@article{CTT100921793,
  author = {Si, Q. and Matsuda, S. and Yamaji, Y. and Momma, T. and Yoshitaka Tateyama},
  title = {Data-Driven Cycle Life Prediction of Lithium Metal-Based Rechargeable Battery Based on Discharge/Charge Capacity and Relaxation Features},
  journal = {Advanced Science},
  year = 2024,
}

@article{CTT100921795,
  author = {Konuma, I. and Ikeda, N. and Campéon, B.D.L. and Fujimura, H. and Kikkawa, J. and Luong, H.D. and Yoshitaka Tateyama and Ugata, Y. and Yonemura, M. and Ishigaki, T. and Aida, T. and Yabuuchi, N.},
  title = {Unified understanding and mitigation of detrimental phase transition in cobalt-free LiNiO<sub>2</sub>},
  journal = {Energy Storage Materials},
  year = 2024,
}

@article{CTT100921800,
  author = {Zhou, Z. and Cazorla, C. and Gao, B. and Luong, H.D. and Momma, T. and Yoshitaka Tateyama},
  title = {First-Principles Study on the Interplay of Strain and State-of-Charge with Li-Ion Diffusion in the Battery Cathode Material LiCoO<sub>2</sub>},
  journal = {ACS Applied Materials and Interfaces},
  year = 2023,
}

@article{CTT100921802,
  author = {Jalem, R. and Chandrappa, M.L.H. and Qi, J. and Yoshitaka Tateyama and Ong, S.P.},
  title = {Lithium dynamics at grain boundaries of β-Li<sub>3</sub>PS<sub>4</sub> solid electrolyte},
  journal = {Energy Advances},
  year = 2023,
}

@article{CTT100921801,
  author = {Zhou, W. and Xu, C. and Gao, B. and Nakayama, M. and Yagi, S. and Yoshitaka Tateyama},
  title = {Glyme Solvent Decomposition on Spinel Cathode Surface in Magnesium Battery},
  journal = {ACS Energy Letters},
  year = 2023,
}

@article{CTT100921804,
  author = {Jalem, R. and Yoshitaka Tateyama and Takada, K. and Jang, S.-H.},
  title = {Multiobjective Solid Electrolyte Design of Tetragonal and Cubic Inverse-Perovskites for All-Solid-State Lithium-Ion Batteries by High-Throughput Density Functional Theory Calculations and AI-Driven Methods},
  journal = {Journal of Physical Chemistry C},
  year = 2023,
}

@article{CTT100921799,
  author = {Yoshitaka Tateyama and Kagatsume, A. and Yao, M. and Matsuda, S. and Uosaki, K.},
  title = {Exploration of Organic Cathode Active Materials with High Energy Densities for Li-Ion Batteries via First-Principles Calculations},
  journal = {Journal of Physical Chemistry C},
  year = 2023,
}

@article{CTT100921798,
  author = {Jang, S.-H. and Jalem, R. and Yoshitaka Tateyama},
  title = {EwaldSolidSolution: A High-Throughput Application to Quickly Sample Stable Site Arrangements for Ionic Solid Solutions},
  journal = {Journal of Physical Chemistry A},
  year = 2023,
}

@article{CTT100921805,
  author = {Mandai, T. and Yao, M. and Sodeyama, K. and Kagatsume, A. and Yoshitaka Tateyama and Imai, H.},
  title = {Toward Improved Anodic Stability of Ether-Based Electrolytes for Rechargeable Magnesium Batteries},
  journal = {Journal of Physical Chemistry C},
  year = 2023,
}

@article{CTT100921797,
  author = {Luong, H.D. and Xu, C. and Jalem, R. and Yoshitaka Tateyama},
  title = {Evaluation of battery positive-electrode performance with simultaneous ab-initio calculations of both electronic and ionic conductivities},
  journal = {Journal of Power Sources},
  year = 2023,
}

@article{CTT100921058,
  author = {Ryoma Sasaki and Bo Gao and Taro Hitosugi and Yoshitaka Tateyama},
  title = {Nonequilibrium molecular dynamics for accelerated computation of ion–ion correlated conductivity beyond Nernst–Einstein limitation},
  journal = {npj Computational Materials},
  year = 2023,
}

@article{CTT100921794,
  author = {Yamada, H. and Ohara, K. and Hiroi, S. and Sakuda, A. and Ikeda, K. and Ohkubo, T. and Nakada, K. and Tsukasaki, H. and Nakajima, H. and Temleitner, L. and Pusztai, L. and Ariga, S. and Matsuo, A. and Ding, J. and Nakano, T. and Kimura, T. and Kobayashi, R. and Usuki, T. and Tahara, S. and Amezawa, K. and Yoshitaka Tateyama and Mori, S. and Hayashi, A.},
  title = {Lithium Ion Transport Environment by Molecular Vibrations in Ion-Conducting Glasses},
  journal = {Energy and Environmental Materials},
  year = 2023,
}

@article{CTT100921808,
  author = {Jang, S.-H. and Yoshitaka Tateyama and Jalem, R.},
  title = {High-Throughput Data-Driven Prediction of Stable High-Performance Na-Ion Sulfide Solid Electrolytes},
  journal = {Advanced Functional Materials},
  year = 2022,
}

@article{CTT100908363,
  author = {Yuuki Sugawara and Keigo Kamata and Atsushi Ishikawa and Yoshitaka Tateyama and Takeo Yamaguchi},
  title = {Efficient Oxygen Evolution Electrocatalysis on CaFe2O4 and Its Reaction Mechanism},
  journal = {ACS Applied Energy Materials},
  year = 2021,
}

@article{CTT100904303,
  author = {Atsushi Ishikawa and Yoshitaka Tateyama},
  title = {First-Principles Microkinetic Analysis of NO + CO Reactions on Rh(111) Surface toward Understanding NO<i><sub>x</sub></i> Reduction Pathways},
  journal = {The Journal of Physical Chemistry C},
  year = 2018,
}

@article{CTT100921944,
  author = {Yoshitaka Tateyama and Ogitsu, T. and Kusakabe, K. and Tsuneyuki, S. and Itoh, S.},
  title = {Proposed synthesis path for heterodiamond BC2N},
  journal = {Physical Review B - Condensed Matter and Materials Physics},
  year = 1997,
}

@article{CTT100921945,
  author = {Yoshitaka Tateyama and Ogitsu, T. and Kusakabe, K. and Tsuneyuki, S.},
  title = {Constant-pressure first-principles studies on the transition states of the graphite-diamond transformation},
  journal = {Physical Review B - Condensed Matter and Materials Physics},
  year = 1996,
}

@inproceedings{CTT100921069,
  author = {佐々木 遼馬 and 一杉 太郎 and 館山 佳尚},
  title = {非平衡MD法による固体電解質のイオン相関を考慮したイオン伝導度計算の高速化},
  booktitle = {},
  year = 2023,
}

@misc{CTT100909652,
  author = {館山 佳尚 and 張 成燻 and JALEM Randy},
  title = {第一原理計算を基軸とした高イオン伝導度固体電解質のハイスループット探索と記述子抽出},
  year = 2023,
}