• Enda Xiao, Terumasa Tadano. Accurate screening of functional materials with machine-learning potential and transfer-learned regressions: Heusler alloy benchmark. npj Computational Materials. 12 [1] 133-1-133-11. 2026. Open Access
• Masato Ohnishi, Tianqi Deng, Pol Torres, Zhihao Xu, Terumasa Tadano, Haoming Zhang, Wei Nong, Masatoshi Hanai, Zeyu Wang, Michimasa Morita, Zhiting Tian, Ming Hu, Xiulin Ruan, Ryo Yoshida, Toyotaro Suzumura, Lucas Lindsay, Alan J. H. McGaughey, Tengfei Luo, Kedar Hippalgaonkar, Junichiro Shiomi. Database and deep-learning scalability of anharmonic phonon properties by automated brute-force first-principles calculations. npj Computational Materials. 12 [1] 150-1-150-14. 2026. Open Access
• Jieyi Chen, Ivan Kurniawan, Shoya Sakamoto, Hidetoshi Kosaki, Erkang Wei, Tempei Hatajiri, Kazuya Ando, Keisuke Masuda, Shinji Miwa. Large Interband-DrivenAnisotropic Gilbert Dampingof a Few Atomic Layers of Fe in Contact with MgO. Nano Letters. 26 [31] 10407-10412. 2026. Open Access
• Ryoma Asai, Ryotaro Arita, Takumi Chida, Ryota Masuki, Kazuhiko Kuroki, Terumasa Tadano. Finite-temperature ab initio structural optimization of the bilayer nickelate superconductor ${\mathrm{La}}_3{\mathrm{Ni}}_2{O}_7$. Physical Review B. 114 [8] L080504-1-L080504-7. 2026.
• Xinyi He, Katsuma Ogata, Terumasa Tadano, Hidenori Hiramatsu, Toshio Kamiya, Takayoshi Katase. Simultaneous enhancement of power factor and suppression of thermal conductivity in bulk TlFe _1.6 Se ₂ via embedded atomically thin FeSe layers. Journal of Materials Chemistry A. 14 [37] 24666-24677. 2026. Open Access
• Zhijun Li, Hongbo Yuan, Alexei A. Belik, Terumasa Tadano, Yoshihiro Tsujimoto, Kazunari Yamaura. Giant Lattice Expansion through Structural Frustration Release in a Dense Oxide. Journal of the American Chemical Society. 148 [21] 22380-22388. 2026. Open Access
• Karen Nakanishi, Masaaki Kakoki, Kiyotaka Ohwada, Kenta Kuroda, Kazuki Sumida, Hitoshi Sato, Koji Miyamoto, Taichi Okuda, Shinji Isogami, Keisuke Masuda, Yuya Sakuraba, Akio Kimura. Visualizing bulk band structure in ${\mathrm{Fe}}_{4}N$ thin films by spin- and angle-resolved photoelectron spectroscopy. Physical Review Research. 8 [2] 023257-1-023257-8. 2026. Open Access
• Ryusei Higuchi, Xinyi He, Takayoshi Katase, Terumasa Tadano, Toshio Kamiya. Enhanced Thermoelectric Performance by Inverted Thermal Conductivity Anisotropy in Layered AE ₂ ZnN ₂ ( AE = Ca, Sr, Ba) with Rigid Interlayer Bonds. The Journal of Physical Chemistry C. 130 [18] 6425-6436. 2026. Open Access
• Kantaro Murayama, Ryota Masuki, Cédric Tassel, Hideaki Sakai, Tatsuya Yanagisawa, Keito Yoshida, Hiroshi Oike, Suguru Yoshida, Xiangyu Gu, Kohdai Ishida, Morito Namba, Ksenia Denisova, Valérie Dupray, Simon Clevers, Olivier Mentré, Takuya Nomoto, Terumasa Tadano, Craig M. Brown, Peter Lemmens, Ryotaro Arita, Hiroshi Takatsu, Hiroshi Kageyama. Lattice softening and diffusive dynamics in the polar metal LiReO ₃. Science Advances. 12 [14] eadt3886-1-eadt3886-9. 2026. Open Access
• Shigenori Ueda, Yuichi Fujita, Ivan Kurniawan, Yuya Sakuraba, Yoshio Miura. Temperature- and depth-dependent valence band electronic structures of half-metallic ${\mathrm{Co}}_2\mathrm{MnSi}$ studied by hard x-ray photoemission spectroscopy. Physical Review B. 113 [6] 064430-1-064430-13. 2026. Open Access
• Xin Tang, Yoshio Miura, Noriki Terada, Enda Xiao, Shintaro Kobayashi, Allan Döring, Terumasa Tadano, Andres Martin‐Cid, Takuo Ohkochi, Shogo Kawaguchi, Yoshitaka Matsushita, Tadakatsu Ohkubo, Tetsuya Nakamura, Konstantin Skokov, Oliver Gutfleisch, Kazuhiro Hono, Hossein Sepehri‐Amin. Control of Covalent Bond Enables Efficient Magnetic Cooling. Advanced Materials. 38 [7] e14295-1-e14295-12. 2026. Open Access

2025

• Yujun Wang, Shunzhen Wang, Masashi Kawaguchi, Jun Uzuhashi, Akhilesh Kumar Patel, Kenji Nawa, Yuya Sakuraba, Tadakatsu Ohkubo, Hiroshi Kohno, Masamitsu Hayashi. Significant electron-magnon scattering in layered ferromagnet Cr2Te3. Communications Physics. 8 [1] 262-1-262-8. 2025. Open Access
