Takashi Nakamura, Masamune Kuwabara, Haoyang Zhang, Kazuki Okazawa, Mauro Boero, Yasuteru Shigeta, Tatsuya Nabeshima,
"Pseudo [3] Rotaxane and [3] Rotaxane of Per (5-carboxy-5-dehydroxymethyl)-Cyclodextrins Utilizing Carboxylic Acid Dimer as Recognition Units"
J. Org. Chem. 90 (10), 3603-3609 (2025). URL
Yuta Tsuji, Kazuki Okazawa, Toshinobu Tatsumi, Kazunari Yoshizawa,
"σ Interference: Through-Space and Through-Bond Dichotomy",
J. Am. Chem. Soc. 146 (47), 32506-32518 (2024). URL
Amit Shrestha, Yosuke Sumiya, Kazuki Okazawa, Yuta Tsuji, Kazunari Yoshizawa,
"Adhesion Mechanism between Epoxy Resins Cured with 4,4′-Diaminodiphenyl Sulfone and 4,4′-Diaminodiphenylmethane and Carboxyl Functionalized Carbon Fiber",
Langmuir, 39 (15), 3948-3960 (2024). URL
Kohei Kikkawa, Yosuke Sumiya, Kazuki Okazawa, Kazunari Yoshizawa, Yoshimitsu Itoh, Takuzo Aida,
"Thiourea as a “Polar Hydrophobic” Hydrogen-Bonding Motif: Application to Highly Durable All-Underwater Adhesion",
J. Am. Chem. Soc. 146 (30), 21168-21175 (2024). URL
Yuta Tsuji, Kazuki Okazawa, Kazunari Yoshizawa,
"Hückel Molecular Orbital Analysis for Stability and Instability of Stacked Aromatic and Stacked Antiaromatic Systems",
J. Org. Chem. 88 (21), 14887-14898 (2023). URL
Taiki Imagawa, Kazuki Okazawa, Kazunari Yoshizawa, Hiroto Yoshida, Rong Shang, Yohsuke Yamamoto, Masaaki Nakamoto,
"Complexation-Triggered Fluctuation of π-Conjugation on an Antiaromatic Dicyanoanthracene Dianion",
Chem. Eur. J. 29 (70), e202302550 (2023). URL
Yuta Tsuji, Yuta Yoshioka, Kazuki Okazawa, Kazunari Yoshizawa,
"Exploring Metal Nanocluster Catalysis for Ammonia Synthesis Using Informatics Methods: A Concerted Effort of Bayesian Optimization, Swarm Intelligence, and First-Principles Computation",
ACS Omega, 8 (33), 30335-30348 (2023). URL
Kazuki Okazawa, Yuta Tsuji, Kazunari Yoshizawa,
"Frontier Orbital Views of Stacked Aromaticity",
J. Phys. Chem. A, 127 (22), 4780-4786 (2023). URL
Amit Shrestha, Yosuke Sumiya, Kazuki Okazawa, Takahiro Uwabe, Kazunari Yoshizawa,
"Molecular Understanding of Adhesion of Epoxy Resion to Graphene and Graphene Oxide Surfaces in Terms of Orbital Interactions",
Langmuir, 39 (15), 5514-5526 (2023). URL
Nagy L. Torad, Yuta Tsuji, Azhar Alowasheeir, Masako Momotake, Kazuki Okazawa, Kazunari Yoshizawa, Michio Matsumoto, Masafumi Yamato, Yusuke Yamauchi, Miharu Eguchi,
"Extraordinary Acceleration of an Electrophilic Reaction Driven by the Polar Surface of 2D Aluminosilicate Nanosheets",
Small, 19 (11), 2205857 (2023). URL
Nikolay Cherkasov, Shunsaku Asano, Yuta Tsuji, Kazuki Okazawa, Kazunari Yoshizawa, Hiroyuki Miyamura, Jun-ichiro Hayashi, Alexander A. Kunitsa, S. David Jackson,
"Mechanistic origins of accelerated hydrogenation of mixed alkylaromatics by synchronised adsorption over Rh/SiO2",
React. Chem. Eng. 8, 1341-1348 (2023). URL
Kazuki Okazawa, Yuta Tsuji, Keita Kurino, Masataka Yoshida, Yoshifumi Amamoto, Kazunari Yoshizawa,
"Exploring the Optimal Alloy for Nitrogen Activation by Combining Bayesian Optimization with Density Functional Theory Calculations",
ACS Omega, 7 (49), 45403-45408 (2022). URL
Kazuki Okazawa, Yuta Tsuji, Kazunari Yoshizawa,
"Graph-theoretical exploration of the relation between conductivity and connectivity in heteroatom-containing single-molecule junctions",
J. Chem. Phys. 156, 091102 (2022). URL
Yuta Tsuji, Kazuki Okazawa, Keita Kurino, Kazunari Yoshizawa,
"Topology Dictates Magnetic and Conductive Properties of a π-Stacked System: Insight into Possible Coexistence of Magnetic and Conductive Systems"
J. Phys. Chem. C, 126 (6), 3244-3256 (2022). URL
Yuta Tsuji, Kazuki Okazawa, Yoji Kobayashi, Hiroshi Kageyama, Kazunari Yoshizawa,
"Electronic Origin of Catalytic Activity of TiH2 for Ammonia Synthesis"
J. Phys.Chem. C, 125 (7), 3948-3960 (2021). URL
Yuta Tsuji, Kazuki Okazawa, Bo Chen, Kazunari Yoshizawa, "Mechanical Control of Molecular Conductance and Diradical Character in Bond Stretching and π-Stack Compression",
J. Phys. Chem. C, 124 (42), 22941-22958 (2020). URL
Masato Kondoh, Chinatsu Takizawa, Kazuki Okazawa, Dai Akase, Misako Aida, Taka-aki Ishibashi,
"Time-resolved infrared study of photo-induced ring-closure reaction of trans-2-hydroxychalcone",
J. Photochem. Photobiol. A, 389 (15), 112280 (2020). URL
Kazuki Okazawa, Yuta Tsuji, Kazunari Yoshizawa,
"Understanding Single-Molecule Parallel Circuits on the Basis of Frontier Orbital Theory",
J. Phys. Chem. C, 124 (5), 3322-3331 (2020). URL
Masato Kondoh, Akira Sakuta, Kazuki Okazawa, Dai Akase, Misako Aida, Taka-aki Ishibashi,
"Photo-Induced Ring-Opening Reaction of Flav-3-en-2-ol Monitored by Time-Resolved Infrared Spectroscopy",
J. Phys. Chem. B, 123 (40), 8499-8504 (2019). URL
岡澤 一樹, 辻 雄太, 吉澤 一成, "積層芳香族性を有する π スタック単分子接合の伝導特性に関する理論的研究", J. Comput. Chem. Jpn. 21 (4), 87-89 (2022). URL
岡澤 一樹, 辻 雄太, 吉澤 一成, "ヘテロ原子を含んだ単分子接合の導電性に関するグラフ理論的研究", J. Comput. Chem. Jpn. 19 (4), 158-160 (2020). URL
岡澤 一樹, 辻 雄太, 吉澤 一成, "芳香族単分子並列回路の電気伝導度とフロンティア軌道の関係", J. Comput. Chem. Jpn. 18 (5), 227-229 (2019). URL