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2019
1 Citation (Scopus)

Adhesion of epoxy resin with hexagonal boron nitride and graphite

Tsuji, Y., Kitamura, Y., Someya, M., Takano, T., Yaginuma, M., Nakanishi, K. & Yoshizawa, K., Mar 1 2019, In : ACS Omega. 4, 3, p. 4491-4504 14 p.

Research output: Contribution to journalArticle

Epoxy Resins
Graphite
Boron nitride
Epoxy resins
Adhesion

An azulene-based chiral helicene and its air-stable cation radical

Narita, M., Teraoka, T., Murafuji, T., Shiota, Y., Yoshizawa, K., Mori, S., Uno, H., Kanegawa, S., Sato, O., Goto, K. & Tani, F., Jan 1 2019, In : Bulletin of the Chemical Society of Japan. 92, 11, p. 1867-1873 7 p.

Research output: Contribution to journalArticle

Open Access
Cations
Paramagnetic resonance
Air
Oxidation
Enantiomers

A study of adhesion interface about die bonding structure with conductive silver paste

Tsurumi, N., Masago, N., Baba, T., Murata, H., Tsuji, Y. & Yoshizawa, K., Jan 4 2019, 2018 IEEE CPMT Symposium Japan, ICSJ 2018. Institute of Electrical and Electronics Engineers Inc., p. 45-48 4 p. 8602784. (2018 IEEE CPMT Symposium Japan, ICSJ 2018).

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Adhesive pastes
Ointments
Silver
adhesion
Adhesion
3 Citations (Scopus)

Catalytic Reactivity of Molybdenum–Trihalide Complexes Bearing PCP-Type Pincer Ligands

Eizawa, A., Arashiba, K., Egi, A., Tanaka, H., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., Jun 14 2019, In : Chemistry - An Asian Journal. 14, 12, p. 2091-2096 6 p.

Research output: Contribution to journalArticle

Bearings (structural)
Ligands
Molybdenum
Ammonia
Catalysts

Computational Studies on the Thermodynamic and Kinetic Parameters of Oxidation of 2-Methoxyethanol Biofuel via H-Atom Abstraction by Methyl Radical

Abdel-Rahman, M. A., El-Gogary, T. M., Al-Hashimi, N., Shibl, M. F., Yoshizawa, K. & El-Nahas, A. M., Dec 1 2019, In : Scientific reports. 9, 1, 15361.

Research output: Contribution to journalArticle

Open Access
Biofuels
Thermodynamics
1-Butanol
methyl radical
methyl cellosolve
5 Citations (Scopus)

Cupric-superoxide complex that induces a catalytic aldol reaction-type C–C bond formation

Abe, T., Hori, Y., Shiota, Y., Ohta, T., Morimoto, Y., Sugimoto, H., Ogura, T., Yoshizawa, K. & Itoh, S., Dec 1 2019, In : Communications Chemistry. 2, 1, 12.

Research output: Contribution to journalArticle

Open Access
Superoxides
carbonyl compound
Carbonyl compounds
transition element
copper

Dual Catalytic Cycle of H2 and H2O Oxidations by a Half-Sandwich Iridium Complex: A Theoretical Study

Ikeda, K., Hori, Y., Mahyuddin, M. H., Shiota, Y., Staykov, A. T., Matsumoto, T., Yoshizawa, K. & Ogo, S., Jun 3 2019, In : Inorganic Chemistry. 58, 11, p. 7274-7284 11 p.

Research output: Contribution to journalArticle

Iridium
iridium
Oxidation
oxidation
cycles

Electronic transport investigation of redox-switching of azulenequinones/hydroquinones: Via first-principles studies

Haidar, E. A., Tawfik, S. A., Stampfl, C., Hirao, K., Yoshizawa, K., El-Demerdash, S. H., Nakajima, T. & El-Nahas, A. M., Jan 1 2019, In : Physical Chemistry Chemical Physics. 21, 32, p. 17859-17867 9 p.

