Pureに変更を加えた場合、すぐここに表示されます。

研究成果 1983 2019

記事
54 引用 (Scopus)
methane monooxygenase
Hydroxylation
Methane
Catalytic Domain
Iron
14 引用 (Scopus)

Two-step concerted mechanism for the hydrocarbon hydroxylation by cytochrome P450

Yoshizawa, K., Ohta, T., Eda, M. & Yamabe, T., 2 1 2000, : : Bulletin of the Chemical Society of Japan. 73, 2, p. 401-407 7 p.

研究成果: ジャーナルへの寄稿記事

Hydroxylation
Porphyrins
Hydrocarbons
Cytochrome P-450 Enzyme System
Carbon
79 引用 (Scopus)

Unique behaviour of dinitrogen-bridged dimolybdenum complexes bearing pincer ligand towards catalytic formation of ammonia

Tanaka, H., Arashiba, K., Kuriyama, S., Sasada, A., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., 4 28 2014, : : Nature communications. 5, 3737.

研究成果: ジャーナルへの寄稿記事

Bearings (structural)
Ammonia
ammonia
Molybdenum
Ligands
2 引用 (Scopus)
self consistent fields
Crystals
Fermi level
forbidden bands
orbitals
12 引用 (Scopus)

Unsymmetrical pnp-pincer type phosphaalkene ligands protected by a fused-ring bulky eind group: Synthesis and applications to rh(i) and ir(i) complexes

Taguchi, H. O., Sasaki, D., Takeuchi, K., Tsujimoto, S., Matsuo, T., Tanaka, H., Yoshizawa, K. & Ozawa, F., 5 23 2016, : : Organometallics. 35, 10, p. 1526-1533 8 p.

研究成果: ジャーナルへの寄稿記事

pyridines
Ligands
ligands
rings
synthesis
32 引用 (Scopus)

Vibronic coupling and Jahn-Teller effect in negatively charged benzene and [18]annulene

Yoshizawa, K., Kato, T. & Yamabe, T., 5 8 1998, : : Journal of Chemical Physics. 108, 18, p. 7637-7644 8 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
Benzene
benzene
Stretching
vibration mode
7 引用 (Scopus)

Vibronic coupling and Jahn-Teller effects in negatively charged [30]annulene

Kato, T., Yoshizawa, K. & Yamabe, T., 9 1 1999, : : Chemical Physics. 247, 3, p. 375-386 12 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
Benzene
vibration mode
benzene
Vibrational spectra
15 引用 (Scopus)

Vibronic coupling and jahn-teller effects in negatively charged corannulene

Yamabe, T., Yahara, K., Kato, T. & Yoshizawa, K., 1 27 2000, : : Journal of Physical Chemistry A. 104, 3, p. 589-595 7 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
Anions
electronics
anions
Superconductivity
2 引用 (Scopus)

Vibronic interaction in a copper oxide cluster

Kato, T., Kondo, M., Tachibana, M., Yamabe, T. & Yoshizawa, K., 9 1 2001, : : Chemical Physics. 271, 1-2, p. 31-39 9 p.

研究成果: ジャーナルへの寄稿記事

Copper oxides
copper oxides
Diamond
Superconducting materials
Copper
10 引用 (Scopus)

Vibronic interaction in metalloporphyrin π-anion radicals

Yoshizawa, K., Nakayama, T., Kamachi, T. & Kozlowski, P. M., 2 8 2007, : : Journal of Physical Chemistry A. 111, 5, p. 852-857 6 p.

研究成果: ジャーナルへの寄稿記事

Metalloporphyrins
Anions
anions
Jahn-Teller effect
electronics
4 引用 (Scopus)

Vibronic interactions and Jahn-Teller effects in π-conjugated systems

Kato, T., Yoshizawa, K. & Yamabe, T., 3 15 2001, : : Synthetic Metals. 119, 1-3, p. 217-218 2 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
Benzene
benzene
interactions
Electronic properties
3 引用 (Scopus)

Vibronic interactions in {6} and {18}hetero(A,B)annulenes

Tachibana, M. & Yoshizawa, K., 10 15 2000, : : Chemical Physics. 260, 3, p. 303-315 13 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
Molecular orbitals
vibration mode
molecular orbitals
electronics
15 引用 (Scopus)

Vibronic interactions in silicon polyhedra of the Si46 clathrate compound

Yoshizawa, K., Kato, T., Tachibana, M. & Yamabe, T., 12 3 1998, : : Journal of Physical Chemistry A. 102, 49, p. 10113-10119 7 p.

