
CAMM publications are organized by year and research group to highlight the Center’s work in quantum materials, AI-enabled discovery, and materials for extreme environments. CAMM principal investigators are bolded in each citation, and DOI links are provided.
2026
IRG 1
S. Akram, S. Paul, C. Kovacs, Vasileios Maroulas, Adrian Del Maestro, and Konstantinos D. Vogiatzis. “Accurate helium–benzene potential: From CCSD(T) to Gaussian process regression.” Journal of Chemical Physics 164, 114108 (2026). DOI: https://doi.org/10.1063/5.0322444
X. Wu, X. Hao, Z. Chen, Y. Cai, M. Wu, C. Chen, K. Wang, F. Ming, Steven Johnston, Rui-Xing Zhang, and Hanno H. Weitering. “Microscopic Fingerprint of Chiral Superconductivity.” Physical Review X 16, 011026 (2026). DOI: https://doi.org/10.1103/jmmf-mpr8
G. Zu, N. Mao, C. Felser, and Yang Zhang. “Interpretation of Crystal Energy Landscapes with Kolmogorov–Arnold Networks.” Nano Letters 26, 5036 (2026). DOI: https://doi.org/10.1021/acs.nanolett.6c00039
J. Xie, Wonhee Ko, Rui-Xing Zhang, and B. Yao. “Physics-guided deep learning with adversarial domain adaptation: Applications to STM image denoising.” Journal of Applied Physics 139, 144303 (2026). DOI: https://doi.org/10.1063/5.0316661
J. Tang, T. S. Ding, S. Ding, J. Li, C. Yi, T. Tang, Z. Huang, X. Wu, Z. Huang, B. Singh, T. Qian, V. Belosevich, M. Guo, A. Gao, N. Peshcherenko, Z. Sun, M. Shehabeldin, K. Watanabe, T. Taniguchi, A. N. Pasupathy, C. Felser, K. S. Burch, N. Ni, Y. Wang, Yang Zhang, S.-Y. Xu, and Q. Ma. “Bistable superlattice switching in a quantum spin Hall insulator.” Nature 652, 68 (2026). DOI: https://doi.org/10.1038/s41586-026-10309-w
J. O. Agada and Arpan Biswas. “LLMs, RAG systems, and agents in crystalline materials discovery and characterization: A systematic review.” MRS Bulletin 1557 (2026). DOI: https://doi.org/10.1557/s43577-026-01057-3
IRG 2
V. Chawla, Dayakar Penumadu, and Sergei V. Kalinin. “Automation of nanoindentation targeting control using machine vision.” Review of Scientific Instruments 97, 043901 (2026). DOI: https://doi.org/10.1063/5.0307893
G. Adamson, J. M. Hirtz, C. Overstreet, E. O’Quinn, C. Kinsler-Fedon, P. Simon, C. Park, X. Wang, T. Liang, Haixuan Xu, V. Keppens, Katharine Page, and Maik Lang. “Influence of Compositional Complexity on Amorphization Resistance of Swift Heavy Ion Irradiated Titanate Pyrochlores.” Inorganic Chemistry 65, 280–290 (2026). DOI: https://doi.org/10.1021/acs.inorgchem.5c04254
Y. Liu and Sergei V. Kalinin. “Pareto-Optimal Experimentation: Human-Guided Multi-Objective Bayesian Optimization in Scanning Probe Microscopy.” Nano Letters 26, 441–447 (2026). DOI: https://doi.org/10.1021/acs.nanolett.5c05373
A. T. Wood, S. Puplampu, K. McNulty, B. H. Jared, S. Babu, and Dayakar Penumadu. “Validation of Profilometry-based Indentation Plastometry (PIP) testing for rapid qualification of Electron Beam-Powder-Bed Fusion (EB-PBF) with Ti–6Al–4V builds.” Advanced Engineering Materials e202502047 (2026). DOI: https://doi.org/10.1002/adem.202502047
