Mhf. Bettega et al., NOTE ON THE GENERATION OF GAUSSIAN BASES FOR PSEUDOPOTENTIAL CALCULATIONS, International journal of quantum chemistry, 60(4), 1996, pp. 821-824
We present a technique to generate Cartesian Gaussian bases for electr
onic configuration and cross-section calculations on molecules. The te
chnique is specially useful for pseudopotential work, when the bases c
annot be tabulated because they depend on the specific choice of the p
seudopotential. (C) 1996 John Wiley & Sons, Inc.