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20242026
most citedA Neural-Network-Based Selective Configuration Interaction Approach to Molecular Electronic Structure

2 citations · 2 across the 11 of their papers we have counts for

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physics.chem-ph2024

C-Pol: Point charge perturbation scheme for mapping tensor moment surfaces

Anoop Ajaya Kumar Nair, Julian Beßner, Timo Jacob +1

We present an efficient moment-based perturbation scheme for evaluating polarizability tensors of small molecules at a fraction of the computational cost of conventional energy-bas…

physics.chem-ph2024★ 2 cited

A Neural-Network-Based Selective Configuration Interaction Approach to Molecular Electronic Structure

Yorick L. A. Schmerwitz, Louis Thirion, Gianluca Levi +4

By combining Hartree-Fock with a neural-network-supported quantum-cluster solver proposed recently in the context of solid-state lattice models, we formulate a scheme for selective…