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MPQC
2.3.1
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PsiExEnv specifies a Psi calculation. More...
#include <psiexenv.h>


Public Member Functions | |
| PsiExEnv (const Ref< KeyVal > &) | |
| PsiExEnv (char *cwd, char *fileprefix, int nscratch, char **scratch) | |
| Ref< PsiInput > | get_psi_input () const |
| Returns the PsiInput object which PsiExEnv uses. | |
| Ref< PsiFile11 > | get_psi_file11 () const |
| Returns the PsiFile11 object which PsiExEnv uses. | |
| int | run_psi () |
| Executes Psi input+driver. | |
| int | run_psi_module (char *) |
| Executes a Psi module. | |
| string | get_cwd () const |
| Returns current working directory. | |
| string | get_fileprefix () const |
| Returns the Psi file prefix. | |
| int | get_nscratch () const |
| Returns the number of scratch locations. | |
| string | get_scratch (int i) const |
| Returns the ith scratch location. | |
| void | print (std::ostream &o=ExEnv::out0()) const |
| Print the object. | |
Public Member Functions inherited from sc::DescribedClass | |
| DescribedClass (const DescribedClass &) | |
| DescribedClass & | operator= (const DescribedClass &) |
| ClassDesc * | class_desc () const throw () |
| 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. | |
Public Member Functions inherited from sc::RefCount | |
| 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... | |
| int | managed () const |
| Return 1 if the object is managed. Otherwise return 0. | |
Public Member Functions inherited from sc::Identity | |
| Identifier | identifier () |
| Return the Identifier for this argument. More... | |
Additional Inherited Members | |
Protected Member Functions inherited from sc::RefCount | |
| RefCount (const RefCount &) | |
| RefCount & | operator= (const RefCount &) |
PsiExEnv specifies a Psi calculation.