Determinant-based CI program. More...
|Rotate a set of vectors around an arbitrary axis Vectors are rows of input matrix. |
|SharedWavefunction||psi::detci::detci (SharedWavefunction, Options &)|
Determinant-based CI program.
DETERMINANT CI Program, incorporating Abelian point-group symmetry
C. David Sherrill Center for Computational Quantum Chemistry University of Georgia August 1994
Updated 3/95 to do frozen core and virtuals correctly Updated 5/95 to do RAS CI's again Updated 2/96 to clean up code and rename DETCI