• Koichi Oyanagi, Hossein Sepehri-Amin, Kenta Takamori, Terumasa Tadano, Takumi Imamura, Ren Nagasawa, Krishnan Mahalingam, Takamasa Hirai, Fuyuki Ando, Yuya Sakuraba, Satoru Kobayashi, Ken-ichi Uchida. Simultaneous achievement of large anomalous Nernst effect and reduced thermal conductivity in sintered polycrystalline topological Heusler ferromagnets. Acta Materialia. 296 121239-121239-8. 2025. Open Access
• Enda Xiao, Terumasa Tadano. High-throughput computational screening of Heusler compounds with phonon considerations for enhanced material discovery. Acta Materialia. 297 121312-121312-14. 2025. Open Access
• Pandu Wisesa, Terumasa Tadano, Wissam A. Saidi. Deep-learning neural network potentials for titanate perovskites. Computational Materials Science. 250 113719-113719-8. 2025. Open Access
• Kazuki Sumida, Masaaki Kakoki, Yuya Sakuraba, Keisuke Masuda, Kazuki Goto, Takashi Kono, Koji Miyamoto, Yoshio Miura, Kazuhiro Hono, Taichi Okuda, Akio Kimura. Surface-specific thermal spin-depolarization on the half-metallic Heusler films. Communications Physics. 8 [1] 12-1-12-7. 2025. Open Access
• Weinan Zhou, Keisuke Masuda, Kazuki Sumida, Yuichi Fujita, Akio Kimura, Yuya Sakuraba. Comparative experimental and theoretical study on anomalous Nernst effect of Heusler alloy Co ₂ FeSi thin film: estimation of on-site Coulomb interaction at Co site. Science and Technology of Advanced Materials. 26 [1] 2564061-1-2564061-11. 2025. Open Access
• Masao Morishita, Terumasa Tadano, Yusuke Matsuoka, Taichi Abe. Mechanism of Solid Ammonia Stabilization at Ambient Temperature: Insights from Thermodynamics, Phonon Calculation, and Micromechanics. ACS Omega. 10 [47] 57684-57691. 2025. Open Access
• I Kurniawan, K Masuda, Y Miura. Theory of tunnel magnetoresistance in magnetic tunnel junctions with hexagonal boron nitride barriers: mechanism and application to ferromagnetic alloy electrodes. Journal of Physics D: Applied Physics. 58 [46] 465302-465302-13. 2025. Open Access
• Alan J. H. McGaughey, Lucas Lindsay, Hua Bao, Tomu Hamakawa, Rinkle Juneja, Shouhang Li, Wu Li, Ryota Masuki, Fanchen Meng, Han Meng, Tribhuwan Pandey, Cheng Shao, Junichiro Shiomi, Terumasa Tadano, Atsushi Togo, Ao Wang, Xinyu Zhang. Phonon Olympics: Phonon property and lattice thermal conductivity benchmarking from open-source packages. Journal of Applied Physics. 138 [13] 135108-1-135108-26. 2025. Open Access
• Kodchakorn Simalaotao, Ivan Kurniawan, Yoshio Miura, Yuya Sakuraba. Searching for Cu-X spacers using a half-metallic Co₂FeGa_0.5Ge_0.5 electrode to boost magnetoresistance in CPP-GMR devices: a first-principles study. Journal of Physics D: Applied Physics. 58 [39] 395303-395303-15. 2025. Open Access
• Ivan Kurniawan, Keita Ito, Takeshi Seki, Keisuke Masuda, Yoshio Miura. Microscopic correlation between magnetostriction and magnetic damping. Physical Review B. 112 [10] L100407-1- L100407-6. 2025. Open Access
• Xinyi He, Takehito Komatsu, Takayoshi Katase, Terumasa Tadano, Takashi Honda, Masayoshi Miyazaki, Masaaki Kitano, Hidenori Hiramatsu, Hideo Hosono, Toshio Kamiya. Strong Phonon Scattering and Enhanced Thermoelectric Performance in SrTiO₃ Polycrystals by Simultaneous Hydrogen Substitution and Oxygen Vacancy Formation. ACS Applied Energy Materials. 8 [15] 11447-11455. 2025. Open Access
• Dan C. Sorescu, Terumasa Tadano, Wissam A. Saidi. Theoretical Investigations of Anharmonic Effects and Phonon Transport in the Cubic Phase of Crystalline Perovskite CsPbCl₃. The Journal of Physical Chemistry C. 129 [29] 13445-13456. 2025. Open Access
• Keisuke Masuda, Thomas Scheike, Hiroaki Sukegawa, Yusuke Kozuka, Seiji Mitani, Yoshio Miura. Theory for tunnel magnetoresistance oscillation. Physical Review B. 111 [22] L220406-1-L220406-6. 2025. Open Access
• Lakhan Bainsla, Yuya Sakuraba, Akash Kumar, Avinash Kumar Chaurasiya, Keisuke Masuda, Nattamon Suwannaharn, Ahmad A. Awad, Nilamani Behera, Roman Khymyn, Taisuke Sasaki, Saroj Prasad Dash, Johan Åkerman. Energy-Efficient Single Layer Spin Hall Nano-Oscillators Driven by Berry Curvature. ACS Nano. 19 [19] 18534-18544. 2025. Open Access
