Symmetry-Guided Machine Learning for the Discovery of Topological Phononic Materials

Project Personnel

Bolin Liao

Principal Investigator

University of California, Santa Barbara

Email

Susanne Stemmer

Co-Principal Investigator

University of California, Santa Barbara

Email

Ajit Roy

Air Force Research Laboratory

Email

Tyson Back

Air Force Research Laboratory

Email

Mingda Li

Massachusetts Institute of Technology

Email

Nina Andrejevic

Funding Divisions

Division of Materials Research (DMR)

Fundamental understanding and control of heat conduction processes in materials are important for energy infrastructure, electronic devices, and renewable energy generation systems. This project focuses on a novel property of phonons – vibrations of atoms that carry the heat in materials - called "topology". This property may allow new phenomena, such as heat conduction perpendicular to the temperature gradient direction and more efficient transport of heat waves on the material surfaces. To discover topological phonons, the research team will exploit a Materials Genome approach to search for materials hosting these special heat carriers. Once candidates are identified, the research team will synthesize and characterize them, and the results will be used to refine the search algorithm. The research team plans to establish a public database storing the heat conduction properties of a large number of materials. 

This research will not only advance the fundamental understanding of how topology affects heat conduction in real materials, but also provide new routes to realizing unusual functionalities such as heat conductors that can be switched on and off. This project also supports educational activities to teach basic materials physics concepts to K-12 and undergraduate students through hands-on class projects and short courses. To promote diversity in the materials science workforce, the team also provides research opportunities to high school and undergraduate students from underrepresented minority communities.

Publications

Virtual node graph neural network for full phonon prediction
R. Okabe, A. Chotrattanapituk, A. Boonkird, N. Andrejevic, X. Fu, T. S. Jaakkola, Q. Song, T. Nguyen, N. Drucker, S. Mu, Y. Wang, B. Liao, Y. Cheng, and M. Li
7/12/2024
Machine learning detection of Majorana zero modes from zero-bias peak measurements
M. Cheng, R. Okabe, A. Chotrattanapituk, and M. Li
7/1/2024
Precise Fermi level engineering in a topological Weyl semimetal via fast ion implantation
M. Mandal, A. Chotrattanapituk, K. Woller, L. Wu, H. Xu, N. T. Hung, N. Mao, R. Okabe, A. Boonkird, T. Nguyen, N. C. Drucker, X. M. Chen, T. Momiki, J. Li, J. Kong, Y. Zhu, and M. Li
6/1/2024
Extraordinary Thermoelectric Properties of Topological Surface States in Quantum‐Confined Cd3As2 Thin Films
W. Ouyang, A. C. Lygo, Y. Chen, H. Zheng, D. Vu, B. L. Wooten, X. Liang, J. P. Heremans, S. Stemmer, and B. Liao
5/9/2024
Topology stabilized fluctuations in a magnetic nodal semimetal
N. C. Drucker, T. Nguyen, F. Han, P. Siriviboon, X. Luo, N. Andrejevic, Z. Zhu, G. Bednik, Q. T. Nguyen, Z. Chen, L. K. Nguyen, T. Liu, T. J. Williams, M. B. Stone, A. I. Kolesnikov, S. Chi, J. Fernandez-Baca, C. S. Nelson, A. Alatas, T. Hogan, A. A. Puretzky, S. Huang, Y. Yu, and M. Li
8/25/2023
Topological Superconductors from a Materials Perspective
M. Mandal, N. C. Drucker, P. Siriviboon, T. Nguyen, A. Boonkird, T. N. Lamichhane, R. Okabe, A. Chotrattanapituk, and M. Li
8/1/2023
Panoramic Mapping of Phonon Transport from Ultrafast Electron Diffraction and Scientific Machine Learning
Z. Chen, X. Shen, N. Andrejevic, T. Liu, D. Luo, T. Nguyen, N. C. Drucker, M. E. Kozina, Q. Song, C. Hua, G. Chen, X. Wang, J. Kong, and M. Li
11/28/2022
Machine‐Learning Spectral Indicators of Topology
N. Andrejevic, J. Andrejevic, B. A. Bernevig, N. Regnault, F. Han, G. Fabbris, T. Nguyen, N. C. Drucker, C. H. Rycroft, and M. Li
10/31/2022
Elucidating proximity magnetism through polarized neutron reflectometry and machine learning
N. Andrejevic, Z. Chen, T. Nguyen, L. Fan, H. Heiberger, L. Zhou, Y. Zhao, C. Chang, A. Grutter, and M. Li
3/1/2022

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Research Highlights

Data Driven Discovery of Topological Phononic Materials
Mingda Li, Massachusetts Institute of Technology
10/1/2022
Machine-learning Spectral Indicators of Topology
Mingda Li, Massachusetts Institute of Technology
10/1/2022
Graduate Training in Machine Learning for Materials Design
Mingda Li, Massachusetts Institute of Technology
10/1/2022

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Designing Materials to Revolutionize and Engineer our Future (DMREF)