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Minimum-Energy Conical Intersections by Compressed Multistate Pair-Density Functional Theory.

Paul B. Calio,Matthew R. Hermes,Jie J. Bao,Ignacio Fdez. Galvan,Roland Lindh,Donald G. Truhlar,Laura Gagliardi

JOURNAL OF PHYSICAL CHEMISTRY A（2024）

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Key words
Hybrid Density Functionals,Density-Functional Theory,Electronic Structure Calculations
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