| 532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） | |
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| 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 | |
| Tabee Jan, Shabnam Raheem, Aamir Hanif, Gaulthier Rydzek, G. M. Peerzada, Katsuhiko Ariga, Jin Shang, Masood Ahmad Rizvi. Adsorptive avidity of Prussian blue polypyrrole nanocomposite for elimination of water contaminants: a case study of malachite green and isoniazid. Physical Chemistry Chemical Physics. 26 [23] (2024) 16802-16820 10.1039/d4cp01053a Open Access | |
| Atsushi Togo, Atsuto Seko. On-the-fly training of polynomial machine learning potentials in computing lattice thermal conductivity. The Journal of Chemical Physics. 160 [21] (2024) 211001 10.1063/5.0211296 Open Access | |
| Aaditya Manjanath, Ryoji Sahara, Kaoru Ohno, Yoshiyuki Kawazoe. Non-adiabatic excited-state time-dependent GW molecular dynamics (TDGW) satisfying extended Koopmans’ theorem: An accurate description of methane photolysis. The Journal of Chemical Physics. 160 [18] (2024) 184102 10.1063/5.0202590 Open Access | |
| Aleksandra Khanina, Andrei Novitskii, Daria Pashkova, Andrei Voronin, Takao Mori, Vladimir Khovaylo. Thermoelectric properties of Bi1−xPbxCu1−xSeO oxyselenides. Physical Chemistry Chemical Physics. 26 [17] (2024) 13006-13011 10.1039/d4cp00308j Open Access | |
| Yanan Gao, Hitoshi Asahina, Shoichi Matsuda, Hidenori Noguchi, Kohei Uosaki. Nature of Li2O2 and its relationship to the mechanisms of discharge/charge reactions of lithium–oxygen batteries. Physical Chemistry Chemical Physics. 26 [18] (2024) 13655-13666 10.1039/d4cp00428k Open Access | |
| Katsuhiko Ariga, Jingwen Song, Kohsaku Kawakami. Molecular machines working at interfaces: physics, chemistry, evolution and nanoarchitectonics. Physical Chemistry Chemical Physics. 26 [18] (2024) 13532-13560 10.1039/d4cp00724g Open Access | |
