Structure and Calculation of the Binding Energy of Gaseous Alkali Halide Dimers

1955 ◽  
Vol 23 (6) ◽  
pp. 1175-1176 ◽  
Author(s):  
Chester T. O'Konski ◽  
William I. Higuchi
Keyword(s):  
Binding Energy ◽  
Alkali Halide

Empirical interionic potentials for alkali halide molecules

1984 ◽  
Vol 62 (6) ◽  
pp. 583-589 ◽  
Author(s):  
J. E. Szymanski ◽  
J. A. D. Matthew
Keyword(s):  
Binding Energy ◽  
Alkali Halide ◽  
Energy Functions ◽  
Gaussian Form ◽  
Potential Energy Functions ◽  
Dissociation Energies ◽  
Anharmonic Constant ◽  
Empirical Potentials ◽  
Repulsion Potential ◽  
Extreme Care

A systematic study of families of empirical internuclear potential energy functions based on the Rittner potential is presented for alkali halide molecules, and comparison is made with recent binding energy and anharmonic constant data. It is concluded that the Rittner formalism, however parameterized, is incapable of consistent prediction of several molecular properties simultaneously, and that the potential seems to be failing to model some aspect of the detailed bonding of the molecule. Inclusion of a Gaussian form of repulsion potential in the model gives excellent agreement for the dissociation energies, but in general extreme care must be taken when applying empirical potentials of the Rittner form to more complex systems such as ionized molecules or clusters.

Anion polarizability functions in alkali halide crystals

1997 ◽  
Vol 92 (6) ◽  
pp. 1029-1033
Author(s):  
A. BATANA ◽  
J. BRUNO ◽  
R.W. MUNN
Keyword(s):  
Alkali Halide ◽  
Alkali Halide Crystals

Controlled modulation of the binding energy of impurity states in a quantum-well system

1996 ◽  
Vol 166 (4) ◽  
pp. 447-448 ◽  
Author(s):  
Vladimir I. Belyavskii ◽  
Yurii V. Kopaev ◽  
N.V. Kornyakov
Keyword(s):  
Binding Energy ◽  
Quantum Well ◽  
Impurity States
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