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Arrested phase separation in double-exchange models: machine-learning enabled large-scale simulation

arXiv 2105.08221 ↗First posted 18 May 2021cond-mat.str-el cond-mat.dis-nn cond-mat.mtrl-scicited by 5

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Abstract (arXiv)

We present large-scale dynamical simulations of electronic phase separation in the single-band double-exchange model based on deep-learning neural-network potentials trained from small-size exact diagonalization solutions. We uncover an intriguing correlation-induced freezing behavior as doped holes are segregated from half-filled insulating background during equilibration. While the aggregation of holes is stabilized by the formation of ferromagnetic clusters through Hund's coupling between charge carriers and local magnetic moments, this stabilization also creates confining potentials for holes when antiferromagnetic spin-spin correlation is well developed in the background. The dramatically reduced mobility of the self-trapped holes prematurely disrupts further growth of the ferromagnetic clusters, leading to an arrested phase separation. Implications of our findings for phase separation dynamics in materials that exhibit colossal magnetoresistance effect are discussed.

Key facts. Cited by 5 papers in the map (data through 7 Oct 2026). Builds on 3 of its 87 references that are in the map. First posted on arXiv 18 May 2021.

Builds on

3 of 87 references.

References · 3

  1. 2019PyTorch: An Imperative Style, High-Performance Deep Learning Librarycited by 20,160
  2. 2017Deep Potential Molecular Dynamics: a scalable model with the accuracy of quantum mechanicscited by 213
  3. 2018Machine learning electron correlation in a disordered mediumcited by 17

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Cited by year (2026 to 7 Oct)

Citing papers per year: 2021: 1; 2022: 1; 2023: 0; 2024: 0; 2025: 0; 2026: 3.

5 papers.