Operator approach in the linearized augmented-plane-wave method: Efficient electronic-structure calculations including forces

1992 ◽  
Vol 45 (4) ◽  
pp. 1597-1604 ◽  
Author(s):  
S. Goedecker ◽  
K. Maschke
Keyword(s):  
Electronic Structure ◽  
Plane Wave ◽  
Electronic Structure Calculations ◽  
Wave Method ◽  
Operator Approach ◽  
Augmented Plane Wave ◽  
Plane Wave Method ◽  
Augmented Plane Wave Method ◽  
Linearized Augmented Plane Wave ◽  
Structure Calculations

Calculation of atomic forces using the linearized-augmented-plane-wave method

1994 ◽  
Vol 50 (12) ◽  
pp. 8846-8848 ◽  
Author(s):  
H. G. Krimmel ◽  
J. Ehmann ◽  
C. Elsässer ◽  
M. Fähnle ◽  
J. M. Soler
Keyword(s):  
Plane Wave ◽  
Wave Method ◽  
Augmented Plane Wave ◽  
Plane Wave Method ◽  
Augmented Plane Wave Method ◽  
Linearized Augmented Plane Wave
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