• Ryo Matsumoto, Kazuki Yamane, Terumasa Tadano, Kensei Terashima, Toru Shinmei, Tetsuo Irifune, Yoshihiko Takano. Emergence of Superconductivity at 20 K in Th₃P₄-type In_3–xS₄ Synthesized by Diamond Anvil Cell with Boron-Doped Diamond Electrodes. Chemistry of Materials. 37 [4] 1648-1656. 2025. Open Access
• Akhilesh Kumar Patel, Ryo Toyama, Keisuke Masuda, Kodchakorn Simalaotao, Tomoya Nakatani, Yoshio Miura, Yuya Sakuraba. Systematic investigation of anomalous Hall effect in Fe–Pt composition-spread epitaxial films for magnetic sensor application. Journal of Applied Physics. 137 [6] 063901-1-063901-9. 2025. Open Access

2024

• 只野 央将. 第一原理計算を用いた熱伝導・電気伝導予測の前線. セラミックス. 59 [11] 779-783. 2024. Open Access
• Z.H. Li, H. Suto, V. Barwal, K. Masuda, T.T. Sasaki, Z.X. Chen, H. Tajiri, K. Hono, Y. Sakuraba. Enhancing atomic ordering, magnetic and transport properties of Mn2VGa Heusler alloy thin films toward negatively spin-polarized charge injection. Acta Materialia. 276 120110-120110-12. 2024. Open Access
• Naoki Abe, Yusuke Kozuka, Terumasa Tadano, Yoshihiro Tsujimoto, Kazunari Yamaura. Large anomalous Hall effect in spin fluctuating devil’s staircase. npj Quantum Materials. 9 [1] 41-1-41-8. 2024. Open Access
• Guangzong Xing, Keisuke Masuda, Terumasa Tadano, Yoshio Miura. Chemical-substitution-driven giant anomalous Hall and Nernst effects in magnetic cubic Heusler compounds. Acta Materialia. 270 119856. 2024. Open Access
• Mari Hiramatsu, Zhongxu Hu, Sakura Yoshikawa, Zan Yang, Xinyi He, Takayoshi Katase, Jun-ichi Yamaura, Hajime Sagayama, Terumasa Tadano, Shigenori Ueda, Hidenori Hiramatsu, Hideo Hosono, Toshio Kamiya. Nonequilibrium Layered PbS Stabilized by Sn Doping: Bipolar Semiconductors with Low Thermal Conductivity. ACS Applied Electronic Materials. 6 [11] 8339-8350. 2024. Open Access
• Hirofumi Suto, Vineet Barwal, Keisuke Masuda, Kodchakorn Simalaotao, Taisuke Sasaki, Yoshio Miura, Hiroo Tajiri, Loku Singgappulige Rosantha Kumara, Tomoyuki Koganezawa, Yuya Sakuraba. Negative spin polarization and effect of composition on the atomic order and electronic structure of ${\mathrm{Mn}}_2\mathrm{VAl}$ Heusler alloy thin films. Physical Review Materials. 8 [11] 114408-1-114408-14. 2024. Open Access
• Ryo Toyama, Keisuke Masuda, Kodchakorn Simalaotao, Weinan Zhou, Varun K Kushwaha, Yuya Sakuraba. Large anomalous Nernst conductivity of L1₀-ordered CoPt in CoPt composition-spread thin films. Journal of Physics D: Applied Physics. 57 [40] 405001-405001-10. 2024. Open Access
• Ryota Masuki, Terumasa Tadano. Continuous crossover between insulating ferroelectrics and polar metals: Ab initio calculation of structural phase transitions of $\mathrm{Li}B{O}_3$ ($B=\mathrm{Ta}$, W, Re, Os). Physical Review B. 110 [9] 094102-1-094102-10. 2024. Open Access
• Hirofumi Suto, Vineet Barwal, Kodchakorn Simalaotao, Zehao Li, Keisuke Masuda, Taisuke Sasaki, Yoshio Miura, Yuya Sakuraba. Negative spin polarization of Mn2VGa Heusler alloy thin films studied in current-perpendicular-to-plane giant magnetoresistance devices. Journal of Applied Physics. 135 [20] 203901-1- 203901-9. 2024. Open Access
• Naoki Chiba, Keisuke Masuda, Ken-ichi Uchida, Yoshio Miura. Prediction of giant anomalous Nernst effect in Sm(Co,Ni)5. Applied Physics Letters. 124 [21] 212408/1-212408/6. 2024. Open Access
• M. Basini, T. Tadano. Terahertz electric-field-driven dynamical multiferroicity in SrTiO3. Nature. 628 [8008] 534-539. 2024. Open Access
• Tomoya Nakatani, Prabhanjan D. Kulkarni, Hirofumi Suto, Keisuke Masuda, Hitoshi Iwasaki, Yuya Sakuraba. Perspective on nanoscale magnetic sensors using giant anomalous Hall effect in topological magnetic materials for read head application in magnetic recording. Applied Physics Letters. 124 [7] 070501. 2024. Open Access
• Jincheng Yue, Terumasa Tadano. Role of atypical temperature-responsive lattice thermal transport on the thermoelectric properties of antiperovskites Mg3XN (X = P, As, Sb, Bi). Materials Today Physics. 41 101340. 2024. Open Access

2023

• Erik Fransson, Terumasa Tadano. Limits of the phonon quasi-particle picture at the cubic-to-tetragonal phase transition in halide perovskites. Communications Physics. 6 [1] 173. 2023.
