Probst, M. M.; Spohr, Eckhard; Heinzinger, Karl:
On the hydration of the beryllium ion
In: Chemical Physics Letters, Vol. 161 (1989), No. 4/5, pp. 405 - 408
1989article/chapter in journal
ChemistryFaculty of Chemistry
Related: 1 publication(s)
Title:
On the hydration of the beryllium ion
Author:
Probst, M. M.;Spohr, EckhardUDE
GND
143257005
LSF ID
49123
ORCID
0000-0001-8148-7575ORCID iD
Other
connected with university
;Heinzinger, Karl
Year of publication:
1989
WWW URL:
http://www.sciencedirect.com/science/article/pii/0009261489851061
Appears in
Chemical Physics Letters
Title in English (abbreviated):
Chem. Phys. Lett.
Place of publication:
Amsterdam
Publisher:
Elsevier
in:
Vol. 161 (1989), No. 4/5, pp. 405 - 408
ISSN
0009-2614 Show availability online & print
ISSN
1873-4448 Show availability online & print
ZDB ID
1466293-0
ZDB ID
280568-6
Library shelfmark:
70 Z 29

Abstract:

A molecular dynamics simulation of a 1.1 molal aqueous solution of BeCl2 with a newly developed three-body potential for the Be2+H2O interactions has been performed. A strongly pronounced first hydration shell has been found with a hydration number of four, in agreement with experimental data. The existence of a second hydration shell is demonstrated. The relationship between hydration number and ion size is discussed.