東京科学大学総合研究院
化学生命科学研究所
館山・安藤研究室
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館山教授のページはこちら。安藤准教授のページはこちら。佐々木助教のページはこちら。中嶋助教のページはこちら。

論文リスト(2023-)

2025

  1. Huu Duc Luong*, Zizhen Zhou, Yoshitaka Tateyama*, J. Power Sources 641, 236854 (2025). “Simultaneous migration mechanism of Co-O couple toward spinel-like Co3O4 formation on LixCoO2 surfaces” [open access] DOI: 10.1016/j.jpowsour.2025.236854
  2. Ruijie Zheng、Shigeru Kobayashi*、Mana Ogawa, Hiroto Katsuragawa, Yuki Watanabe, Jun Deng, Ryo Nakayama, Kazunori Nishio, Ryota Shimizu, Yoshitaka Tateyama, Makoto Moriya, Taro Hitosugi*, ACS Appl. Mater. Interfaces ?? (2025). “Investigating the Interface of Li{N(SO2F)2}(NCCH2CH2CN)2 Molecular Crystal Electrolytes for 5 V Class Solid-State Batteries” DOI: 10.1021/acsami.4c22076
  3. Ryoma Sasaki*, Yoshitaka Tateyama, Debra J. Searles, PRX Energy 4, 013005 (2025). “Constant-Current Nonequilibrium Molecular Dynamics Approach for Accelerated Computation of Ionic Conductivity Including Ion-Ion Correlation” [open access] DOI: 10.1103/PRXEnergy.4.013005
  4. Xiaoni Zhang, Tomoko Fujino, Yasunobu Ando, Yuki Tsujikawa, Tianle Wang, Takeru Nakashima, Haruto Sakurai, Kazuki Yamaguchi, Masafumi Horio, Hatsumi Mori, Jun Yoshinobu, Takahiro Kondo, Iwao Matsuda* Commun. Chem. 8, 14 (2025). “Discovery of bicyclic borane molecule B14H26” DOI: 10.1038/s42004-025-01409-1
  5. Jingmin Tang, Takeru Nakashima, Masashige Miyamoto, Xiaoni Zhang, Masafumi Horio, Yasunobu Ando, Iwao Matsuda*, e-J. Surf. Sci. Nanotechnol. 23, 59-64 (2025). “Developing a Machine-Learning-based Robotic System for Mixing Solvents” DOI: 10.1380/ejssnt.2025-001
  6. Yasunobu Ando*, Shusuke Kasamatsu, Suguru Iwasaki, Yumi Tanaka, Sci. Technol. Adv. Mater. Meth. 5 2441102 (2025). “Fitting of nonnegative physical models based on statistical divergence: application to thermally stimulated depolarization currents” DOI: 10.1080/27660400.2024.2441102
  7. Yusuke Sato, Yuki Fukaya, Akito Nakano, Takeo Hoshi, Chi-Cheng Lee, Kazuyoshi Yoshimi, Taisuke Ozaki, Takeru Nakashima, Yasunobu Ando, Hiroaki Aoyama, Tadashi Abukawa, Yuki Tsujikawa, Masafumi Horio, Masahito Niibe, Fumio Komori, Iwao Matsuda*, Phys. Rev. Materials 9, 014002 (2025). “Surface structure of the 3×3-Si phase on Al(111), studied by the multiple usages of positron diffraction and core-level photoemission spectroscopy” DOI: 10.1103/PhysRevMaterials.9.014002

2024

  1. Interface Ionics ~For All-Solid-State Batteries and Solid State Ionics Devices~ (The Materials Research Society Series), Eds. Yasutoshi Iriyama, Koji Amezawa, Yoshitaka Tateyama, Naoaki Yabuuchi, Springer Singapore (2024). DOI: https://doi.org/10.1007/978-981-97-6039-8

