論文

• Ruicheng Li, G. Budiutama, S. Manzhos, M. Ihara. Hybrid DFTB – Molecular Mechanics approach: applicability to optical properties, 34th IUPAP Conference on Computational Physics (CCP2023), Proceeding of 34th IUPAP Conference on Computational Physics (CCP2023), Springer Proceedings in Physics, Nov. 2023.
• G. Budiutama, Ruicheng, M. Ihara*, S. Manzhos*. Hybrid Density Functional Tight Binding (DFTB) – molecular mechanics approach for a low-cost expansion of DFTB applicability, Journal of Chemical Theory and Computation, Volume 19, Issue 15, Page 5189–5198, July 2023.

国際会議発表 (査読なし・不明)

• Ruicheng Li, Gekko Budiutama, Keisuke Kameda, Sergei Manzhos, Manabu Ihara. Exploring The Application of Hybrid DFTB-Molecular Mechanics Approach to Computing Optical Properties, 2024 MRS Spring Meeting & Exhibit, May 2024.
• Ruicheng Li, Keisuke Maeda, Man-Fai Ng, Keisuke Kameda, Sergei Manzhos, Manabu Ihara. Exploring Carbon Nanoflake Based Materials for Charge Transport Layers of Perovskite Solar Cells: A Combined DFT-DFTB Study Including Effects of Solid-State Packing, 2024 MRS Spring Meeting & Exhibit, May 2024.
• Ruicheng Li, Keisuke Kameda, Sergei Manzhos, Manabu Ihara. Carbon Nanoflake Based Materials for Charge Transport Layers of Perovskite Solar Cells: Insight from Atomistic Modeling into Nanosizing and Functionalization Suitable for Electron and Hole Transport, 2023 MRS Fall Meeting & Exhibit, Nov. 2023.
• Gekko Budiutama, Ruicheng Li, Sergei Manzhos, Manabu Ihara. Combining Density Functional Tight Binding (DFTB) with empiric potentials for large-scale semiempirical materials modeling, The 34th IUPAP Conference on Computational Physics (CCP2023), Aug. 2023.

国内会議発表 (査読なし・不明)

• 前田 佳亮, Li Ruicheng, 亀田 恵佑, Manzhos Sergei, 伊原 学. 第一原理計算を用いた材料インフォマティクスにおける ペロブスカイト太陽電池の炭素系材料の検討, 第85回応用物理学会秋季学術講演会, Sept. 2024.
• Ruicheng Li, Keisuke Maeda, Man-Fai Ng, Keisuke Kameda, Sergei Manzhos, Manabu Ihara. Exploring Electronic Properties of Carbon Nanoflake-Based Materials for Charge Transport Layers in Perovskite Solar Cells: Insight from Solid-state Modelling, 第71回応用物理学会春季学術講演会, Mar. 2024.
• Li Ruicheng, Hasegawa Kei, Manzhos Sergei, Ihara Manabu, Waki Keiko. Investigating the Structural Change of PbI2-rich Perovskite Solar Cells After Storage, 化学工学会第87年会, Mar. 2022.

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