Unsupervised learning of phase transitions: from principal component analysis to variational autoencoders
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Abstract (arXiv)
We employ unsupervised machine learning techniques to learn latent parameters which best describe states of the two-dimensional Ising model and the three-dimensional XY model. These methods range from principal component analysis to artificial neural network based variational autoencoders. The states are sampled using a Monte-Carlo simulation above and below the critical temperature. We find that the predicted latent parameters correspond to the known order parameters. The latent representation of the states of the models in question are clustered, which makes it possible to identify phases without prior knowledge of their existence or the underlying Hamiltonian. Furthermore, we find that the reconstruction loss function can be used as a universal identifier for phase transitions.
Key facts. Cited by 47 papers in the map (data through 7 Oct 2026). First posted on arXiv 7 Mar 2017.
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Citing papers per year: 2021: 8; 2022: 7; 2023: 4; 2024: 7; 2025: 11; 2026: 10.
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- 2021Neural network based order parameter for phase transitions and its applications in high-entropy alloys12 Sep 2021
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12 most cited of 45 All 45 (JSON)
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- 2026Thermodynamic properties of chemically disordered compounds via AI-driven estimation of partition function with the PULSE method27 May 2026
- 2026Discovering quantum phenomena with Interpretable Machine Learning17 Apr 2026
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- 2026Unsupervised Discovery of Intermediate Phase Order in the Frustrated J1-J2 Heisenberg Model via Prometheus Framework25 Feb 2026
- 2026From Classical to Quantum: Extending Prometheus for Unsupervised Discovery of Phase Transitions in Three Dimensions and Quantum Systems16 Feb 2026
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12 newest of 45 All 45 (JSON)