Molecular g-Tensors From Spin-Orbit Quasidegenerate N-electron Valence Perturbation Theory: Benchmarks, Intruder-State Mitigation, and Practical Guidelines

Fuente: arXiv
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Bibliographic Details
Main Authors: Chiang, Nicholas Yiching, Majumder, Rajat, Sokolov, Alexander Yu.
Format: Preprint
Published: 2026
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