The hybrid anti-symmetrized coupled channels method (haCC) for the tRecX
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The hybrid anti-symmetrized coupled channels method (haCC) for the tRecX
code
We present a new implementation of the hybrid antisymmetrized Coupled Channels (haCC) method in the framework of the tRecX [A. Scrinzi, Comp. Phys. Comm., 270:108146, 2022.]. The method represents atomic and molecular multi-electron functions by combining CI functions, Gaussian molecular orbitals, and a numerical single-electron basis. It is suitable for …