• 増木 亮太, 只野 央将. 非調和フォノン理論に基づいた有限温度における結晶構造の第一原理計算. 固体物理. 58 [No.8 (通巻690号)] 419-432. 2023. Open Access
• Yusuke Kozuka, Taisuke T. Sasaki, Terumasa Tadano, Jun Fujioka. Epitaxy and transport properties of alkali-earth palladate thin films. Science and Technology of Advanced Materials. 24 [1] 2265431. 2023. Open Access
• Xinyi He, Terumasa Tadano, Satoru Matsuishi. Inverse‐Perovskite Ba₃BO (B = Si and Ge) as a High Performance Environmentally Benign Thermoelectric Material with Low Lattice Thermal Conductivity. Advanced Science. 2307058. 2023. Open Access
• Kazuki Sumida, Weinan Zhou, Keisuke Masuda, Yuya Sakuraba. Role of on-site Coulomb interactions in the half-metallic Weyl ferromagnet candidate thin-film ${\mathrm{Co}}_2\text{FeSi}$. Physical Review B. 108 [24] L241101. 2023. Open Access
• ハ ツォン, 増田 啓介, ソン ジェユアン, シャイケ トーマス, 温 振超, 三浦 良雄, 大久保 忠勝, 宝野 和博, 三谷 誠司, 介川 裕章. Nano-crystal domains in Co-based fcc(111) epitaxial magnetic junctions and their impact on tunnel magnetoresistance. Acta Materialia. 261 119394. 2023. Open Access
• 只野 央将. 非調和フォノン理論が拓く有限温度物性の第一原理計算. 日本物理学会誌. 78 [9] 542-547. 2023.
• Atsushi Togo, Laurent Chaput, Terumasa Tadano. Implementation strategies in phonopy and phono3py. Journal of Physics: Condensed Matter. 35 [35] 353001. 2023. Open Access
• Masao Morishita, Taichi Abe, Tadakatsu Ohkubo, Terumasa Tadano. Magnetic characterization of Sm(Fe1-, Cox)11Ti (x = 0, 0.1) determined by heat-capacity measurement from very low to high temperatures. Thermochimica Acta. 727 179573. 2023.
• Ivan Kurniawan, Yoshio Miura, Guangzong Xing, Terumasa Tadano, Kazuhiro Hono. Theoretical study of the effect of lattice dynamics on the damping constant of FePt at finite temperature. Physical Review B. 108 [9] 094426. 2023. Open Access
• Ryo Toyama, Satoshi Kokado, Keisuke Masuda, Zehao Li, Varun K. Kushwaha, Taisuke T. Sasaki, Yuma Iwasaki, Yuya Sakuraba. Origin of negative anisotropic magnetoresistance effect in ${\mathrm{Fe}}_{0.75}{\mathrm{Co}}_{0.25}$ single-crystal thin films upon Ir addition. Physical Review Materials. 7 [8] 084401. 2023.
• Kenji Nawa, Tsuyoshi Suzuki, Keisuke Masuda, Yoshio Miura. Quantum Annealing Optimization Method for the Design of Barrier Materials in Magnetic Tunnel Junctions. Physical Review Applied. 20 [2] 024044. 2023. Open Access
• Kouta Kazama, Terumasa Tadano, Yusuke Kozuka, Yoshihiro Tsujimoto, Kazunari Yamaura. Charge transport and thermopower in the electron-doped narrow gap semiconductor ${\mathrm{Ca}}_{1-x}{\mathrm{La}}_x{\mathrm{Pd}}_3{O}_4$. Physical Review Materials. 7 [8] 085402. 2023. Open Access
• Guangzong Xing, Yoshio Miura, Terumasa Tadano. First-principles prediction of phase transition of ${\mathrm{YCo}}_5$ from self-consistent phonon calculations. Physical Review B. 108 [1] 014304. 2023.
• Xinyi He, Terumasa Tadano, Hiroshi Mizoguchi, Hideo Hosono. Hydride Anion Substitution Boosts Thermoelectric Performance of Polycrystalline SrTiO₃ via Simultaneous Realization of Reduced Thermal Conductivity and High Electronic Conductivity. Advanced Functional Materials. 33 [28] 2213144. 2023. Open Access
• Dhruba B. Khadka, Yasuhiro Shirai, Masatoshi Yanagida, Terumasa Tadano, Kenjiro Miyano. Alleviating Defect and Oxidation in Tin Perovskite Solar Cells Using a Bidentate Ligand. Chemistry of Materials. 35 [11] 4250-4258. 2023. Open Access
• Naoki Chiba, Keisuke Masuda, Ken-ichi Uchida, Yoshio Miura. Designing composition ratio of magnetic alloy multilayer for transverse thermoelectric conversion by Bayesian optimization. APL Machine Learning. 1 [2] 026114. 2023. Open Access
• Phillip David Bentley, Keisuke Masuda, Yoshio Miura, Yuya Sakuraba. Cubic-type Heusler compound ${\mathrm{Mn}}_2\mathrm{FeGa}$ thin film with strain-induced large perpendicular magnetic anisotropy. Physical Review Materials. 7 [6] 064404. 2023.
• Chen Shen, Terumasa Tadano. Impact of quartic anharmonicity on lattice thermal transport in EuTiO3: A comparative theoretical and experimental investigation. Materials Today Physics. 34 101059. 2023.
• Ryota Masuki, Terumasa Tadano. Full optimization of quasiharmonic free energy with an anharmonic lattice model: Application to thermal expansion and pyroelectricity of wurtzite GaN and ZnO. Physical Review B. 107 [13] 134119. 2023.
• Zhongxu Hu, Terumasa Tadano. Reversible Thermal Conductivity Modulation of Non-equilibrium (Sn_1–xPb _x)S by 2D–3D Structural Phase Transition above Room Temperature. ACS Applied Energy Materials. 6 [6] 3504-3513. 2023.
• Tomohito Amano, Terumasa Tadano. Lattice dielectric properties of rutile ${\mathrm{TiO}}_2$: First-principles anharmonic self-consistent phonon study. Physical Review B. 107 [9] 094305. 2023.

• 増田 啓介. トンネル磁気抵抗効果の理論研究. 第50回 日本磁気学会学術講演会. 2026. Invited
• ウォン ウンジェ, SASAKI, Yuta, 菊池 伸明, 江川 元太, MASUDA, Keisuke, TAKAHASHI, Yukiko, SUTO, Hirofumi. Anisotropic Exchange Stiffness of Perpendicularly Magnetized Co/Pt multilayer thin film. Magnetics and Optics Research International Symposium 2026 (MORIS 2026). 2026.
