論文

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1. K. Gocho, M. Hamaie, N. Tanibata, H. Takeda, *M. Nakayama, M. Karasuyama, R. Kobayashi, J. Phys. Chem.C,129,1035-1043(2025)
   "Causal Analysis of Factors for Li Ionic Conductivity in Olivine-Type LiMXO4 Materials Using LiNGAM"
   DOI: 10.1021/acs.jpcc.4c06131
   2025.01.07; 計画A01 
2. *N. Tanibata, S. Kondo, S. Akatsuka, H. Takeda, M. Nakayama, Chem. Mater.,37,303-312(2025)
   "Fast Anion Redox by Amorphization in Sodium-Ion Batteries"
   DOI: 10.1021/acs.chemmater.4c02583
   2024.12.27; 計画A01, 計画A02 
3. *T. Sudare, R. Shimizu, N. Yamada, Y. Miura, R. Ueda, R. Nakayama, S. Kobayashi, K. Kaneko, *T. Hitosugi, Chem. Mater.,37,480-488(2025)
   "Elucidating the Role of Interstitial Oxygen in Transparent Conducting Anatase TiO2 by Polarized X-ray Absorption Spectroscopy Study"
   DOI: 10.1021/acs.chemmater.4c02896
   2024.12.11; 計画A01, 計画A02 
4. K.Tani, T.Tada, *T.Takami, J. Mater. Chem. A,13,1478-1484(2025)
   "Fluoride superionic conduction in TlF with the new anti-α-CuBr structure containing intrinsic F vacancies"
   DOI: 10.1039/D4TA06334A
   2024.12.03; 計画A01 
5. K. Kihara, K. Nishinari, Y. Ando,*T. Ezaki, Phys. rev. res.,6,043210_1-7 (2024)
   "Solid-electrolyte-inspired totally asymmetric simple exclusion process with parallel channels and random defects"
   DOI: 10.1103/PhysRevResearch.6.043210
   2024.11.26; 計画A01 
6. Y. Yokoyama, S. Noguchi, K. Ishikawa, N. Tanibata, H. Takeda, *M. Nakayama, R. Kobayashi, M. Karasuyama, APL Mater.,12,111120_1-8 (2024)
   "Prediction of Li-ion conductivity in Ca and Si co-doped LiZr2(PO4)3 using a denoising autoencoder for experimental data"
   DOI: 10.1063/5.0231411
   2024.11.26; 計画A01 
7. K. Oka, N. Tanibata, H. Takeda, *M. Nakayama, S. Noguchi, M. Karasuyama, Y. Fujiwara, T. Miyuki, Sci. Rep.,14,28905_1-12 (2024)
   "Deep learning based emulator for predicting voltage behaviour in lithium ion batteries"
   DOI: 10.1038/s41598-024-80371-9
   2024.11.21; 計画A01 
8. *T. Ozawa, Y. Sugisawa, Y. Komatsu, R. Shimizu, T. Hitosugi, D. Sekiba, K. Yamauchi, I. Hamada, K. Fukutani, Nat. Commun.,15,9558_1-8(2024)
   "Isotope-dependent site occupation of hydrogen in epitaxial titanium hydride nanofilms"
   DOI: 10.1038/s41467-024-53838-6
   2024.11.14; 計画A02 
9. F. Takeiri, K. Kusumoto, K. Kawai, H. Yaguchi, T. Saito, K. Mori, S. Hosokawa, M. Okubo, *G. Kobayashi, Chem.Commun.,60,14388-14390 (2024)
   "Li2NbHO2: a new transition-metal oxyhydride with rock-salt-type structure"
   DOI: 10.1039/D4CC05503A
   2024.11.12; 計画A02, 計画A03 
10. *T. Ezaki, N. Imura, K. Nishinari, PLOS Complex Syst.,1(3),e0000017_1-15 (2024）
    "Synergistic integration of fragmented transportation networks: When do networks (not) synergize?"