  2. Feye-Feng Lu, Huu Duc Luong, Seong-Hoon Jang, Randy Jalem, Yoshitaka Tateyama*, Hong-Kang Tian*, J. Power Sources 628, 235906 (2025). ” Dual influence of protonation on Li-ion transport in garnet solid electrolytes: A first-principles study” DOI: 10.1016/j.jpowsour.2024.235906

  3. Kai Kihara, Katsuhiro Nishinari, Yasunobu Ando, Takahiro Ezaki*, Phys. Rev. Res. 6, 043210 (2024). “Solid-electrolyte-inspired totally asymmetric simple exclusion process with parallel channels and random defects” [open access] DOI: 10.1103/PhysRevResearch.6.043210

  4. Seong-Hoon Jang*, Randy Jalem, Yoshitaka Tateyama, Adv. Energy Sustainability Res. “Predicting Room-Temperature Conductivity of Na-Ion Super Ionic Conductors with the Minimal Number of Easily-Accessible Descriptors” DOI: 10.1002/aesr.202400158

  5. 館山　佳尚*, JALEM Randy, 高　博, セラミックス, ５９, １０月号, 679-682（2024). “第一原理計算で見たガーネット型固体電解質の粒界イオン伝導とドーパント効果” (全固体電池の設計ー構造設計と解析ー特集号) [open access] HP: https://member.ceramic.or.jp/journal/vol_no/59/10/59_10.html
  6. Kosuke Kawai, Seong-Hoon Jang, Yuta Igarashi, Koji Yazawa, Kazuma Gotoh, Jun Kikkawa, Atsuo Yamada, Yoshitaka Tateyama, Masashi Okubo*, Angew. Chem. Int. Ed. “Proton Intercalation into an Open-Tunnel Bronze Phase with Near-Zero Volume Change” [open access] DOI:10.1002/anie.202410971
  7. Takahiro Ezaki*, Katsuhiro Nishinari, Yasunobu Ando, Phys. Rev. Res. 6, L032032 (2024). “Diffusion-facilitated transport of self-driven particles in polycrystalline structures” [open access] DOI: 10.1103/PhysRevResearch.6.L032032
  8. Yuki Tsujikawa, Takeru Nakashima, Xiaoni Zhang, Kazuki Yamaguchi, Masafumi Horio, Masahiro Haze, Yukio Hasegawa, Fumio Komori, Takahiro Kondo, Yasunobu Ando, Iwao Matsuda*, Phys. Rev. Mater. 8, 084003 (2024). “Dimensional crossover and chirality of boron adsorbates on copper (110) surfaces” DOI: 10.1103/PhysRevMaterials.8.084003
  9. Tarojiro Matsumura, Naoka Nagamura, Shotaro Akaho, Kenji Nagata, Yasunobu Ando*, Sci. Technol. Adv. Mater. Meth. 4, 2373046 (2024). “Maximum a posteriori estimation for high-throughput peak fitting in X-ray photoelectron spectroscopy” DOI: 10.1080/27660400.2024.2373046