• ウォン ウンジェ, SASAKI, Yuta, 菊池伸明, 江川元太, MASUDA, Keisuke, TAKAHASHI, Yukiko, SUTO, Hirofumi. Anisotropic Exchange Stiffness in Perpendicularly Magnetized Co/Pt multilayer film. 第73回応用物理学会春季学術講演会. 2026.
• 只野 央将, シャオ エンダ. 汎用機械学習原子間ポテンシャルからの転移学習による物性予測. 日本金属学会2026年春期(第178回)講演大会. 2026.

2025

• 只野 央将. 有限温度における構造最適化法の開発とニッケル酸化物超伝導体への応用. 新規超伝導体を舞台とする超伝導科学のフロンティア. 2025. Invited
• TADANO, Terumasa, XIAO, Enda. Stable and functional Heusler alloys: A high-throughput first-principles exploration. Materials Research Meeting 2025 (MRM 2025). 2025.
• XIAO, Enda, TADANO, Terumasa. Stable and Functional Heusler Alloys: A Machine Learning- Assisted High-Throughput First-Principles Exploration. Materials Research Meeting 2025 (MRM 2025). 2025.
• TADANO, Terumasa. Anharmonic lattice dynamics and thermal transport in type-I clathrates studied by first-principles calculation. 2025 MRS Fall Meeting. 2025. Invited
• ウォン ウンジェ, 佐々木 悠太, 菊池 伸明, 江川 元太, 増田 啓介, 高橋 有紀子, 首藤 浩文. 垂直磁化 Co/Pt 多層膜の異方的 Exchange Stiffness. 2025年第62回秋期講演⼤会. 2025.
• Xueyao HOU, 伊藤 啓太, Varun Kumar KUSHWAHA, 山崎 匠, Junwei GU, WEN, ZhenChao, MASUDA, Keisuke, 岡林 潤, 坂本 祥哉, 関 剛斎. Tungsten-Mediated Interlayer Exchange Coupling System Revisited. International Symposium MSSp2025: Materials Science and Spintronics. 2025.
• TADANO, Terumasa. First-Principles and Data-Driven Approaches for the Computational Design of Functional Heusler Alloys. Materials Science from First Principles: Materials Scientist Toolbox. 2025. Invited
• NAKATANI, Tomoya, クルカルニ プラバンジャン ディリプ, MANIKKETH, Murali Krishnan, TOYAMA, Ryo, SUTO, Hirofumi, MASUDA, Keisuke, SUWANNAHARN, Nattamon, SASAKI, Taisuke, 岩崎 仁志, SAKURABA, Yuya. Potential and challenges of anomalous Hall sensors for future read head technology. The 70th Annual Conference on Magnetism and Magnetic Materials (MMM 2025). 2025. Invited
• XIAO, Enda, TADANO, Terumasa. Accurate Screening of Functional Materials with Machine-Learning Potential and Transfer-Learned Regressions: Heusler Alloy Benchmark. The 26th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-26). 2025.
• 只野 央将. 第一原理計算とデータ駆動による磁性材料設計. 第3回 ナノエラストロニクスワークショップ. 2025. Invited
• 森下 政夫, 只野 央将, 松岡 佑亮, 阿部 太一. 第一原理フォノン計算支援熱力学モデルおよびマイクロメカニクスによる 固体アンモニアの安定化機構およびCALPHADデータ関数. 第61回熱測定討論会. 2025.
• Hou Xueyao, 伊藤 啓太, Kushwaha Varun, 山崎 匠, Gu Junwei, 坂本 祥哉, 温 振超, 増田 啓介, 岡林 潤, 関 剛斎. タングステンを介した層間交換結合系の再考. 日本金属学会 2025年秋期(第177回)講演大会. 2025.
• 森下 政夫, 只野 央将, 松岡 佑亮, 阿部 太一. 第一原理フォノン計算を援用した熱力学モデリングおよびマイクロメカニクスシミュレーションによる常温における固体アンモニアの安定化機構. 日本金属学会 2025年秋期 (第177回) 講演大会. 2025.
• 只野 央将, シャオ エンダ. ハイスループット第一原理計算と機械学習による機能性ホイスラー合金の探索. 日本物理学会 第80回年次大会 (2025年). 2025.
• 浅井 僚眞, 有田 亮太郎, 黒木 和彦, 只野 央将. 第一原理計算によるLa3Ni2O7の温度圧力相図の決定. 日本物理学会 第80回年次大会 (2025年). 2025.
• 只野 央将. 非調和フォノン計算を活用した相転移温度の非経験予測. 日本物理学会 第80回年次大会 (2025年). 2025.
• シャイケ トーマス, 温 振超, 増田 啓介, 三浦 良雄, 葛西 伸哉, 三谷 誠司, 介川 裕章. トンネル磁気抵抗振動現象のバイアス依存性. 第49回日本磁気学会学術講演会. 2025.
• 増田 啓介, シャイケ トーマス, 介川 裕章, 小塚 裕介, 三谷 誠司, 三浦 良雄. TMR振動の理論：微視的機構及び実験結果に対する考察. 第49回日本磁気学会学術講演会. 2025.
• KURNIAWAN, Ivan, MASUDA, Keisuke, MIURA, Yoshio. First-principles study of hcp-Co_{1-x}Ni_{x}|h-BN|hcp-Co_{1-x}Ni_{x} magnetic tunnel junction. 第86回応用物理学会秋季学術講演会. 2025.