研究成果: ジャーナルへの寄稿記事

Jahn-Teller effect
clathrates
Silicon
polyhedrons
Superconductivity
5 引用 (Scopus)

Vibronic interactions in the C36 tri- and tetra-anions

Yoshizawa, K., Tachibana, M. & Yamabe, T., 12 8 1999, : : Journal of Chemical Physics. 111, 22, p. 10088-10092 5 p.

研究成果: ジャーナルへの寄稿記事

Anions
anions
Molecular orbitals
Jahn-Teller effect
molecular orbitals
46 引用 (Scopus)

Water-assisted oxo mechanism for heme metabolism

Kamachi, T. & Yoshizawa, K., 8 3 2005, : : Journal of the American Chemical Society. 127, 30, p. 10686-10692 7 p.

研究成果: ジャーナルへの寄稿記事

Heme
Metabolism
Porphyrins
Heme Oxygenase (Decyclizing)
Water
18 引用 (Scopus)

Weak suppression of ferromagnetism in tetrakis(dimethylamino)ethylene-(C60)1-x(C70)x

Tanaka, K., Sato, T., Yamabe, T., Yoshizawa, K., Okahara, K. & Zakhidov, A. A., 1 1 1995, : : Physical Review B. 51, 2, p. 990-995 6 p.

研究成果: ジャーナルへの寄稿記事

ferromagnetism
ethylene
retarding
magnetization
Curie temperature
14 引用 (Scopus)

What is the identity of the metal ions in the active sites of coenzyme b12-dependent diol dehydratase? a computational mutation analysis

Kamachi, T., Takahata, M., Toraya, T. & Yoshizawa, K., 6 25 2009, : : Journal of Physical Chemistry B. 113, 25, p. 8435-8438 4 p.

研究成果: ジャーナルへの寄稿記事

Propanediol Dehydratase
coenzymes
Coenzymes
mutations
Metal ions
65 引用 (Scopus)

Wire-length dependence of the conductance of oligo(p-phenylene) dithiolate wires: A consideration from molecular orbitals

Kondo, M., Tada, T. & Yoshizawa, K., 10 21 2004, : : Journal of Physical Chemistry A. 108, 42, p. 9143-9149 7 p.

研究成果: ジャーナルへの寄稿記事

Molecular orbitals
molecular orbitals
wire
Wire
Peptide Elongation Factor G

ホスフィンスルフィドをアンカーとする単一分子接合の形成と電気伝導特性

深澤愛子, Staykov, A., 吉澤一成, 山口茂弘, 木口学, 丹下聡, 市橋泰宜, 趙強, 高橋拓也, 小西達也, 村越敬 & 辻雄太, 2009, : : 基礎有機化学討論会要旨集(基礎有機化学連合討論会予稿集). 2009, 0, p. 221-221 1 p.

研究成果: ジャーナルへの寄稿記事

phosphine
Sulfides
Anchors
Metals
Molecules

メタン活性化を目指したインフォマティクス

蒲池高志, 斎藤雅史, 辻雄太 & 吉澤一成, 2017, : : Journal of Computer Chemistry, Japan. 16, 5, p. 147-148 2 p.

研究成果: ジャーナルへの寄稿記事

Methane
Screening
Metals
Chemical activation
Catalysts
7 引用 (Scopus)
Alkenes
Computer aided manufacturing
Hydrogenation
Osmium
Carbon Monoxide
3 引用 (Scopus)

Computational approach to nitrogen fixation on molybdenum–dinitrogen complexes

Tanaka, H. & Yoshizawa, K., 1 1 2017, Topics in Organometallic Chemistry. Springer Verlag, p. 171-196 26 p. (Topics in Organometallic Chemistry; 巻数 60).

研究成果: 著書/レポートタイプへの貢献

Nitrogen fixation
Bearings (structural)
Reaction intermediates
Coordination Complexes
Metal complexes
2 引用 (Scopus)

Methane Hydroxylation by First Row Transition Metal Oxides

Yoshizawa, K., 4 1 2008, Computational Modeling for Homogeneous and Enzymatic Catalysis: A Knowledge-Base for Designing Efficient Catalysts. Wiley - VCH Verlag GmbH & CO. KGaA, p. 317-335 19 p.

