A simple model potential to analyze the band structure of crystals with a chalcopyrite lattice

1971 ◽  
Vol 14 (11) ◽  
pp. 1573-1575
Author(s):  
A. S. Poplavnoi ◽  
Yu. I. Polygalov
Keyword(s):  
Simple Model ◽  
Band Structure ◽  
Model Potential ◽  
Chalcopyrite Lattice

Discussion of the band structure effects on thermoemission as deduced from a simple model

1976 ◽  
Vol 37 (2) ◽  
pp. 149-158 ◽  
Author(s):  
A.K. Bhattacharjee ◽  
B. Caroli ◽  
D. Saint-James
Keyword(s):  
Simple Model ◽  
Band Structure

Dipole moments and conformation energies for substituted ethanes

1982 ◽  
Vol 60 (16) ◽  
pp. 2049-2056 ◽  
Author(s):  
Victor M. S. Gil ◽  
António J. C. Varandas
Keyword(s):  
Simple Model ◽  
Potential Energy ◽  
Dipole Moments ◽  
Model Potential ◽  
Energy Functions ◽  
Electric Dipole Moments ◽  
Potential Energy Functions ◽  
Rotational Isomeric State ◽  
State Models ◽  
The Continuum

By using simple model potential energy functions for internal rotation of ethane derivatives (CH2X–CH2X and CHX2–CHX2), a comparison was made between the continuum and the rotational isomeric state models for obtaining conformation information (especially energy differences for the staggered conformers) from electric dipole moments. It is found that the results obtained by the two procedures may be appreciably different, depending on the features of the conformational energy function and on the temperature considered.

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