Adsorption and Activation of Methane on the (110) Surface of Rutile-type Metal Dioxides von Tsuji, Yuta, Yoshizawa, Kazunari

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Influence of long-range interactions on quantum interference in molecular conduction. A tight-binding (Hückel) approach von Tsuji, Yuta, Estrada, Ernesto

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Competition between Hydrogen Bonding and Dispersion Force in Water Adsorption and Epoxy Adhesion to Boron Nitride: From the Flat to the Curved von Tsuji, Yuta, Yoshizawa, Kazunari

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Frontier Orbital Perspective for Quantum Interference in Alternant and Nonalternant Hydrocarbons von Tsuji, Yuta, Yoshizawa, Kazunari

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Theoretical Study on the Contribution of Interfacial Functional Groups to the Adhesive Interaction between Epoxy Resins and Aluminum Surfaces von Nakamura, Shin, Yamamoto, Satoru, Tsuji, Yuta, Tanaka, Keiji, Yoshizawa, Kazunari

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Methane Activation at the Metal–Support Interface of Ni4–CeO2(111) Catalyst: A Theoretical Study von Singha, Rajib Kumar, Tsuji, Yuta, Mahyuddin, Muhammad Haris, Yoshizawa, Kazunari

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Molecular Dynamics Study on the Thermal Aspects of the Effect of Water Molecules at the Adhesive Interface on an Adhesive Structure von Nakamura, Shin, Tsuji, Yuta, Yoshizawa, Kazunari

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Quantum interference in polyenes von Tsuji, Yuta, Hoffmann, Roald, Movassagh, Ramis, Datta, Supriyo

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The Influence of Linkers on Quantum Interference: A Linker Theorem von Tsuji, Yuta, Stuyver, Thijs, Gunasekaran, Suman, Venkataraman, Latha

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Understanding Single-Molecule Parallel Circuits on the Basis of Frontier Orbital Theory von Okazawa, Kazuki, Tsuji, Yuta, Yoshizawa, Kazunari

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Lithium-Richest Phase of Lithium Tetrelides Li17Tt4 (Tt = Si, Ge, Sn, and Pb) as an Electride von Tsuji, Yuta, Hashimoto, Wataru, Yoshizawa, Kazunari

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Close relation between quantum interference in molecular conductance and diradical existence von Tsuji, Yuta, Hoffmann, Roald, Strange, Mikkel, Solomon, Gemma C.

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Helical Oligoenes: Conformations, Bond Alternation, and Competing Through-Bond and Through-Space Transmission von Tsuji, Yuta, Hoffmann, Roald

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Theoretical Study on the Electronic Structure of Heavy Alkali-Metal Suboxides von Tsuji, Yuta, Hori, Mikiya, Yoshizawa, Kazunari

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Concepts of Computational Approach to Explore Heterogeneous Catalysts for Direct Methane Conversion von Tsuji, Yuta, Yoshida, Masataka, Yoshizawa, Kazunari, Kamachi, Takashi

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The Green’s function for the Hückel (tight binding) model von Movassagh, Ramis, Strang, Gilbert, Tsuji, Yuta, Hoffmann, Roald

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Role of Edge Oxygen Atoms on the Adhesive Interaction between Carbon Fiber and Epoxy Resin von Semoto, Takayuki, Tsuji, Yuta, Tanaka, Hiromasa, Yoshizawa, Kazunari

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Van der Waals interactions between nonpolar alkyl chains and polar oxide surfaces prevent catalyst deactivation in aldehyde gas sensing von Nakamura, Kentaro, Takahashi, Tsunaki, Hosomi, Takuro, Tanaka, Wataru, Yamaguchi, Yu, Liu, Jiangyang, Kanai, Masaki, Tsuji, Yuta, Yanagida, Takeshi

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Supra-ceramics: a molecule-driven frontier of inorganic materials von Maeda, Kazuhiko, Motohashi, Teruki, Ohtani, Ryo, Sugimoto, Kunihisa, Tsuji, Yuta, Kuwabara, Akihide, Horike, Satoshi

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Elucidation of Adhesive Interaction between the Epoxy Molding Compound and Cu Lead Frames von Tsurumi, Naoaki, Tsuji, Yuta, Masago, Noriyuki, Yoshizawa, Kazunari

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