  10. Zizhen Zhou*, Huu Duc Luong, Bo Gao, Toshiyuki Momma, Yoshitaka 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” [open access] DOI: 10.1021/acsami.4c05737
  11. Seong-Hoon Jang*, Randy Jalem, Yoshitaka Tateyama, J. Mater. Chem. A 12, 20879-20886 (2024). “Computational discovery of stable Na-ion sulfide solid electrolytes with high conductivity at room temperature” [open access] DOI: 10.1039/d4ta02522a
  12. Kazuki Yamaguchi, Masahito Niibe, Xiaoni Zhang, Toshihide Sumi, Masafumi Horio, Yasunobu Ando, Jun-ichi Yamaura, Eiken Nakamura, Kiyohisa Tanaka, Takahiro Kondo, Iwao Matsuda*, Phys. Rev. Mater. 8, 074005 (2024). “Macroscopic Sheets of Hydrogen Boride and Their Spectroscopic Evaluation”, DOI: 10.1103/PhysRevMaterials.8.074005
  13. Qianli Si, Shoichi Matsuda, Youhei Yamaji, Toshiyuki Momma, Yoshitaka Tateyama*, Adv. Sci., 11, 2402608 (2024).”Data-Driven Cycle Life Prediction of Lithium Metal-Based Rechargeable Battery Based on Discharge/Charge Capacity and Relaxation Features” [open access] DOI: 10.1002/advs.202402608
  14. Takeru Nakashima, Ikuma Tateishi, Yuki Tsujikawa, Masafumi Horio, Takahiro Kondo, Iwao Matsuda, Yasunobu Ando*, Phys. Rev. B 109, 165104 (2024). “Phase stability and band degeneracy of quasi-one-dimensional boron chain polymorphs embedded in LiB crystals” DOI: 10.1103/PhysRevB.109.165104
  15. Kosuke Kawai, Yasunobu Ando, Masashi Okubo*, Small Methods 2024, 2400062 (2024). “Machine Learning‐Assisted Survey on Charge Storage of MXenes in Aqueous Electrolytes” DOI: 10.1002/smtd.202400062
  16. Yuki Tsujikawa, Xiaoni Zhang, Kazuki Yamaguchi, Masahiro Haze, Takeru Nakashima, Arpita Varadwaj, Yusuke Sato, Masafumi Horio, Yukio Hasegawa, Fumio Komori, Masaki Oshikawa, Masato Kotsugi, Yasunobu Ando, Takahiro Kondo, Iwao Matsuda*, Nano Lett. 24, 1160-1167 (2024). “Quasi-Periodic Growth of One-Dimensional Copper Boride on Cu(110)” DOI: 10.1021/acs.nanolett.3c03861
  17. Itsuki Konuma, Naohiro Ikeda, Benoît D.L. Campéon, Hinata Fujimura, Jun Kikkawa, Huu Duc Luong, Yoshitaka Tateyama, Yosuke Ugata, Masao Yonemura, Toru Ishigaki, Taira Aida, Naoaki Yabuuchi*, Energy Storage Mater. 55, 103200 (2024). ” Unified understanding and mitigation of detrimental phase transition in cobalt-free LiNiO2″ [open access] DOI: 10.1016/j.ensm.2024.103200

