MPQC
3.0.0-alpha
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Public Member Functions | |
AccumEffectiveH (SCF *) | |
virtual void | process (SCMatrixBlockIter &, SCMatrixBlockIter &) |
Public Member Functions inherited from sc::BlockedSCElementOp2 | |
void | working_on (int) |
int | current_block () const |
Public Member Functions inherited from sc::SCElementOp2 | |
SCElementOp2 (StateIn &s) | |
virtual int | has_collect () |
virtual void | defer_collect (int) |
virtual int | has_side_effects () |
virtual int | has_side_effects_in_arg () |
virtual void | collect (const Ref< MessageGrp > &) |
void | process_base (SCMatrixBlock *, SCMatrixBlock *) |
virtual void | process_spec_rect (SCMatrixRectBlock *, SCMatrixRectBlock *) |
virtual void | process_spec_ltri (SCMatrixLTriBlock *, SCMatrixLTriBlock *) |
virtual void | process_spec_diag (SCMatrixDiagBlock *, SCMatrixDiagBlock *) |
virtual void | process_spec_vsimp (SCVectorSimpleBlock *, SCVectorSimpleBlock *) |
Public Member Functions inherited from sc::SavableState | |
SavableState & | operator= (const SavableState &) |
void | save_state (StateOut &) |
Save the state of the object as specified by the StateOut object. More... | |
void | save_object_state (StateOut &) |
This can be used for saving state when the exact type of the object is known for both the save and the restore. More... | |
virtual void | save_vbase_state (StateOut &) |
Save the virtual bases for the object. More... | |
virtual 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. More... | |
Public Member Functions inherited from sc::DescribedClass | |
DescribedClass (const DescribedClass &) | |
DescribedClass & | operator= (const DescribedClass &) |
ClassDesc * | class_desc () const MPQC__NOEXCEPT |
This returns the unique pointer to the ClassDesc corresponding to the given type_info object. More... | |
const char * | class_name () const |
Return the name of the object's exact type. | |
int | class_version () const |
Return the version of the class. | |
virtual void | print (std::ostream &=ExEnv::out0()) const |
Print the object. | |
Ref< DescribedClass > | ref () |
Return this object wrapped up in a Ref smart pointer. More... | |
Public Member Functions inherited from sc::RefCount | |
size_t | identifier () const |
Return the unique identifier for this object that can be compared for different objects of different types. More... | |
int | lock_ptr () const |
Lock this object. | |
int | unlock_ptr () const |
Unlock this object. | |
void | use_locks (bool inVal) |
start and stop using locks on this object | |
refcount_t | nreference () const |
Return the reference count. | |
refcount_t | reference () |
Increment the reference count and return the new count. | |
refcount_t | dereference () |
Decrement the reference count and return the new count. | |
int | managed () const |
void | unmanage () |
Turn off the reference counting mechanism for this object. More... | |
Protected Member Functions | |
virtual void | init ()=0 |
int | index (int hindex, int shelli, int shellj) |
int | shell (double) |
double & | coef (int i, int j, int k) |
Protected Member Functions inherited from sc::SavableState | |
SavableState (const SavableState &) | |
SavableState (StateIn &) | |
Each derived class StateIn CTOR handles the restore corresponding to calling save_object_state, save_vbase_state, and save_data_state listed above. More... | |
Protected Member Functions inherited from sc::RefCount | |
RefCount (const RefCount &) | |
RefCount & | operator= (const RefCount &) |
Protected Attributes | |
SCF * | scf_ |
double | coef_ [18] |
Additional Inherited Members | |
Static Public Member Functions inherited from sc::SavableState | |
static void | save_state (SavableState *s, StateOut &) |
static SavableState * | restore_state (StateIn &si) |
Restores objects saved with save_state. More... | |
static SavableState * | key_restore_state (StateIn &si, const char *keyword) |
Like restore_state, but keyword is used to override values while restoring. | |
static SavableState * | dir_restore_state (StateIn &si, const char *objectname, const char *keyword=0) |