A note on geometry relaxation of molecular positron complexes

Journal of Chemical Physics

Volumn 121, Issue 11, 2004, Pages 5553-5554

  Mohallem, José R ^a   Gonçalves, Cristina P ^a  

^a FEDERAL UNIVERSITY OF MINAS GERAIS   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

ACETONE; APPROXIMATION THEORY; BINDING ENERGY; CHEMICAL BONDS; COMPUTATIONAL METHODS; IONS; POSITRONS; UREA;

ANNIHILATION; ATOMIC BONDS; BORN-OPPENHEIMER APPROXIMATION; MOLECULAR POSITRON COMPLEXES;

MOLECULAR DYNAMICS;

EID: 4944241057     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1781617     Document Type: Article

References (7)

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2. K. Strasburger, J. Chem. Phys. 114, 615 (2001).
3. M. Tachikawa, R. J. Buenker, and M. Kimura, J. Chem. Phys. 119, 5005 (2003).
4. J. Mitroy, M. W. Bromley, and G. G. Ryzhikh, J. Phys. B 35, R1 (2002).
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6. J. R. Mohallem, F. Rolim, and C. P. Gonçalves, J. Phys. B 37, 1045 (2004).
7. See also M. Mella, G. Morosi, and D. Bressanini, J. Chem. Phys. 112, 3928 (2000).