Ionization Dynamics of the Benzene-HF Complex: A Direct ab Initio Dynamics Study

Journal of Physical Chemistry A

Volumn 103, Issue 34, 1999, Pages 6873-6879

  Tachikawa, Hiroto ^a  

^a HOKKAIDO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000788440     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp991605o     Document Type: Article

References (21)

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16. (e) Program code of the direct ab initio dynamics calculation was created by our group.
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20. Ab initio MO calculation program: Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman; J. R.; Keith, T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andres, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzalez, C.; Pople, J. A.; Gaussian 94, Revision D.3; Gaussian, Inc.: Pittsburgh, PA, 1995.
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