• XIAO, Enda, TADANO, Terumasa. Accurate Screening of Functional Materials with Machine-Learning Potential and Transfer-Learned Regressions: Heusler Alloy Benchmark. The 86th JSAP Autumn Meeting (第86回応用物理学会秋季学術講演会). 2025.
• MASUDA, Keisuke, SCHEIKE, Thomas, SUKEGAWA, Hiroaki, KOZUKA, Yusuke, MITANI, Seiji, MIURA, Yoshio. Theoretical and experimental studies for understanding the TMR oscillation. 第86回応用物理学会秋季学術講演会. 2025.
• Jieyi Chen, 坂本 祥哉, KURNIAWAN, Ivan, 甲崎 秀俊, Erkang Wei, 畑尻 天平, MASUDA, Keisuke, 三輪 真嗣. Anisotropic Gilbert damping in the V/Fe/MgO multilayer. 第86回応用物理学会秋季学術講演会. 2025.
• Xueyao HOU, 伊藤 啓太, Varun Kumar KUSHWAHA, 山崎 匠, Junwei GU, 坂本 祥哉, WEN, ZhenChao, MASUDA, Keisuke, 岡林 潤, 関 剛斎. Tungsten-Mediated Interlayer Exchange Coupling System Revisited. 第86回応用物理学会秋季学術講演会. 2025.
• ウォン ウンジェ, SASAKI, Yuta, 菊池伸明, 江川元太, MASUDA, Keisuke, TAKAHASHI, Yukiko, SUTO, Hirofumi. Anisotropic exchange stiffness of perpendicularly magnetized Co/Pt multilayer thin film. TMRC2025 (The Magnetic Recording Conference). 2025.
• TADANO, Terumasa, XIAO, Enda. Phonon-phonon scattering and thermal transport in Heusler alloys: A first-principles high-throughput investigation. ICT/ACT2025 (41st International and 7th Asian Conference on Thermoelectrics 2025). 2025.
• ウォン ウンジェ, SASAKI, Yuta, 菊池伸明, 江川元太, MASUDA, Keisuke, TAKAHASHI, Yukiko, SUTO, Hirofumi. Anisotropic exchange stiffness of perpendicularly magnetized Co/Pt multilayer thin film. KMS 2025 Summer Conference　（2025年韓国磁気学会夏季学術大会）. 2025.
• KURNIAWAN, Ivan, Keita Ito, Takeshi Seki, MASUDA, Keisuke, MIURA, Yoshio. Ab-initio study on correlation between magnetostriction and magnetic damping. The 7th International Conference of Asian Union of Magnetics Societies (IcAUMS 2025). 2025.
• XIAO, Enda, TADANO, Terumasa. Comprehensive ab initio Stability Analysis of Heusler Compounds with Phonon Considerations for Enhanced Material Discovery. The 7th International Conference of Asian Union of Magnetics Societies (IcAUMS2025). 2025.
• 只野 央将, シャオ エンダ. ハイスループット第一原理計算による機能性ホイスラー合金の探索. 物性研究所スパコン共同利用・CCMS合同研究会「機械学習と計算物性科学の未来」. 2025.
• 森下 政夫, 只野 央将, 松岡 佑亮, 阿部 太一. フォノン状態密度に基づく熱力学モデルの構築およびマイクロメカニクス 援用による低温固体アンモニアの常温における安定機構の検討. 第 2 回ワークショップ「現代に適応するデータベース」. 2025.
• 只野 央将. 第一原理計算とデータ駆動手法による機能性ホイスラー合金の探索. 計算科学研究センター・計算物質科学スーパーコンピュータ共用事業合同ワークショップ 「AI/MLに基づく材料設計と開発：理論と実験の接点」. 2025. Invited
• KURNIAWAN, Ivan, Keita Ito, Takeshi Seki, MASUDA, Keisuke, MIURA, Yoshio. Understanding the microscopic origin of the relation between magnetoelasticity and magnetic damping constant in Fe4xCo4-4xN. The 16th Joint Conference on Magnetism and Magnetic Materials and Intermag 2025 (2025 Joint MMM-Intermag). 2025.
• MASUDA, Keisuke, SCHEIKE, Thomas, SUKEGAWA, Hiroaki, KOZUKA, Yusuke, MITANI, Seiji, MIURA, Yoshio. Theory for the TMR oscillation as a function of the barrier thickness. The 16th Joint Conference on Magnetism and Magnetic Materials and Intermag. 2025.

2024

• 松本 凌, 山根 和樹, 只野 央将, 寺嶋 健成, 新名亨, 入舩徹男, 高野 義彦. 20Kの超伝導転移温度を有するIn3S4 の高圧合成. 第65回高圧討論会. 2024.
• TADANO, Terumasa. Simulating structural change and phase transitions at finite temperatures: A phonon-based approach. The 25th Asian Workshop on First-Principles Electronic Structure Calculations (ASIAN-25). 2024. Invited
• 只野 央将. 第一原理に基づくスピン−フォノン相関の理論解析. 第2回ナノエラストロニクス・ワークショップ. 2024. Invited
• 増田 啓介, シャイケ トーマス, 介川 裕章, 小塚 裕介, 三谷 誠司, 三浦 良雄. TMRのバリア膜厚振動に対する理論研究. 第48回日本磁気学会学術講演会. 2024.
• 遠山 諒, 増田 啓介, シマラオタオ コチャコン, 周 偉男, クシュワハ ヴァルン クマール, スワンナハーン ナッタモン, 佐々木 泰祐, 桜庭 裕弥. CoPt組成傾斜薄膜におけるL10規則化CoPtの大きな異常ネルンスト伝導度. 第48回日本磁気学会学術講演会. 2024.
