⇤ ← Revision 1 as of 2016-01-12 08:30:27
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]]||NOCI <<latex($\langle A_0\vert\tilde{H}\vert B_0\rangle=\langle A_0\vert H+\frac{1}{2}(\sum\hat{E}_{ij}^{ab}H+\sum H\hat{E}_{ij}^{ab})\vert B_0\rangle$)>> | NOCI <<latex($\langle A_0\vert\tilde{H}\vert B_0\rangle=\langle A_0\vert H+\frac{1}{2}(\sum\hat{E}_{ij}^{ab}H+\sum H\hat{E}_{ij}^{ab})\vert B_0\rangle$)>> |
INTEGER no1ci(DSCFINFO *pInfo,REAL *pEne);
NOCI
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