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location: Develop / noxci / no1ci

INTEGER no1ci(DSCFINFO *pInfo,REAL *pEne);

Types are defined here.

NOCI $\langle A_0\vert\tilde{H}\vert B_0\rangle=\langle A_0\vert H+\frac{1}{2}(\sum\hat{E}_{ij}^{ab}H+\sum H\hat{E}_{ij}^{ab})\vert B_0\rangle$ 

HEADER: source/noxci/NoXci.h

LIB: libnoxci.a

SOURCE source/noxci/NoXci.cpp

DSCFINFO *pInfo

Input, pointer to DSCFINFO structure

REAL *pEne

Output, the lowest energy of no1ci (save to the address).

Return Code

INTEGER, 0 if succeeded, non-zero otherwise