M. D. Hossain, N. S. McIlwaine, N. O. Marquez-Rios, A. C. Feltrin, V. Chawla, R. A. Mayonovic, W. G. Fahrenholtz, Dayakar Penumadu, E. Zurek, D. W. Brenner, D. E. Wolfe, S. Divilov, H. Eckert, S. Curtarolo, and J.-P. Maria. “Superhard refractory high-entropy diborides.” Physical Review Materials 10, 033604 (2026). DOI: https://doi.org/10.1103/hqlp-dcvl
J. Marshall, S. L. Sanchez, R. Desai, E. Foadian, U. Pratiush, A. Mannodi-Kanakkithodi, Sergei V. Kalinin, and Mahshid Ahmadi. “POLARIS: perovskite optimization using LLM-assisted refinement and intelligent screening.” Digital Discovery 5, 1765–1782 (2026). DOI: https://doi.org/10.1039/D5DD00378D
2025
IRG 1
M. Thamm, H. Radhakrishnan, H. Barghathi, C. M. Herdman, Arpan Biswas, B. Rosenow, and Adrian Del Maestro. “Berezinskii-Kosterlitz-Thouless Renormalization Group Flow at a Quantum Phase Transition.” Physical Review Letters 135, 116002 (2025). DOI: https://doi.org/10.1103/4xdz-5vq7
P. Park, W. Cho, C. Kim, Y. An, K. Iida, R. Kajimoto, S. Matin, S.-S. Zhang, Cristian D. Batista, and J.-G. Park. “Spin Dynamics of Triple-q Magnetic Orderings in a Triangular Lattice: Implications for Multi-Q Orderings in General Two-Dimensional Lattices.” Physical Review X 15, 031032 (2025). DOI: https://doi.org/10.1103/y9ly-4kld
H. Zhao, R. Millan-Solsona, M. Checa, S. R. Brown, J. L. Morrell-Falvey, L. Collins, and Arpan Biswas. “A bi-channel aided stitching of atomic force microscopy images.” Scientific Reports 15, 41897 (2025). DOI: https://doi.org/10.1038/s41598-025-25855-y
B. Venkatesan, S.-Y. Guan, J.-T. Chang, S.-B. Chiu, P.-Y. Yang, C.-C. Su, T.-R. Chang, K. Raju, R. Sankar, S. Fongchaiya, M.-W. Chu, C.-S. Chang, G. Chang, H. Lin, Adrian Del Maestro, Y.-J. Kao, and T.-M. Chuang. “Direct visualization of a disorder driven electronic smectic phase in nonsymmorphic square-net semimetal GdSbTe.” npj Quantum Materials 10, 56 (2025). DOI: https://doi.org/10.1038/s41535-025-00779-y
Y. Choi, S. Lee, D. Shin, S. Sim, M. Jung, D. Wulferding, M. Kim, J. Eom, M. Mostafa, Wonhee Ko, S. Cha, J. Hwang, H. Y. Jeong, K. K. Kim, and W. S. Choi. “Universal Fabrication of Graphene/Perovskite Oxide Hybrid Heterostructures.” Small Structures 202500613 (2025). DOI: https://doi.org/10.1002/sstr.202500613
C. Farhang, W. R. Meier, W. Lu, J. Li, Y. Wu, S. Mozaffari, R. P. Madhogaria, Yang Zhang, David Mandrus, and J. Xia. “Discovery of an intermediate nematic state in a bilayer kagome metal ScV6Sn6.” Nature Communications 16, 1038 (2025). DOI: https://doi.org/10.1038/s41467-025-63294-5
T. Xi, H. Jiang, J. Li, Y. He, Y. Gu, C. Fox, L. Primeau, Y. Mao, J. Rollins, T. Taniguchi, K. Watanabe, D. van der Weide, D. Rhodes, Yang Zhang, Y. Wang, and J. Xiao. “Terahertz sensing based on the nonlinear electrodynamics of the two-dimensional correlated topological semimetal TaIrTe4.” Nature Electronics 8, 578–586 (2025). DOI: https://doi.org/10.1038/s41928-025-01397-z
M. M. Bermudez, R. A. Borzi, Alan Tennant, and S. A. Grigera. “Low-temperature state of the spin-ice material: Reverse Monte Carlo investigation.” Physical Review B 112, 094431 (2025). DOI: https://doi.org/10.1103/8xtq-tfx3
