| sc::TwoBodyGrid(3) | MPQC | sc::TwoBodyGrid(3) |
sc::TwoBodyGrid - Class TwoBodyGrid describes a set of coordinates of 2 particles.
#include <twobodygrid.h>
Inherits sc::SavableState.
TwoBodyGrid (StateIn &)
TwoBodyGrid (const Ref< KeyVal > &)
The KeyVal constructor. void save_data_state (StateOut
&)
Save the base classes (with save_data_state) and the members in the same order
that the StateIn CTOR initializes them. const std::string &
name () const
int nelem () const
const SCVector3 & origin () const
SCVector3 xyz1 (int i, const SCVector3
&O=SCVector3(0.0)) const
Cartesian coordinates of particle 1 at grid point i with respect to origin O.
SCVector3 xyz2 (int i, const SCVector3
&O=SCVector3(0.0)) const
Cartesian coordinates of particle 2 at grid point i with respect to origin O.
SCVector3 rtp1 (int i, const SCVector3
&O=SCVector3(0.0)) const
Spherical polar coordinates of particle 1 at grid point i with respect to
origin O. SCVector3 rtp2 (int i, const SCVector3
&O=SCVector3(0.0)) const
Spherical polar coordinates of particle 2 at grid point i with respect to
origin O. void print (std::ostream &o=ExEnv::out0()) const
Prints out this.
Class TwoBodyGrid describes a set of coordinates of 2 particles.
Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. This must be implemented by the derived class if the class has data.
Reimplemented from sc::SavableState.
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| Sun Oct 4 2020 | Version 2.3.1 |