JDFTx  1.4.2
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Electronic DFT

Modules

 Electronic system
 
 Ionic system
 
 Exchange-correlation terms
 
 Long-range interactions
 
 Outputs
 

Files

file  Control.h
 

Classes

class  Control
 Miscellaneous flags controlling electronic DFT. More...
 
class  Everything
 Container class that contains, well, everything. More...
 
class  Symmetries
 Symmetry detection and symmetrization of various quantities. More...
 

Enumerations

enum  BasisKdep { BasisKpointDep, BasisKpointIndep }
 K-point dependence of basis.
 
enum  ElecEigenAlgo { ElecEigenCG, ElecEigenDavidson }
 Electronic eigenvalue method.
 
enum  SymmetryMode { SymmetriesNone, SymmetriesAutomatic, SymmetriesManual }
 

Detailed Description