Arpan Biswas, R. Vasudevan, R. Pant, I. Takeuchi, H. Funakubo, and Y. Liu. “SANE: Strategic autonomous non-smooth exploration for multiple optima discovery in multi-modal and non-differentiable black-box functions.” Digital Discovery 4, 853–867 (2025). DOI: https://doi.org/10.1039/d4dd00299g
R. Bulanadi, J. Chowdhury, H. Funakubo, M. Ziatdinov, R. Vasudevan, Arpan Biswas, and Y. Liu. “Beyond Optimization: Exploring Novelty Discovery in Autonomous Experiments.” ACS Nanoscience Au 6, 86–94 (2025). DOI: https://doi.org/10.1021/acsnanoscienceau.5c00106
J. Tang, T. S. Ding, C. Wang, N. Mao, V. Belosevich, Yang Zhang, X. Qian, and Q. Ma. “Quantum spin Hall effects in van der Waals materials.” Advanced Quantum Technologies 8, e00327 (2025). DOI: https://doi.org/10.1002/qute.202500327
M. Naamneh, E. C. O’Quinn, E. Paris, D. McNally, Y. Tseng, W. R. Pudelko, D. J. Gawryluk, J. Shamblin, B. Cohen-Stead, M. Shi, M. Radovic, Maik Lang, T. Schmitt, Steven Johnston, and N. C. Plumb. “Persistence of small polarons into the superconducting doping range of Ba1−xKxBiO3.” Physical Review Research 7, 043082 (2025). DOI: https://doi.org/10.1103/s3p1-cy1s
P. Siwakoti, D. Gong, S. Pandey, J. Li, L. Primeau, U. Lamichhane, B. R. Sankhi, Y. Xin, E. Karapetrova, J. Strempfer, Y. Choi, Yang Zhang, D. Meyers, and J. Liu. “Enhancing anomalous Hall effect with suppressed ferromagnetism in the SrTiO3-confined bilayer heterostructure of ultrathin SrRuO3 and SrIrO3.” Applied Materials Today 47, 102960 (2025). DOI: https://doi.org/10.1016/j.apmt.2025.102960
H. Jiang, T. Xi, J. Li, Y. He, H. Ma, Y. Mao, T. Taniguchi, K. Watanabe, D. A. Rhodes, Yang Zhang, J. Xiao, and Y. Wang. “Probing interplay of topological properties and electron correlation in TaIrTe4 via nonlinear Hall effect.” Nature Communications 16, 6351 (2025). DOI: https://doi.org/10.1038/s41467-025-61347-3
D. Kalita, K. Mulewska, I. Jóźwik, Y. Zhang, Ł. Kurpaska, Philip D. Rack, W. J. Weber, and J. Jagielski. “Effect of Zr Addition on the Structure, Nanomechanical Properties, and Helium Irradiation Behavior of the Novel MoTaTiV Body-Centered Cubic Concentrated Solid Solution Alloy.” Journal of Nuclear Materials 615, 155994 (2025). DOI: https://doi.org/10.1016/j.jnucmat.2025.155994
D. Kalita, A. Esfandiarpour, I. Jóźwik, Y. Zhang, J. Byggmästar, M. J. Alava, Ł. Kurpaska, W. J. Weber, Philip D. Rack, and J. Jagielski. “High temperature He bubble evolution and thermal stability of the WTaCrV refractory concentrated solid solution alloy.” Materials & Design 252, 113751 (2025). DOI: https://doi.org/10.1016/j.matdes.2025.113751
R. Emery, S. B. Puplampu, A. Wood, Dayakar Penumadu, Eric Lass, J. Lasseter, K. A. Unocic, S. Chen, Y. Zhao, Steve Zinkle, T. Liang, Haixuan Xu, D. A. Gilbert, C. C. Buchanan, P. K. Liaw, and Philip D. Rack. “Thin film combinatorial sputtering of TaTiHfZr refractory compositionally complex alloys for rapid materials discovery.” Materials & Design 250, 113643 (2025). DOI: https://doi.org/10.1016/j.matdes.2025.113643