    DOI: 10.1371/journal.pcsy.0000017
    2024.11.05; 計画A01 
11. T. Usami, K. Gocho, N. Tanibata, H. Takeda, *M. Nakayama, Electrochemistry.,92(11),117001_1-5(2024）
    "Investigation of Effect of Heterovalent Element Doping on Ionic Conductivity in Li3InCl6 System Using Neural-network Potential"
    DOI: 10.5796/electrochemistry.24-00088
    2024.11.01; 計画A01 
12. S. Ito, K. Rojas, Y. Yasuda, N. Noguchi, K. Fukuda, M. Hikichi, Z. Kang, M. Yuan, R. Tsuji, O. Oki, S. Roy, Y. Hikita, I. Matsuda, M. Miyauchi, *I. Hamada, *T. Kondo, J. Phys. Chem. Lett.,15,10965–10976(2024)
    "Inter-layer Hydrogen Recombination from Hydrogen Boride Nanosheets Elucidated by Isotope Labeling"
    DOI: 10.1021/acs.jpclett.4c01975
    2024.10.25; 計画A02 
13. K. Miyashita, K. Ogasawara, M. Miyazaki, H. Abe, Y. Niwa, *H. Kato, *H. Hosono, *M. Kitano, NPG Asia Mater.,16,54_2-9(2024）
    "Effects of nitrogen vacancy sites of oxynitride support on the catalytic activity for ammonia decomposition"
    DOI: 10.1038/s41427-024-00572-6
    2024.10.18; 計画A02 
14. *M. Liu, N. Oyama, T. Kawasaki, H. Mizuno, J. Appl. Phys.,136,144702(2024)
    "Classification of solid and liquid structures using a deep neural network unveils origin of dynamical heterogeneities in supercooled liquids"
    DOI: 10.1063/5.0229577
    2024.10.08; 計画A01 
15. Y. Miyaoka, T. Sato, Y. Oguro, S. Kondo, K. Nakano, M. Nakayama, Y. Ugata, D. Goonetilleke, N. Sharma, A. M. Glushenkov, S. Hiroi, K. Ohara, K.Takada, Y. Fujii, *N. Yabuuchi, ACS Cent. Sci.,10,1718-1732(2024）
    "A Practical and Sustainable Ni/Co-Free High-Energy Electrode Material: Nanostructured LiMnO2"
    DOI: 10.1021/acscentsci.4c00578
    2024.09.24; 計画A01, 計画A02 
16. M. Horibe, N. Tanibata, H.Takeda, *M. Nakayama, ACS Appl. Mater. Interfaces,16,53621-53630(2024)
    "Universal Neural Network Potential-Driven Molecular Dynamics Study of CO2/O2 Evolution at the Ethylene Carbonate/Charged–Electrode Interface"
    DOI: 10.1021/acsami.4c03866
    2024.09.24; 計画A01 
17. K. Kawai, S.-H. Jang, Y. Igarashi, K. Yazawa, K. Gotoh, J. Kikkawa, A. Yamada, Y. Tateyama, *M. Okubo, Angew. Chem. Int. Ed.,64,e202410971_1-8(2025)
    "Proton Intercalation into an Open-Tunnel Bronze Phase with Near-Zero Volume Change"
    DOI: 10.1002/anie.202410971
    2024.08.28; 計画A01, 計画A02 
18. H. Sato, *T. Sugimoto, J. Am. Chem. Soc.,146,24800–24807(2024)
    "Direct Operando Identification of Reactive Electron Species Driving Photocatalytic Hydrogen Evolution on Metal-loaded Oxides"
    DOI: 10.1021/jacs.3c14558
    2024.08.27; 計画A03 
19. R. Iwasaki, N. Tanibata, H. Takeda, *M. Nakayama, Commun. Mater.,5,148_1-8(2024)
    "Universal-neural-network-potential molecular dynamics for lithium metal and garnet-type solid electrolyte interface"
    DOI: 10.1038/s43246-024-00595-0
    2024.08.10; 計画A01 
20. *T. Ezaki, K. Nishinari, Y. Ando, Phys. Rev. Res.,6,L032032(2024)
    "Diffusion-facilitated transport of self-driven particles in polycrystalline structures"
    DOI: 10.1103/PhysRevResearch.6.L032032
    2024.08.08; 計画A01 
21. *S.-H. Jang*, R. Jalem, Y. Tateyama, J. Mater. Chem. A,12,20879-20886(2024)
