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論文・分野から探す

機構に所属する研究者の発表した論文を、タイトル・抄録・分野などから検索することができます。論文の分野はクラリベイト社のESI分類を参考に分類しています(Materials Science, Physics, Chemistry, Engineering, Biologyなど)。

最終更新日: 2025年12月17日

463件の論文が見つかりました。論文は出版年月日順に表示しています。(ヘルプ)
  • Miao Wang, Ken Sakaushi. Bridging classical concepts and modern advances in electrode processes: a tutorial review. Physical Chemistry Chemical Physics. 27 [48] (2025) 25743-25766 10.1039/d5cp03949e
  • Kousuke Nakano, Sandro Sorella, Michele Casula. Load-balanced diffusion Monte Carlo method with lattice regularization. The Journal of Chemical Physics. 163 [19] (2025) 194117 10.1063/5.0296986 Open Access
  • Flaviano Della Pia, Benjamin X. Shi, Yasmine S. Al-Hamdani, Dario Alfé, Tyler A. Anderson, Matteo Barborini, Anouar Benali, Michele Casula, Neil D. Drummond, Matúš Dubecký, Claudia Filippi, Paul R. C. Kent, Jaron T. Krogel, Pablo López Ríos, Arne Lüchow, Ye Luo, Angelos Michaelides, Lubos Mitas, Kousuke Nakano, Richard J. Needs, Manolo C. Per, Anthony Scemama, Jil Schultze, Ravindra Shinde, Emiel Slootman, Sandro Sorella, Alexandre Tkatchenko, Mike Towler, C. J. Umrigar, Lucas K. Wagner, William A. Wheeler, Haihan Zhou, Andrea Zen. Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water–methane dimer. The Journal of Chemical Physics. 163 [10] (2025) 104110 10.1063/5.0272974 Open Access
  • Yuji Higuchi, Yasuyuki Nakamura, Masanobu Naito, Yoshihisa Fujii. Influences of secondary and tertiary amines in epoxy resins on water dynamics by all-atomic molecular dynamics simulations. Chemical Physics. 597 (2025) 112766 10.1016/j.chemphys.2025.112766
  • Lok Yiu Wu, Maksymilian J. Roman, Brianna R. Heazlewood, Mitsunori Kurahashi. Steric effects in the adsorption of O2 on a Cu(111) surface. Physical Chemistry Chemical Physics. 27 [11] (2025) 5701-5709 10.1039/d4cp04595e Open Access
  • Nasrat Hannah Shudin, Ryuto Eguchi, Takeshi Fujita, Tomoharu Tokunaga, Ayako Hashimoto, Hideki Abe. Phase textures of metal–oxide nanocomposites self-orchestrated by atomic diffusions through precursor alloys. Physical Chemistry Chemical Physics. 26 [19] (2024) 14103-14107 10.1039/d3cp05157a Open Access
  • Mikio Ito, Hidenori Noguchi, Kohei Uosaki. Effect of para-substituents on NC bonding of aryl isocyanide molecules adsorbed on metal surfaces studied by sum frequency generation (SFG) spectroscopy. The Journal of Chemical Physics. 161 [20] (2024) 204703 10.1063/5.0236548 Open Access
  • Goichiro Seo, Ryoma Hayakawa, Yutaka Wakayama, Ryosuke Ohnuki, Shinya Yoshioka, Kaname Kanai. Mechanism of charge accumulation in potassium poly(heptazine imide). Physical Chemistry Chemical Physics. 26 [30] (2024) 20585-20597 10.1039/d4cp02012j Open Access
  • Yushen Wang, Hidenori Noguchi. Revealing the enhancement of Li plating/stripping efficiency in TEGDME-based low-concentration electrolytes for anode-free lithium metal batteries. Physical Chemistry Chemical Physics. 26 [39] (2024) 25352-25362 10.1039/d4cp02755h Open Access
  • Shengzhou Li, Tsuyoshi Miyazaki, Ayako Nakata. Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study. Physical Chemistry Chemical Physics. 26 [30] (2024) 20251-20260 10.1039/d4cp01094a Open Access
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