|
MPQC
3.0.0-alpha
|
This permits an Array<2> and an Array<4> to be used with SelfConsistentExtrapolation derivatives. More...
#include <chemistry/qc/lmp2/extrap.h>

Public Member Functions | |
| Array24SCExtrapData (Array< 2 > &, bool distrib2, Array< 4 > &, bool distrib4, const sc::Ref< sc::MessageGrp > &msg) | |
| void | save_data_state (sc::StateOut &) |
| Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. | |
| sc::SCExtrapData * | copy () |
| Return a copy of this. | |
| void | zero () |
| Set this to zero. | |
| void | accumulate_scaled (double, const sc::Ref< sc::SCExtrapData > &) |
| The passed SCExtrapData is accumulated into this after applying the scaling factor. | |
| void | update (Array< 2 > &array2, Array< 4 > &array4) |
This permits an Array<2> and an Array<4> to be used with SelfConsistentExtrapolation derivatives.
| void sc::sma2::Array24SCExtrapData::accumulate_scaled | ( | double | scale, |
| const sc::Ref< sc::SCExtrapData > & | |||
| ) | [virtual] |
The passed SCExtrapData is accumulated into this after applying the scaling factor.
Implements sc::SCExtrapData.
| sc::SCExtrapData* sc::sma2::Array24SCExtrapData::copy | ( | ) | [virtual] |
Return a copy of this.
Implements sc::SCExtrapData.
| void sc::sma2::Array24SCExtrapData::save_data_state | ( | sc::StateOut & | ) | [virtual] |
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::SCExtrapData.
| void sc::sma2::Array24SCExtrapData::zero | ( | ) | [virtual] |
Set this to zero.
Implements sc::SCExtrapData.