriteUps/almlof.pdf
Mean distance: 10.34 | S | N | B | C | P |
Parents
Sign in to add mentorIvar Olovsson | grad student | 1974 | Uppsala | |
(Studies of hydrogen bonding by quantum-mechanical calculations and X-ray diffraction methods) | ||||
Björn O. Roos | grad student | 1974 | University of Uppsala | |
Enrico Clementi | post-doc | 1975 | IBM Research Laboratory, San Jose |
Children
Sign in to add traineeEric Schwegler | grad student | ||
Angela K. Wilson | grad student | ||
Trygve Helgaker | grad student | 1986 | University of Oslo, Norway |
Vudhichai Parasuk | grad student | 1987-1991 | UMN |
Abhik Ghosh | grad student | 1989-1992 | UMN |
Willem M. Klopper | post-doc | 1991 | UMN |
Collaborators
Sign in to add collaboratorPeter Robert Taylor | collaborator | NASA Ames Research Center |
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Publications
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AlmlÖf J, Deleeuw BJ, Taylor PR, et al. (2009) The dissociation energy of N2 International Journal of Quantum Chemistry. 36: 345-354 |
Sjo/voll M, Fagerli H, Gropen O, et al. (1997) Extensive relativistic calculations on the palladium hydride molecule The Journal of Chemical Physics. 107: 5496-5501 |
Wilson AK, Almlöf J. (1997) Møller-Plesset correlation energies in a localized orbital basis using a Laplace transform technique Theoretica Chimica Acta. 95: 49-62 |
Challacombe M, Schwegler E, Almlöf J. (1996) Fast assembly of the Coulomb matrix: A quantum chemical tree code Journal of Chemical Physics. 104: 4685-4698 |
Hankinson DJ, Almlöf J, Leopold KR. (1996) A direct comparison between structure correlations and reaction paths Journal of Physical Chemistry. 100: 6904-6909 |
Røeggen I, Almlöf J. (1996) An extended geminal calculation of the three-body potential for the ground state of the helium trimer Journal of Molecular Structure-Theochem. 388: 331-337 |
Fanti M, Almlöf J. (1996) Hyperpolarizabilities of substituted polyphenyls Journal of Molecular Structure-Theochem. 388: 305-313 |
Zheng YC, Almlöf JE. (1996) A grid-free DFT implementation of non-local functionals and analytical energy derivatives Journal of Molecular Structure: Theochem. 388: 277-284 |
Hankinson DJ, Almlöf J. (1996) Cluster models for lithium intercalated graphite: electronic structures and energetics Journal of Molecular Structure-Theochem. 388: 245-256 |
Sargent AL, Rollog ME, Almlöf JE, et al. (1996) Enzyme-catalyzed enolization reactions: A theoretical study on the energetics of concerted and stepwise pathways Journal of Molecular Structure: Theochem. 388: 145-159 |