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Atom-water interactions, theory

See Jordan, K. D. Kurtz, H. A. "Theory of Metal Atom-Water Interactions and Alkali Halide Dimers" ACS Symp. Series,... [Pg.203]

Theory of Metal Atom-Water Interactions and Alkali Halide Dimers... [Pg.377]

Y. Ferro, A. Allouche, and V. Kempter, Electron solvation by highly polar molecules Density functional theory study of atomic sodium interaction with water, ammonia, and methanol. J. Chem. Phys. 120, 8683 8691 (2004). [Pg.49]

In radiology, the biological effects of radiation are usually discussed along two lines the matrix effect and target theory. The matrix effect considers the particle-water interaction in which ions, radicals, and excited atoms are produced. This is the dominating effect at large... [Pg.482]

Kimura Y, Alfano JC, Walhout PK, Barbara PF (1994) Ultrafast transient absorption spectroscopy of the solvated electron in water. J Phys Chem 98 3450-3458 Li X, Sevilla MD, Sanche L (2003) Density functional theory studies of electron interaction with DNA can zero eV electrons induce strand breaks J Am Chem Soc 125 13668-13699 Lind J, Shen X, Eriksen TE, Merenyi G, Eberson L (1991) One-electron reduction of N-bromosuccin-imide. Rapid expulsion of a bromine atom. J Am Chem Soc 113 4629-4633 Marasas RA, lyoda T, Miller JR (2003) Benzene radical ion in equilibrium with solvated electrons. J Phys Chem A 107 2033-2038... [Pg.85]

The original OZ equation can be applied only to liquids composed of spherically symmetrical particles, namely atoms. Chandler and Andersen proposed one of the possible extensions to treat general polyatomic cases, referred to as the reference interaction site model (RISM) or site-site OZ (SSOZ) theory [4], This has been further extended by Hirata and Rossky to be applicable to polar molecules such as water [5], In the RISM theory,... [Pg.595]

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See also in sourсe #XX -- [ Pg.377 , Pg.378 , Pg.379 , Pg.380 , Pg.381 , Pg.382 , Pg.383 , Pg.384 ]



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