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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
Subjects:	Chemical Physics Strongly Correlated Electrons Computational Physics Quantum Physics
Online Access:	Acceder al recurso
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