|
| ISphericalTransformCints (int l, int subl=-1) |
|
SphericalTransformComponent * | new_components () |
| This must create SphericalTransformComponent's of the appropriate specialization.
|
|
void | add (int a, int b, int c, double coef, int pureindex) |
| Adds another SphericalTransformComponent.
|
|
int | cartindex (int i) const |
| Returns the Cartesian basis function index of component i.
|
|
int | pureindex (int i) const |
| Returns the solid harmonic basis function index of component i.
|
|
double | coef (int i) const |
| Returns the transform coefficient of component i.
|
|
int | a (int i) const |
| Returns the Cartesian basis function's x exponent of component i.
|
|
int | b (int i) const |
| Returns the Cartesian basis function's y exponent of component i.
|
|
int | c (int i) const |
| Returns the Cartesian basis function's z exponent of component i.
|
|
int | l () const |
| Returns the angular momentum.
|
|
int | n () const |
| Returns the number of components in the transformation.
|
|
The documentation for this class was generated from the following file: