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20192022
most citedUsing hyper-optimized tensor networks and first-principles electronic structure to simulate experimental properties of the giant {Mn84} torus

3 citations · 3 across the 2 of their papers we have counts for

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cond-mat.mtrl-sci2020

Long-Range Magnetic Exchange Pathways in Complex Clusters from First-Principles

Dian-Teng Chen, Jia Chen, Xiang-Guo Li +3

This work builds a bridge between density functional theory (DFT) and model interpretations of Anderson's superexchange theory by constructing a -- model with DFT Wannier…

cond-mat.mtrl-sci2019

Three Jahn-Teller states of matter in the spin-crossover system Mn(taa)

Jie-Xiang Yu, Dian-Teng Chen, Jie Gu +7

Three high-spin phases recently discovered in the spin-crossover system Mn(taa) are identified through analysis by a combination of first-principles calculations and Monte Carlo si…