Y. Mu, J. Liang, Z. Xi, J. Li, Y. Zhou, L. Shi, L. Lei, S. Yang, and X. Sun. “Compositional gradient-driven design of additively manufactured nickel-based superalloys for enhanced 900°C strength-ductility synergy via Ti/Al optimization.” Materials Today Communications 49, 113751 (2025). DOI: https://doi.org/10.1016/j.mtcomm.2025.113751
IRG 2
A. Raghavan, U. Pratiush, M. Valleti, R. Liu, R. Emery, H. Funakubo, Y. Liu, Philip D. Rack, and Sergei Kalinin. “Invariant discovery of features across multiple length scales: Applications in microscopy and autonomous materials characterization.” Journal of Applied Physics 137, 034901 (2025). DOI: https://doi.org/10.1063/5.0233070
Y. Liu, R. Proksch, J. Bemis, U. Pratiush, A. Dubey, Mahshid Ahmadi, R. Emery, Philip D. Rack, Y.-C. Liu, J.-C. Yang, and Sergei V. Kalinin. “Machine Learning-Based Reward-Driven Tuning of Scanning Probe Microscopy: Toward Fully Automated Microscopy.” ACS Nano 19, 19659–19669 (2025). DOI: https://doi.org/10.1021/acsnano.4c18760
B. N. Slautin, Y. Liu, J. Dec, V. V. Shvartsman, D. C. Lupascu, M. A. Ziatdinov, and Sergei V. Kalinin. “Measurements with noise: Bayesian optimization for co-optimizing noise and property discovery in automated experiments.” Digital Discovery 4, 1066–1074 (2025). DOI: https://doi.org/10.1039/d4dd00391h
B. N. Slautin, Y. Liu, K. Barakati, Y. Liu, R. Emery, S. Hong, A. Dubey, V. V. Shvartsman, D. C. Lupascu, S. L. Sanchez, Mahshid Ahmadi, Y. Kim, E. Strelcov, K. A. Brown, Philip D. Rack, and Sergei V. Kalinin. “Materials discovery in combinatorial and high-throughput synthesis and processing: A new frontier for SPM.” Applied Physics Reviews 12, 031321 (2025). DOI: https://doi.org/10.1063/5.0259851
Mahshid Ahmadi and Sergei V. Kalinin. “Learning the flow from the get-go.” Nature Chemical Engineering 2, 472–473 (2025). DOI: https://doi.org/10.1038/s44286-025-00261-3
U. Pratiush, Sergei Kalinin, et al. “Scientific exploration with expert knowledge (SEEK) in autonomous scanning probe microscopy with active learning.” Digital Discovery 4, Jan. 2025. DOI: https://doi.org/10.1039/D4DD00277F
J. Li and Haixuan Xu. “Dislocation properties in BCC refractory compositionally complex alloys from atomistic simulations.” Computational Materials Science 253, 113859 (2025). DOI: https://doi.org/10.1016/j.commatsci.2025.113859
M. Naamneh, E. C. O’Quinn, E. Paris, D. McNally, Y. Tseng, W. R. Pudelko, D. J. Gawryluk, J. Shamblin, B. Cohen-Stead, M. Shi, M. Radovic, Maik Lang, T. Schmitt, Steven Johnston, and N. C. Plumb. “Persistence of small polarons into the superconducting doping range of Ba1−xKxBiO3.” Physical Review Research 7, 043082 (2025). DOI: https://doi.org/10.1103/s3p1-cy1s
P. Siwakoti, D. Gong, S. Pandey, J. Li, L. Primeau, U. Lamichhane, B. R. Sankhi, Y. Xin, E. Karapetrova, J. Strempfer, Y. Choi, Yang Zhang, D. Meyers, and J. Liu. “Enhancing anomalous Hall effect with suppressed ferromagnetism in the SrTiO3-confined bilayer heterostructure of ultrathin SrRuO3 and SrIrO3.” Applied Materials Today 47, 102960 (2025). DOI: https://doi.org/10.1016/j.apmt.2025.102960
