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MPQC
3.0.0-alpha
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PsiCCSD_T is a concrete implementation of Psi CCSD(T) wave function. More...
#include <chemistry/qc/psi/psicc.h>

Public Member Functions | |
| PsiCCSD_T (const Ref< KeyVal > &) | |
| PsiCCSD_T (StateIn &) | |
| 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. | |
Protected Member Functions | |
| void | write_input (int conv) |
| Prepares a complete Psi input file. The input file is assumed to have been opened. | |
PsiCCSD_T is a concrete implementation of Psi CCSD(T) wave function.
| void sc::PsiCCSD_T::save_data_state | ( | StateOut & | ) | [virtual] |