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Adding Temperature to the Adiabatic Connection: Hybrid Functionals for Static and Dynamic Correlation

Matz, Florian et al.
arXiv (All) · Papers
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chemical-physicsquantum-physics
Capturing static and dynamic electron correlation simultaneously at manageable computational cost remains a key challenge in electronic structure theory. Motivated by the recurring role of effective temperature in self-consistent field methods we extend the adiabatic connection mechanism from densit
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