H. Jiang, T. Xi, J. Li, Y. He, H. Ma, Y. Mao, T. Taniguchi, K. Watanabe, D. A. Rhodes, Yang Zhang, J. Xiao, and Y. Wang. “Probing interplay of topological properties and electron correlation in TaIrTe4 via nonlinear Hall effect.” Nature Communications 16, 6351 (2025). DOI: https://doi.org/10.1038/s41467-025-61347-3
D. Kalita, K. Mulewska, I. Jóźwik, Y. Zhang, Ł. Kurpaska, Philip D. Rack, W. J. Weber, and J. Jagielski. “Effect of Zr Addition on the Structure, Nanomechanical Properties, and Helium Irradiation Behavior of the Novel MoTaTiV Body-Centered Cubic Concentrated Solid Solution Alloy.” Journal of Nuclear Materials 615, 155994 (2025). DOI: https://doi.org/10.1016/j.jnucmat.2025.155994
D. Kalita, A. Esfandiarpour, I. Jóźwik, Y. Zhang, J. Byggmästar, M. J. Alava, Ł. Kurpaska, W. J. Weber, Philip D. Rack, and J. Jagielski. “High temperature He bubble evolution and thermal stability of the WTaCrV refractory concentrated solid solution alloy.” Materials & Design 252, 113751 (2025). DOI: https://doi.org/10.1016/j.matdes.2025.113751
R. Emery, S. B. Puplampu, A. Wood, Dayakar Penumadu, Eric Lass, J. Lasseter, K. A. Unocic, S. Chen, Y. Zhao, Steve Zinkle, T. Liang, Haixuan Xu, D. A. Gilbert, C. C. Buchanan, P. K. Liaw, and Philip D. Rack. “Thin film combinatorial sputtering of TaTiHfZr refractory compositionally complex alloys for rapid materials discovery.” Materials & Design 250, 113643 (2025). DOI: https://doi.org/10.1016/j.matdes.2025.113643
Y. Mu, J. Liang, Z. Xi, J. Li, Y. Zhou, L. Shi, L. Lei, S. Yang, and X. Sun. “Compositional gradient-driven design of additively manufactured nickel-based superalloys for enhanced 900°C strength-ductility synergy via Ti/Al optimization.” Materials Today Communications 49, 113751 (2025). DOI: https://doi.org/10.1016/j.mtcomm.2025.113751
2024
IRG 1
G. Erwin and Adrian Del Maestro. “Effects of Substrate Corrugation During Helium Adsorption on Graphene in the Grand Canonical Ensemble.” Journal of Low Temperature Physics 215, 525–540 (2024). DOI: https://doi.org/10.1007/s10909-024-03156-4
Y. Ohno, Adrian Del Maestro, and T. I. Lakoba. “Efficient simulations of Hartree–Fock equations by an accelerated gradient descent method.” Physical Review E 110, 055304 (2024). DOI: https://doi.org/10.1103/PhysRevE.110.055304
N. Mao, C. Xu, J. Li, T. Bao, P. Liu, Y. Xu, C. Felser, L. Fu, and Yang Zhang. “Transfer learning relaxation, electronic structure, and continuum model for twisted bilayer MoTe2.” Communications Physics 7, Article 262 (2024). DOI: https://doi.org/10.1038/s42005-024-01754-y
Y. Shen, L. Primeau, J. Li, T.-D. Nguyen, David Mandrus, Y. C. Lin, and Yang Zhang. “Nonlinear photocurrent in quantum materials for broadband photodetection.” Progress in Quantum Electronics 97, 100535 (2024). DOI: https://doi.org/10.1016/j.pquantelec.2024.100535
H. Miao, J. Bouaziz, G. Fabbris, W. R. Meier, F. Z. Yang, H. X. Li, C. Nelson, E. Vescovo, S. Zhang, A. D. Christianson, H. N. Lee, Yang Zhang, Cristian D. Batista, and S. Blügel. “Spontaneous chirality flipping in an orthogonal spin-charge ordered topological magnet.” Physical Review X 14, 011053 (2024). DOI: https://doi.org/10.1103/PhysRevX.14.011053