研究成果: 著書/レポートタイプへの貢献

Hydroxylation
Methane
Oxides
Transition metals
Metals
4 引用 (Scopus)

Theoretical Aspects of Dioxygen Activation in Dicopper Enzymes

Yoshizawa, K., 8 11 2011, Copper-Oxygen Chemistry. John Wiley and Sons, p. 197-224 28 p.

研究成果: 著書/レポートタイプへの貢献

Chemical activation
Oxygen
Enzymes
評論記事
1 引用 (Scopus)

Cooperation between enzyme science and theoretical chemistry for a new paradigm in enzyme research

Toraya, T., Kamachi, T. & Yoshizawa, K., 2008, : : Seikagaku. The Journal of Japanese Biochemical Society. 80, 2, p. 132-138 7 p.

研究成果: ジャーナルへの寄稿評論記事

Protein Conformation
Amino Acid Sequence
Theoretical Models
Binding Sites
Enzymes
3 引用 (Scopus)

Intermediate-Spin Iron(III) Complexes Having a Redox-Noninnocent Macrocyclic Tetraamido Ligand

Kojima, T., Ogishima, F., Nishibu, T., Kotani, H., Ishizuka, T., Okajima, T., Nozawa, S., Shiota, Y., Yoshizawa, K., Ohtsu, H., Kawano, M., Shiga, T. & Oshio, H., 8 20 2018, : : Inorganic Chemistry. 57, 16, p. 9683-9695 13 p.

研究成果: ジャーナルへの寄稿評論記事

Iron
Ligands
iron
ligands
methylidyne
20 引用 (Scopus)

Mechanistic aspects in the direct synthesis of hydrogen peroxide on PdAu catalyst from first principles

Li, J. & Yoshizawa, K., 6 15 2015, : : Catalysis Today. 248, p. 142-148 7 p.

研究成果: ジャーナルへの寄稿評論記事

Hydrogen peroxide
Hydrogen Peroxide
Catalysts
Catalyst selectivity
Catalyst activity
4 引用 (Scopus)

Methane selective oxidation to methanol by metal-exchanged zeolites: A review of active sites and their reactivity

Mahyuddin, M. H., Shiota, Y. & Yoshizawa, K., 1 1 2019, : : Catalysis Science and Technology. 9, 8, p. 1744-1768 25 p.

研究成果: ジャーナルへの寄稿評論記事

Zeolites
Hydroxylation
Methane
Methanol
Metals
17 引用 (Scopus)

Molecular design of electron transport with orbital rule: Toward conductance-decay free molecular junctions

Tada, T. & Yoshizawa, K., 2015, : : Physical Chemistry Chemical Physics. 17, 48, p. 32099-32110 12 p.

研究成果: ジャーナルへの寄稿評論記事

Benzene
orbitals
decay
electrons
Electron Transport
13 引用 (Scopus)

Quantum-size effects in capped and uncapped carbon nanotubes

Yumura, T., Nozaki, D., Hirahara, K., Bandow, S., Iijima, S. & Yoshizawa, K., 8 14 2006, : : Annual Reports on the Progress of Chemistry - Section C. 102, 1, p. 71-91 21 p.

研究成果: ジャーナルへの寄稿評論記事

Carbon Nanotubes
Nanotubes
Polyenes
Fullerenes
Discrete Fourier transforms
7 引用 (Scopus)
Stereochemistry
Platinum
Nickel
Transition metals
Unsaturated compounds
13 引用 (Scopus)

Theoretical Overview of Methane Hydroxylation by Copper-Oxygen Species in Enzymatic and Zeolitic Catalysts

Mahyuddin, M. H., Shiota, Y., Staykov, A. T. & Yoshizawa, K., 10 16 2018, : : Accounts of Chemical Research. 51, 10, p. 2382-2390 9 p.

研究成果: ジャーナルへの寄稿評論記事

Hydroxylation
methane monooxygenase
Methane
Copper
Zeolites
60 引用 (Scopus)
methane monooxygenase
Hydroxylation
Alkanes
Methane
Catalytic Domain
編集

Special issue: Seventh congress of the international society for theoretical chemical physics

Nakai, H., Yoshizawa, K., Ando, K., Nakajima, T. & Brändas, E. J., 2 5 2013, : : International Journal of Quantum Chemistry. 113, 3, p. 171-172 2 p.

研究成果: ジャーナルへの寄稿編集