Allink
v0.1
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Energy contribution from the density functional hamiltonian. More...
#include <VarData.h>
Public Member Functions | |
MatInt (int NType, int NOrd) | |
Creates and fill the matrix. | |
void | FillEntries (double *Matr, int Ord) |
Fill all the entries. | |
int | IntType (int t1, int t2) |
Matrix element of the two type interaction. | |
int | IntType (int t1, int t2, int t3) |
Matrix element of the two type interaction. | |
double | Coeff (int t1, int t2) |
Prefactor of the force. | |
double | Coeff (int t1, int t2, int t3) |
Prefactor of the force. | |
void | SetCoeff (double Co, int t1, int t2) |
Set the prefactor. | |
void | SetCoeff (double Co, int t1, int t2, int t3) |
Set the prefactor. | |
void | Print () |
Print the entries. | |
int | pNType () |
Print n type. | |
void | Rescale (double SFactor, int Order) |
Rescale entries. | |
Energy contribution from the density functional hamiltonian.