C. Xu, J. Li, Y. Xu, Z. Bi, and Yang Zhang. “Maximally localized Wannier functions, interaction models, and fractional quantum anomalous Hall effect in twisted bilayer MoTe2.” Proceedings of the National Academy of Sciences of the United States of America 121, Article e2316749121 (2024). DOI: https://doi.org/10.1073/pnas.2316749121
J. Tang, T. S. Ding, H. Chen, A. Gao, T. Qian, Z. Huang, Z. Sun, X. Han, A. Strasser, J. Li, M. Geiwitz, M. Shehabeldin, V. Belosevich, Z. Wang, Y. Wang, K. Watanabe, T. Taniguchi, D. C. Bell, Z. Wang, L. Fu, Yang Zhang, X. Qian, K. S. Burch, Y. Shi, N. Ni, G. Chang, S.-Y. Xu, and Q. Ma. “Dual quantum spin Hall insulator by density-tuned correlations in TaIrTe4.” Nature 628, 515–521 (2024). DOI: https://doi.org/10.1038/s41586-024-07211-8
IRG 2
Y. Liu, U. Pratiush, J. Bemis, R. Proksch, R. Emery, Philip D. Rack, Y.-C. Liu, J.-C. Yang, S. Udovenko, S. Trolier-McKinstry, and Sergei V. Kalinin. “Integration of scanning probe microscope with high-performance computing: Fixed-policy and reward-driven workflows implementation.” Review of Scientific Instruments 95, 093701 (2024). DOI: https://doi.org/10.1063/5.0219990
U. Pratiush, A. Houston, Sergei V. Kalinin, and G. Duscher. “Realizing smart scanning transmission electron microscopy using high performance computing.” Review of Scientific Instruments 95, 103701 (2024). DOI: https://doi.org/10.1063/5.0225401
R. Tanveer, D. Windsor, S. Drewry, Katharine Page, Haixuan Xu, V. Keppens, and W. J. Weber. “Synthesis and properties of rare-earth high-entropy perovskite.” Applied Physics Letters 124, 061903 (2024). DOI: https://doi.org/10.1063/5.0206254
D. J. Rutstrom, L. Stand, D. Windsor, Haixuan Xu, M. Kapusta, C. L. Melcher, and M. Zhuravleva. “New ultrafast scintillators with core valence luminescence: Cs2MgCl4 and Cs3MgCl5.” Journal of Materials Chemistry C 12, 6920–6931 (2024). DOI: https://doi.org/10.1039/d4tc00877d
C. Xu, J. Li, Y. Xu, Z. Bi, and Yang Zhang. “Maximally localized Wannier functions, interaction models, and fractional quantum anomalous Hall effect in twisted bilayer MoTe2.” Proceedings of the National Academy of Sciences of the United States of America 121, Article e2316749121 (2024). DOI: https://doi.org/10.1073/pnas.2316749121
J. Tang, T. S. Ding, H. Chen, A. Gao, T. Qian, Z. Huang, Z. Sun, X. Han, A. Strasser, J. Li, M. Geiwitz, M. Shehabeldin, V. Belosevich, Z. Wang, Y. Wang, K. Watanabe, T. Taniguchi, D. C. Bell, Z. Wang, L. Fu, Yang Zhang, X. Qian, K. S. Burch, Y. Shi, N. Ni, G. Chang, S.-Y. Xu, and Q. Ma. “Dual quantum spin Hall insulator by density-tuned correlations in TaIrTe4.” Nature 628, 515–521 (2024). DOI: https://doi.org/10.1038/s41586-024-07211-8
2023
IRG 1
F. Xu, Z. Sun, T. Jia, C. Liu, C. Xu, C. Li, Y. Gu, K. Watanabe, T. Taniguchi, B. Tong, J. Jia, Z. Shi, S. Jiang, Yang Zhang, X. Liu, and T. Li. “Observation of integer and fractional quantum anomalous Hall effects in twisted bilayer MoTe2.” Physical Review X 13, 031037 (2023). DOI: https://doi.org/10.1103/PhysRevX.13.031037