AEGISS -- Atomic orbital and Entropy-based Guided Inference for Space Selection -- A novel semi-automated active space selection workflow for quantum chemistry and quantum computing applications

Fuente: arXiv
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Bibliographic Details
Main Authors: Tarocco, Fabio, Haase, Pi A. B., Pavošević, Fabijan, Krishna, Vijay, Guidoni, Leonardo, Knecht, Stefan, Stella, Martina
Format: Preprint
Published: 2025
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