2023

  1. Zizhen Zhou, Claudio Cazorla, Bo Gao, Huu Duc Luong, Toshiyuki Momma, Yoshitaka Tateyama*, ACS Appl. Mater. Interfaces  (2023). “First-Principles Study on the Interplay of Strain and State-of-Charge with Li-Ion Diffusion in the Battery Cathode Material LiCoO2” [open access] DOI: 10.1021/acsami.3c14444

  2. Randy Jalem, Manas Likhit Holekevi Chandrappa, Ji Qi, Yoshitaka Tateyama, Shyue Ping Ong*, Energy Adv. 2, 2029-2041 (2023).”Lithium dynamics at grain boundaries of β-Li3PS4 solid electrolyte” [open access] DOI: 10.1039/D3YA00234A

  3. Wenchong Zhou, Chenchao Xu, Bo Gao, Masanobu Nakayama, Shunsuke Yagi, Yoshitaka Tateyama*, ACS Energy Lett. 8, 4113-4118 (2023). ” Glyme Solvent Decomposition on Spinel Cathode Surface in Magnesium Battery” [open access] DOI: 10.1021/acsenergylett.3c01084
  4. Shigeru Kobayashi, Ryota Shimizu, Yasunobu Ando, Taro Hitosugi*, ACS Materials Lett. 5, 10, 2711–2717 (2023). “Autonomous Exploration of an Unexpected Electrode Material for Lithium Batteries” DOI: /10.1021/acsmaterialslett.3c00350
  5. Randy Jalem*, Yoshitaka Tateyama, Kazunori Takada, Seong-Hoon Jang, J. Phys. Chem. C 127, 17307-17323 (2023). “Multi-objective solid electrolyte design of tetragonal and cubic inverse-perovskites for all-solid-state lithium-ion batteries by high-throughput DFT calculations and AI-driven methods” DOI: 10.1021/acs.jpcc.3c02801
  6. Masahito Ikeda, Randy Jalem*, Gen Hasegawa, Naoaki Kuwata, Qiumin Liu, Takafumi Yamamoto, Kei Shigematsu, Yoshitaka Tateyama, Masaki Azuma*, J. Phys. Chem. C 127, 14117-14124 (2023). “Theoretical Prediction and High-Pressure Synthesis of New LISICON-Type Solid-State Electrolyte Li2.75[B0.625P0.125S0.25]O3.375” DOI: 10.1021/acs.jpcc.3c02842
  7. Yoshitaka Tateyama*, Akiko Kagatsume, Masaru Yao, Shoichi Matsuda, Kohei Uosaki, J. Phys. Chem. C 127, 12867-12873 (2023). “Exploration of Organic Cathode Active Materials with High Energy Densities for Li-Ion Batteries via First-Principles Calculations” DOI: 10.1021/acs.jpcc.3c02131
  8. Seong-Hoon Jang*, Randy Jalem*, Yoshitaka Tateyama, J. Phys. Chem. A 127, 5734-5744 (2023). “EwaldSolidSolution: A High-Throughput Application to Quickly Sample Stable Site Arrangements for Ionic Solid Solutions” DOI: 10.1021/acs.jpca.3c00076
  9. Toshihiko Mandai*, Masaru Yao, Keitaro Sodeyama, Akiko Kagatsume, Yoshitaka Tateyama, Hiroaki Imai, J. Phys. Chem. C 127, 10419-10433 (2023). “Toward Improved Anodic Stability of Ether-Based Electrolytes for Rechargeable Magnesium Batteries” DOI: 10.1021/acs.jpcc.3c01452
  10. Ryoma Sasaki*, Bo Gao, Taro Hitosugi, Yoshitaka Tateyama*, npj Comput. Mater. 9, 48 (2023). “Nonequilibrium molecular dynamics for accelerated computation of ion–ion correlated conductivity beyond Nernst–Einstein limitation” [open access] DOI: 10.1038/s41524-023-00996-8
  11. Huu Duc Luong, Chenchao Xu, Randy Jalem, Yoshitaka Tateyama*, J. Power Sources 569, 232969 (2023). “Evaluation of battery positive-electrode performance with simultaneous ab-initio calculations of both electronic and ionic conductivities” DOI: 10.1016/j.jpowsour.2023.232969
  12. F.A. Vasquez, N.C. Rosero-Navarro*, R. Jalem*, A. Miura, Y. Goto, Y. Tateyama, J.A. Calderon*, K. Tadanaga, Appl. Mater. Today 30, 101697 (2023). “Microwave assisted preparation of LiFePO4/C coated LiMn1.6Ni0.4O4 for Li-ion batteries with superior electrochemical properties” [open access] DOI: 10.1016/j.apmt.2022.101697

      招待・依頼講演リスト(2023-)

      2025

      1. Yoshitaka Tateyama, “Interface Chemistry and Ion Transport in Battery Materials by Advanced DFT-based Calculations”, Understanding Surfaces and Interfaces: A Symposium Celebrating 7 Decades of Service (of Prof. Michael L. Klein), Kyoto Campus, Temple University Japan, Kyoto, Japan, 2025/03/14-15

      2. 安藤康伸, “データの⽣成・蓄積・活⽤のサイクルに基づくデータ駆動材料科学”, 新物質の物理的・数学的・化学的アプローチによる分野融合研究に関する講演会 群馬大学, 桐生市, 群馬県, 2025/01/29

      3. Yoshitaka Tateyama, “Microscopic Ion Transport Mechanism in Cathodes, Solid Electrolytes and Their Interfaces Via Atomistic Simulations” Advanced Green-Energy Materials Conference (AGEM), National Cheng Kung Universit, National Cheng Kung University, Tainan, Taiwan, 2025/01/15-17

      2024

      1. Yoshitaka Tateyama, “Advanced MD Study on Ion Transport in Battery Solid Electrolyte” 2024 Taiwan-Japan Joint Symposium ~ Beyond our Future with People, Intelligence and Materials, Kyushu Univ. Nishijin Plaza, Kyusyu Univ. Fukuoka Japan, 2024/12/19-20

      2. Yoshitaka Tateyama, “Interface Chemistry and Ion Transport in Solid-State Battery Materials by Advanced DFT-based Calculations” The 8th International Conference on Electronic Materials and Nanotechnology for Green Environment (ENGE2024), ENGE2024 organizing committee, Jeju Shinhwa World, Jeju, Korea, 2024/11/25-27

      3. Yoshitaka Tateyama, “Theoretical elucidation of microscopic Na-ion state/dynamics in NIB electrodes and (solid) electrolyte”, The 9th International Conference on Sodium Batteries (ICNaB), Pacific North-West National Laboratory, Richland, WA, USA, 2024/11-14

      4. Yoshitaka Tateyama, “Strain Effects on Li-ion Transport around Cathode-Coating Interfaces: A DFT Study”, The 14th Japan-France Joint Meeting on Battery, Kagaku Denchi Zairyo Kenkyukai, Matsue, Shimane, Japan, 2024/09/04-07

      5. 佐々木遼馬, “非平衡分子動力学法によるイオン相関を考慮したイオン伝導度計算の高速化”, 第18回 固体イオニクスセミナー, 日本固体イオニクス学会, 筑波山ホテル青木屋, 茨城県, 2024/08/05

      6. Yoshitaka Tateyama, “Microscopic electrochemistry for interface ionics based on DFT calculation”, Workshop on Interfacial Chemistry and Charge Transfer for Energy Storage and Conversion, Telluride Science & Innovation Center, Telluride, CO, USA, 2024/08/04-08

      7. 安藤康伸, “イオン渋滞学の構築に向けた数理・計算シミュレーション解析”, 学術変革領域A「イオン渋滞学」第１回公開シンポジウム. 東京大学 本郷キャンパス, 東京都, 2024/08/01

      8. Yoshitaka Tateyama, “Nanometer-size Na cluster formation in micropore of hard carbon suggested by DFT calculations”, UK-Japan Next-Generation Batteries Seminar, JST-ASPIRE project, King’s College London, London, UK, 2024/07/20

      9. 館山佳尚, “蓄電池内部のカチオンダイナミクスに関する高度分子動力学シミュレーション”, 令和6年度中性子産業利用報告会, CROSS中性子科学センター, 秋葉原、東京都, 2024/07/11

      10. Yoshitaka Tateyama, “High-Throughput DFT-level Self-Diffusion Coefficient Calculation for Na-ion Sulfide SEs + Electronic States Discussion”, Workshop bridging between theory and experiment on all-solid-state battery materials, JST-ASPIRE project & JSPS “Ion-Jamology” project & Tateyama-Ando group, Suzukake-dai campus, Tokyo Institute of Technology, Yokohama, Japan, 2024/06/27

      11. Ryoma Sasaki, “Nonequilibrium molecular dynamics beyond dilute approximation to solid state ionics with ion correlation”, International Symposium on ‘Green Technologies for Excellence (GteX)’ for Young Researchers, JST ASPIRE project, Green Technologies for Excellence (GteX) project, Waseda University, Shinjuku, Tokyo, Japan,, 2024/06/25

      12. Yoshitaka Tateyama,”Microscopic Elucidation of Battery “Interfaces” and “Ionics” Via Atomistic Simulations”, Kick-off Meeting of JST ASPIRE project -International Collaboration Network for Innovative Battery Technology and Net-Zero Society-, JST-ASPIRE project & Okubo group, Waseda U., Waseda University, Shinjuku, Tokyo, Japan, 2024/06/24

      13. Yoshitaka Tateyama, “Microscopic Elucidation of Ion Transport in Cathodes, Solid Electrolytes and Their Interfaces Via Atomistic Simulations”, IMLB2024 (The 22nd International Meeting on Lithium Batteries), IMLB2024 local organizing committee, AsiaWorld Expo., Hong Kong, 2024/06/16-21

      14. 館山佳尚, “第一原理計算が示唆する正極、固体電解質およびその界面の微視的イオン輸送機構”, 第421回電池技術委員会, (公社)電気化学会　電池技術委員会, 早稲田大学, 東京都, 2024/06/12

      15. Yoshitaka Tateyama, “First-Principles Calculation Study on Degradation-Related Phenomena around Cathode/Solid Electrolyte Interfaces in Solid-State Battery”, 2024 MRS SPRING MEETING & EXHIBIT, Materials Research Society (MRS), @Seattle Convention Center Summit, 2024/04/22-26

      16. 安藤康伸, “低次元性を有するホウ化物に関する理論研究”, 第16回日本ホウ素・ホウ化物研究会, 東京大学柏の葉キャンパス駅前サテライト, 千葉県, 2024/02/16

      2023

      1. Yasunobu Ando, “Machine learning-based amorphous simulation and high-throughput spectral modeling” MRM2023 Kyoto, Japan, 2023/12/13

      2. 安藤康伸,“データ生成・蓄積・活用のためのデータ駆動材料科学の進展”, 2023年触媒学会北海道支部札幌講演会 「近未来系物質合成・材料探索：データ駆動型研究はどこに向かうのか」 北海道大学 創成科学研究棟 ５階 大会議室, 札幌市, 2023/11/27

      3. Yoshitaka Tateyama, “Interface Chemistry and Ion Transport in Batteries Revealed by Advanced First-Principles Calculations”, Japanese-German Joint Seminar on Sustainable Batteries, BMBF and JST, @MEET Hall, MEET Battery Research Center, Corrensstrasse 46, 48149 Münster, Germany, 2023/11/13-15 (11/15)

      4. Yoshitaka Tateyama, “Advanced MD Study on Ion Transport in Battery Solid Electrolyte” Structure and Dynamics of Chemical and Biomolecular Systems (SDCBS23), IIT Kanpur, @IIT Kanpur, India, 2023/10/26-28

      5. 安藤康伸, “データ生成・蓄積・活用サイクルに向けたデータ駆動材料科学”,（独）日本学術振興会 R031 ハイブリッド量子ナノ技術委員会第 13 回研究会 東京大学生産技術研究所, 目黒区, 2023/10/06

      6. 館山佳尚, “物理‐化学連携による持続的成長に向けた高機能・長寿命材料の探索・制御：「富岳」材料物理化学課題”, 第16回材料系ワークショップ　～アカデミアと社会を結ぶ「富岳」の利用に向けて～, 一般財団法人高度情報科学技術研究機構(RIST), @秋葉原UDX, 東京都, 2023/10/3

      7. 館山佳尚, “電池内の電子・イオン移動に関する計算科学”, 第８４回応用物理学会秋季学術講演会　シンポジウム：表面・界面における電子・イオン移動に基づくエネルギー変換の最前線, 公益社団法人応用物理学会, @熊本城ホール, 熊本市, 2023/9/19-23

      8. 安藤康伸, “EMアルゴリズムによるポアソン誤差を考慮した安定な物理モデル推定”, 第15回 ⽇本放射光学会 若⼿研究会「放射光と顕微鏡技術・機械学習との交差点」 ⼤阪⼤学吹⽥キャンパス, 大阪市, 2023/09/11

      9. 安藤康伸,“第一原理計算データを活用したデータ駆動型 物質・材料研究” 第９回 大型実験施設とスーパーコンピュータとの連携利用シンポジウム ―マテリアルデータサイエンスに向けた自動測定と自動解析の展開―, 秋葉原UDX, 千代田区, 2023/09/04

      10. Yoshitaka Tateyama, “Advanced DFT-MD Study on Ion Transport in Solid Electrolyte: Grain Boundary and Ion Correlation”, IUMRS-ICAM & ICMAT 2023, MRS Singapore, @SUNTEC Singapore, Singapore, 2023/6/26-30

      11. 安藤康伸, “計算データ生成・蓄積・活用と機械学習ポテンシャル”, 2023 年度 東京大学物性研究所 社会連携研究部門&データ連携部会合同シンポジウム, 柏の葉キャンパス駅前サテライト 1 階 多目的ホール, 柏市, 2023/6/26

      12. 館山佳尚, “理論計算によるイオン伝導度研究の最新動向”, 第24回超イオン導電体物性研究会（第84回固体イオニクス研究会）, 一般社団法人日本固体イオニクス学会, @NIMS, Tsukuba, 2023/6/8-9

      13. Yoshitaka Tateyama, “Unravelling the Fast Li-ion Conduction Mechanism in Li(FSA)(SN)2 Molecular Crystal: A Molecular Dynamics Study”, 2023 Japan-Taiwan Nano Material and Biomedicine Workshop, NIMS and National Cheng Kung University, @NIMS, Tsukuba, Japan, 2023/5/15

      14. 館山佳尚, “金属負極－電解質界面の計算科学研究動向”, 近化電池セミナー「金属負極二次電池の現状と展望」, 近畿化学協会, @大阪科学技術センター, 大阪市, 2023/4/26

      15. 館山佳尚, GAO Bo, JALEM Randy, “酸化物固体電解質粒界における界面イオン伝導に関する第一原理MD解析”, 日本化学会第103春季年会併設シンポジウム　全固体電池のプロセスサイエンス第2回シンポジウム, NIMSマテリアライズ事務局, @東京理科大野田キャンパス、野田市, 2023/3/23

      16. Yoshitaka Tateyama, “Advanced DFT-MD study on Ion Transport in Solid Electrolyte: Grain Boundary and Ion Correlation”, Japan-US Joint Seminar on Fundamentals of Next Generation Batteries, JST and DOE, @NIMS, Tsukuba, Japan, 2023/03/16-17　

      17. Yoshitaka Tateyama, “DFT-based studies on “battery” issues”, EU-Japan Workshop on High-Performance Computing, DG CONECT EU and MEXT JAPAN, @online, 2023/01/25

      18. 館山佳尚, “第一原理MD を用いた蓄電池のイオン伝導計算手法の開発と応用”, ｢富岳｣電池課題 第３回公開シンポジウム（成果報告会）, 国立研究開発法人 物質・材料研究機構 ｢富岳｣電池課題, @online, 2023/1/5

            講演・ポスターリスト(2023-)

            2024

            1. TBA

            2023

            1. TBA
            2. [Poster] Bo Gao, Randy Jalem, Yanming Ma, Yoshitaka Tateyama, “Microscope mechanism of Li-ion transport at Interfaces between LiCoO2 Cathode and Sulfide Electrolyte in All-Solid-State Battery via DFT-CALYPSO Method”, Materials research meeting 2019, MRS-Japan, Yokohama symposia, Yokohama, 2019/12/10-2019/12/14
            3. [Oral] Bo Gao, Randy Jalem, Yanming Ma, Yoshitaka Tateyama, “Structure Search and Property Analysis of Interfaces between Cathode and Solid Electrolyte in All-Solid-State Battery via DFT-CALYPSO Method”, The 10th Asian Conference on Electrochemical Power Sources 2019, The organizing committee of ACEPS-10, Kaohsiung Exhibition Center, Kaohsiung, Taiwan, 2019/11/24-2019/11/27
            4. [Poster] Bo Gao, Randy Jalem, Yanming Ma, Yoshitaka Tateyama, “Structure Search and Property Analysis of Interfaces between Cathode and Solid Electrolyte in All-Solid-State Battery via DFT-CALYPSO Method”, The 22nd Asian Workshop on First-Principles Electronic Structure Calculations, The organizing committee of Asian-22, Osaka University Hall, Osaka, Japan, 2019/10/28-2019/10/30