C. Shinagawa, S. Takamoto, D. Shintani, Y.-B. Zhuang, Y. Tsuboi, K. Nishimra, K. Shinohara, S. Iwase, Y. Tanaka, and J. Li, “Matlantis-PFP v8: Universal Machine Learning Interatomic Potential with Better Experimental Agreements via r2SCAN Functional” [arXiv:2603.11063]
T. Nomoto, K. Shinohara, H. Watanabe, and R. Arita, “Systematic Magnetic Structure Generation Based on Oriented Spin Space Groups: Formulation, Applications, and High-Throughput First-Principles Calculations” [arXiv:2601.15735]
Journal Publications
T. Shibayama, H. Imamura, K. Nishimra, K. Shinohara, C. Shinagawa, S. Takamoto, and J. Li, Efficient crystal structure prediction using universal neural network potential with diversity preservation in genetic algorithms, Phys. Rev. Mater. 10, 063401 (2026) [arxiv:2503.21201]
J. Fu, M. Kuisma, A. H. Larsen, K. Shinohara, A. Togo, and K. S. Thygesen, Symmetry classification of 2D materials: layer groups versus space groups, 2D Mater. 11, 3, 035009 (2024) [arxiv:2401.16705]
H. Watanabe, K. Shinohara, T. Nomoto, A. Togo, and R. Arita, Symmetry Analysis with Spin Crystallographic Groups: Disentangling Spin-Orbit-Free Effects in Emergent Electromagnetism, Phys. Rev. B 109, 094438 (2024) [arxiv:2307.11560]
K. Shinohara, A. Togo, and I. Tanaka, Algorithms for magnetic symmetry operation search and identification of magnetic space group from magnetic crystal structure, Acta Cryst. A 79, 390-398 (2023) [arxiv:2211.15008]
K. Shinohara, A. Seko, T. Horiyama, M. Ishihata, J. Honda and I. Tanaka, Enumeration of nonequivalent substitutional structures using advanced data structure of binary decision diagram, J. Chem. Phys. 153, 104109 (2020) [arxiv:2002.12603]
K. Shinohara, T. Nomoto, H. Watanabe, and R. Arita, Magnetic-Structure Generation Based on Oriented Spin Space Groups, 27th Congress and General Assembly of the International Union of Crystallography (IUCr 2026), MS-023 Spin groups & magnetic symmetry, August, 2026 [Web] [Slides (PDF)] [arXiv:2601.15735]
K. Shinohara, T. Nomoto, H. Watanabe, and R. Arita, Magnetic-Structure Generation Based on Oriented Spin Space Groups, 27th Congress and General Assembly of the International Union of Crystallography (IUCr 2026), Poster Session 1B, August, 2026 [Web] [Poster (PDF)] [arXiv:2601.15735] (Poster prepared for the session on August 12, 2026; I withdrew from the poster session because my flight was cancelled due to severe weather.)
K. Shinohara, H. Imamura, K. Nishimra, S. Watanabe, K. Hisama, C. Shinagawa, S. Takamoto, and J. Li, Enhancing Crystal Structure Prediction with r2SCAN-Level Universal Neural Network Potentials, 2025 MRS Fall Meeting, December, 2025 [Web]
K. Shinohara, T. Shibayama, H. Imamura, K. Nishimra, C. Shinagawa. S. Takamoto, and J. Li, Finite-Temperature Crystal Structure Prediction with Universal Neural Network Potential and Free Energy Calculation, 2024 MRS Fall Meeting, December, 2024 [Web]
K. Shinohara, A. Seko, T. Horiyama, M. Ishihata, J. Honda and I. Tanaka, Accelerated enumeration of derivative structures using zero-suppressed binary decision diagram, APS March Meeting 2020, March, 2020 [Web]