• 首藤 浩文, バルワル ビニート, 増田 啓介, シマラオタオ コチャコン, 佐々木 泰祐, 三浦 良雄, 田尻 寛男, クマーラ ロシャンタ, 小金澤 智之, 桜庭 裕弥. Mn₂VAlホイスラー合金の負のスピン分極率：規則化と電子状態に対する組成の影響. 第48回 日本磁気学会学術講演会. 2024.
• ハ ツォン, 増田 啓介, ソン ジェユアン, シャイケ トーマス, 温 振超, 三浦 良雄, 大久保 忠勝, 宝野 和博, 三谷 誠司, 介川 裕章. エピタキシャルfcc-CoFe/MgO/CoFe(111)型強磁性トンネル接合におけるナノ結晶ドメインの形成と磁気抵抗比への影響. 第48回日本磁気学会学術講演会. 2024.
• XIAO, Enda, TADANO, Terumasa. Development of machine learning models for efficient exploration of functional Heusler compounds. 日本金属学会2024年秋期(第175回)講演大会. 2024. Open Access
• 只野 央将, シャオ エンダ. ハイスループット第一原理計算によるホイスラー合金の物性マップ構築. 日本金属学会2024年秋期(第175回)講演大会. 2024. Open Access
• 森下 政夫, 只野 央将, 阿部 太一. 準安定固相アンモニアの常温における標準生成ギブズエネルギー. 日本金属学会2024年秋期(第175回）講演大会. 2024. Open Access
• MASUDA, Keisuke, SCHEIKE, Thomas, SUKEGAWA, Hiroaki, KOZUKA, Yusuke, MITANI, Seiji, MIURA, Yoshio. Theoretical approach for the TMR oscillation as a function of the barrier thickness. 第85回応用物理学会秋季学術講演会. 2024.
• SUTO, Hirofumi, バルワル ビニート, SIMALAOTAO, Kodchakorn, リー ゼハオ, MASUDA, Keisuke, SASAKI, Taisuke, MIURA, Yoshio, SAKURABA, Yuya. Mn2VGa and Mn2VAl Heusler alloys with negative spin polarizationfor efficient spin-transfer-torque-based devices. TMRC 2024 (The 35th Magnetic Recording Conference). 2024. Invited
• MASUDA, Keisuke, SCHEIKE, Thomas, SUKEGAWA, Hiroaki, KOZUKA, Yusuke, MITANI, Seiji, MIURA, Yoshio. Theory for Tunnel Magnetoresistance Oscillation: an Analytical Approach. Joint Inter-laboratory Workshop on Nano-magnetics (JIWON). 2024. Invited
• 只野 央将. 先進フォノン計算を用いた機能材料開拓. 金研研究会2024~強相関物質における創発物性研究の現状と将来展望~. 2024. Invited Open Access
• 只野 央将. 第一原理計算によるホイスラー合金データベースの構築と応用 . スーパーコンピュータ「富岳」成果創出加速プログラムDDCoMS 公開シンポジウム. 2024.
• 山根 和樹, 松本 凌, 只野 央将, 寺嶋 健成, 新名 亨, 櫻井 裕也, 高野 義彦. 新規超伝導体In3−xS4における合成条件の最適化. 第71回応用物理学会春季学術講演会. 2024.
• TADANO, Terumasa. Anharmonic Phonon Theory in Condensed Matter Physics with applications based on DFT. DFT2024 (RIKEN Symposium Second Workshop on Fundamentals in Density Functional Theory). 2024. Invited

2023

• 名和 憲嗣, 鈴木 健司, MASUDA, Keisuke, 田中宗, MIURA, Yoshio. Quantum-annealing Approach for Exploring Spintronics Materials: Case Study of Cation-disordered Inverse Spinel MgGa2O4 Oxides. MRM2023/IUMRS-ICA2023. 2023.
• 只野 央将. エラストスピン現象の理論的解釈. 第1回ナノエラストロニクス・ワークショップ. 2023.
• 松本 凌, 山根 和樹, 寺嶋 健成, 只野 央将, 永田 響, 新名 亨, 櫻井 裕也, 高野 義彦. 高圧合成および物性測定機能付きDACを用いたM3Ch4系超伝導体の探索. 第64回高圧討論会. 2023.
• 山根 和樹, 松本 凌, 只野 央将, 寺嶋 健成, 櫻井 裕也, 高野 義彦. 加熱機能付き電極導入型DACを用いた新規超伝導体In3−xS4 (Tc = 16 K) の高圧合成. 第64回高圧討論会. 2023.
• WEN, ZhenChao, SCHEIKE, Thomas, ハ ツォン, MASUDA, Keisuke, SUKEGAWA, Hiroaki, OHKUBO, Tadakatsu, MITANI, Seiji. Inverse tunneling magnetoresistance driven by interfacial resonance states in a (001)-oriented FeRh/MgO/FeCo junction. The 68th Annual Conference on Magnetism and Magnetic Materials (MMM2023). 2023. Open Access
• TADANO, Terumasa. First-principles quasiparticle phonon calculation of anharmonic solids. ASIAN-24 (The 24th Asian Workshop on First-Principles Electronic Structure Calculations). 2023.
• ハ ツォン, MASUDA, Keisuke, SONG, Jieyuan, SCHEIKE, Thomas, WEN, ZhenChao, SUKEGAWA, Hiroaki, MIURA, Yoshio, OHKUBO, Tadakatsu, HONO, Kazuhiro, MITANI, Seiji. Three Types of Nano Crystal Domain Structures in Fully Epitaxial fcc-Co/MgO/Co(111) Magnetic Tunnel Junctions. The 68th Annual Conference on Magnetism and Magnetic Materials (MMM2023). 2023.