    "Computational discovery of stable Na-ion sulfide solid electrolytes with high conductivity at room temperature"
    DOI: 10.1039/D4TA02522A
    2024.08.05; 計画A01 
22. *Z. Zhou, H. D. Luong, B. Gao, T. Momma, *Y. Tateyama, ACS Appl. Mater. Interfaces,16,42093-42099(2024)
    "LiNbO3 and LiTaO3 Coating Effects on the Interface of the LiCoO2 Cathode: A DFT Study of Li-Ion Transport"
    DOI: 10.1021/acsami.4c05737
    2024.08.05; 計画A01 
23. S. Sato, M. Miyazaki, *S. Matsuishi, *H. Hosono, *M. Kitano, Adv. Energy Mater.,14,2402353_1-11(2024）
    "Ammonia Synthesis over Ruthenium Supported on Metastable Perovskite Oxyhydrides BaREO2H (RE = Y, Sc) Prepared by Mechanochemical Method"
    DOI: 10.1002/aenm.202402353
    2024.08.03; 計画A02 
24. H. Takeda, *M. Shibasaki, K. Murakami, M. Tanaka, K. Makino, N. Tanibata, H. Maeda, M. Nakayama, Energy Adv.,3,2238-2244(2024)
    "Effect of synthesis process on the Li-ion conductivity of LiTa2PO8 solid electrolyte materials for all-solid-state batteries"
    DOI: 10.1039/D4YA00180J
    2024.07.11; 計画A01 
25. M. Sun, J. Cheng, A. Anzai, *H. Kobayashi, *M. Yamauchi, Adv. Sci.,11,240493_1-7(2024)
    "Modulating Electronic States of Cu in Metal-Organic Frameworks for Emerging Controllable CH4/C2H4 Selectivity in CO2 Electroreduction"
    DOI: 10.1002/advs.202404931
    2024.07.08; 計画A03 
26. *H. Mizuno, A. Ikeda, T. Kawasaki, K. Miyazaki, Commun. Phys.,7,199_1-12(2024)
    "Universal mechanism of shear thinning in supercooled liquids"
    DOI: 10.1038/s42005-024-01685-8
    2024.07.01; 計画A01 
27. T. Kawasaki, K. Miyazaki, Phys. Rev. Lett.,132,268201_1-6(2024)
    "Unified Understanding of Nonlinear Rheology near the Jamming Transition Point"
    DOI: 10.1103/PhysRevLett.132.268201
    2024.06.25; 計画A01 
28. N. H. A. Besisa, K.-S. Yoon, T. G. Noguchi, H. Kobayashi, *M.Yamauchi, ACS Sustain. Chem. Eng.,12,9874-9881(2024)
    "Defect-driven Optimization of TiO2-based Electrodes for High-efficiency Electrochemical 1,4-NADH Generation"
    DOI: 10.1021/acssuschemeng.4c02313
    2024.06.20; 計画A03 
29. *N. Tanibata, S. Aizu, M. Koga, H. Takeda, R. Kobayashi, M. Nakayama, J. Mater. Chem. A,12,15601-15607(2024)
    "Guidelines for designing high-deformability materials for all-solid-state lithium-ion batteries"
    DOI: 10.1039/D4TA02328E
    2024.06.11; 計画A01 
30. N. Hashimoto, *K. Mori, H. Yoshida, N. Kamiuchi, R. Kitaura, R. Hirasawa, H. Yamashita, Nano Lett.,24,7063−7068(2024)
    "Thermal stability of high-entropy alloy nanoparticles evaluated by in situ TEM observations"
    DOI: 10.1021/acs.nanolett.4c01625
    2024.05.28; 計画A03 
31. N. Ishiguro, F. Kaneko, M. Abe, Y. Takayama, J. Yoshida, T. Hoshino, S. Takazawa, H. Uematsu, Y. Sasaki, N. Okawa, K. Takahashi, H. Takizawa, H. Kishimoto, *Y. Takahashi, Appl. Phys. Express.,17,52006_1-5(2024)
    "Towards sub-10 nm spatial resolution by tender X-ray ptychographic coherent diffraction imaging"
    DOI: 10.35848/1882-0786/ad4846
    2024.05.27; 計画A03 
32. *N. Oyama, T. Kawasaki, K. Kim, H. Mizuno, Phys. Rev. Lett.,132,148201_1-6(2024)
    "Scale Separation of Shear-Induced Criticality in Glasses"
    DOI: 10.1103/PhysRevLett.132.148201
    2024.04.03; 計画A01