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DAVIDSON PARAMETER
DAVIDSON RDIIS
DIAGONALIZER {DAVIDSON,NONHERMIT,PCG} [MINIMIZE]
FORCE STATE
LOCALIZATION
MOLECULAR STATES
LR-TDDFT
PCG PARAMETER
PROPERTY { STATE }
RANDOMIZE
REORDER
REORDER LOCAL
ROTATION PARAMETER
STATES [MIXED,SINGLET,TRIPLET]
TAMM-DANCOFF [SUBSPACE,OPTIMIZE]
TD_METHOD_A [ functionals ]
Costas Bekas
2008-09-04