Electrostatic interaction of a solute with a continuum. Improved description of the cavity and of the surface cavity bound charge distribution.

Journal of Computational Chemistry

Volumn 8, Issue 6, 1987, Pages 778-787

  Pascual Ahuir J L ^a   Silla, E ^a   Tomasi, J ^b   Bonaccorsi, R ^c  

^a UNIVERSITY OF VALENCIA   (Spain)

^b UNIVERSITY OF PISA   (Italy)

^c CNR   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84988109711     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.540080605     Document Type: Article

References (30)

1. Ab initio evaluation of absorption and emission transitions for molecular solutes, including separate consideration of orientational and inductive solvent effects
2. On a semiclassical interpretation of inter- and intramolecular interactions
3. Structural deformations of the DNA double helix in the first stages of DNA transcription studied with a simple model