• 増田 啓介, 伊藤博介, 介川 裕章, 三谷 誠司, 三浦 良雄. SrTiO3を用いた(111)配向磁気トンネル接合の理論研究. 第47回　日本磁気学会学術講演会. 2023.
• 首藤 浩文, バルワル ビニート, リー ゼハオ, 増田 啓介, 佐々木 泰祐, 古門 聡士, 桜庭 裕弥. Mn基ホイスラー合金 Mn2VGa およびMn2VAlエピタキシャル薄膜のスパッタ成長とAMR効果. 第47回 日本磁気学会学術講演会. 2023.
• 中西楓恋, 磯上 慎二, 増田 啓介, 桜庭 裕弥. スピン角度分解光電子分光実験によるFe4N薄膜の電子状態の観測. 第４７回日本磁気学会学術講演会. 2023.
• 名和 憲嗣, 鈴木 健司, 増田 啓介, 田中宗, 三浦 良雄. 量子アニーリングによる不規則性トンネルバリア設計. 第47回日本磁気学会学術講演会. 2023.
• XING, Guangzong, MASUDA, Keisuke, TADANO, Terumasa, MIURA, Yoshio. High-throughput Calculation of Transverse Transport Properties in Heusler Compounds. JSAP Autumn Meeting 2023. 2023.
• 相川皆子, 増田 啓介, 桜庭 裕弥. 立方晶系Fe3Sn薄膜の規則度と物性評価. 第84回応用物理学会秋季学術講演会. 2023.
• 名和 憲嗣, 鈴木 健司, MASUDA, Keisuke, 田中宗, MIURA, Yoshio. Quantum-annealing approach for design of magnetic tunnel junction: Case study of inverse-spinel MgGa2O4 tunnel barrier. 第84回応用物理学会秋季学術講演会. 2023.
• TOYAMA, Ryo, 古門 聡士, MASUDA, Keisuke, リー ゼハオ, クシュワハ ヴァルン クマール, SASAKI, Taisuke, IWASAKI, Yuma, SAKURABA, Yuya. Large negative anisotropic magnetoresistance effect by metastable B2-ordering of Fe0.75Co0.25 single-crystal thin films upon Ir addition. 第84回応用物理学会秋季学術講演会. 2023.
• 名和 憲嗣, 鈴木 健司, 増田 啓介, 田中宗, 三浦 良雄. 量子アニーリングと第一原理計算を用いた不規則系酸化物の最適化. 第84回応用物理学会秋季学術講演会. 2023.
• 山根 和樹, 松本 凌, 只野 央将, 寺嶋 健成, 櫻井 裕也, 高野 義彦. 高圧合成とその場電気抵抗測定による新規超伝導体In3-xS4(Tc=16 K)の発見. 日本物理学会第78回年次大会. 2023.
• 只野 央将. ハライドペロブスカイトにおける高次非調和効果の第一原理解析. 日本物理学会 第78回年次大会. 2023.
• SUTO, Hirofumi, バルワル ビニート, リー ゼハオ, MASUDA, Keisuke, SASAKI, Taisuke, SAKURABA, Yuya. Negative spin polarization of Mn2VGa Heusler alloy thin film studied in current-perpendicular-to-plane giant magnetoresistance devices. Intermag 2023. 2023.
• XING, Guangzong, MASUDA, Keisuke, TADANO, Terumasa, MIURA, Yoshio. High-throughput Calculation of Transverse Transport Properties in Heusler Compounds. Intermag 2023. 2023.
• 中西楓恋, ISOGAMI, Shinji, MASUDA, Keisuke, SAKURABA, Yuya. Minority-Spin Dominated Band Structure of Fe4N Thin Films Unveiled by Spin- and Angle-Resolved Photoelectron Spectroscopy. INTERMAG 2023. 2023. Open Access
• MASUDA, Keisuke, TADANO, Terumasa, MIURA, Yoshio. Theory for Temperature Dependence of Tunnel Magnetoresistance: Crucial Role of Interfacial s-d Exchange Interaction. Intermag 2023. 2023.
• MASUDA, Keisuke, 伊藤博介, SUKEGAWA, Hiroaki, MITANI, Seiji, MIURA, Yoshio. Prediction of High Tunnel Magnetoresistance Ratios in (111)-Oriented Junctions with SrTiO3 Barriers. Intermag 2023. 2023.
• 山根 和樹, 松本 凌, 只野 央将, 寺嶋 健成, 高野 義彦. 高圧合成とその場電気抵抗測定によるIn-S系超伝導体の発見. 第70回応用物理学会春季学術講演会. 2023.
• 中西楓恋, ISOGAMI, Shinji, MASUDA, Keisuke, SAKURABA, Yuya. Minority-Spin Dominated Band Structure of Fe4N Thin Films Unveiled by Spin- and Angle-Resolved Photoelectron Spectroscopy. The 70th JSAP Spring Meeting 2023. 2023.
• MASUDA, Keisuke, 伊藤博介, SUKEGAWA, Hiroaki, MITANI, Seiji, MIURA, Yoshio. Large tunnel magnetoresistance in (111)-oriented junctions with a SrTiO3 barrier. 第70回応用物理学会春季学術講演会. 2023.

• 只野 央将. 有限温度における結晶構造の計算機シミュレーション. Fine Ceramics Report. 43 [2] 59-63. 2025.
• Atsufumi Hirohata, Hiroki Koizumi, Tufan Roy, Masahito Tsujikawa, Shigemi Mizukami, Kenji Nawa, Masafumi Shirai. Machine learning for the development of new materials for a magnetic tunnel junction. npj Spintronics. 3 [1] 32-1-32-9. 2025.