Research output: Contribution to journalArticle

Hydroquinones
azulene
electronics
Oxidation
oxidation

Esterification of Tertiary Amides by Alcohols Through C−N Bond Cleavage over CeO2

Toyao, T., Nurnobi Rashed, M., Morita, Y., Kamachi, T., Hakim Siddiki, S. M. A., Ali, M. A., Touchy, A. S., Kon, K., Maeno, Z., Yoshizawa, K. & Shimizu, K. I., Jan 9 2019, In : ChemCatChem. 11, 1, 1 p.

Research output: Contribution to journalComment/debate

Esterification
Amides
amides
cleavage
alcohols
4 Citations (Scopus)

Esterification of Tertiary Amides by Alcohols Through C−N Bond Cleavage over CeO2

Toyao, T., Nurnobi Rashed, M., Morita, Y., Kamachi, T., Hakim Siddiki, S. M. A., Ali, M. A., Touchy, A. S., Kon, K., Maeno, Z., Yoshizawa, K. & Shimizu, K. I., Jan 9 2019, In : ChemCatChem. 11, 1, p. 449-456 8 p.

Research output: Contribution to journalArticle

Arrhenius plots
Energy barriers
Esterification
Temperature programmed desorption
Amides

Formation of a Ruthenium(V) - Imido Complex and the Reactivity in Substrate Oxidation in Water through the Nitrogen Non-Rebound Mechanism

Ishizuka, T., Kogawa, T., Makino, M., Shiota, Y., Ohara, K., Kotani, H., Nozawa, S., Adachi, S. I., Yamaguchi, K., Yoshizawa, K. & Kojima, T., Oct 7 2019, In : Inorganic chemistry. 58, 19, p. 12815-12824 10 p.

Research output: Contribution to journalArticle

Ruthenium
ruthenium
Nitrogen
reactivity
nitrogen

Fundamental electron-transfer and proton-coupled electron-transfer properties of Ru(iv)-oxo complexes

Kotani, H., Shimomura, H., Horimoto, M., Ishizuka, T., Shiota, Y., Yoshizawa, K., Yanagisawa, S., Kawahara-Nakagawa, Y., Kubo, M. & Kojima, T., Jan 1 2019, In : Dalton Transactions. 48, 35, p. 13154-13161 8 p.

Research output: Contribution to journalArticle

Protons
Electrons
Discrete Fourier transforms
Oxidation

Giant anisotropic thermal expansion actuated by thermodynamically assisted reorientation of imidazoliums in a single crystal

Yao, Z. S., Guan, H., Shiota, Y., He, C. T., Wang, X. L., Wu, S. Q., Zheng, X., Su, S. Q., Yoshizawa, K., Kong, X., Sato, O. & Tao, J., Dec 1 2019, In : Nature communications. 10, 1, 4805.

Research output: Contribution to journalArticle

Open Access
retraining
Thermal expansion
thermal expansion
Hot Temperature
Single crystals
2 Citations (Scopus)

High-temperature cooperative spin crossover transitions and single-crystal reflection spectra of [Fe III (qsal) 2 ](CH 3 OSO 3 ) and related compounds

Takahashi, K., Yamamoto, K., Yamamoto, T., Einaga, Y., Shiota, Y., Yoshizawa, K. & Mori, H., Jan 1 2019, In : Crystals. 9, 2, 81.

Research output: Contribution to journalArticle

Open Access
OSO-3
Optical conductivity
crossovers
Crystal structure
Single crystals

Iron complex of a quadruply fused porphyrin: Synthesis, structure and redox properties

Ishizuka, T., Komamura, K., Saegusa, Y., Tanaka, S., Shiota, Y., Yoshizawa, K. & Kojima, T., Jan 1 2019, (Accepted/In press) In : Journal of Porphyrins and Phthalocyanines.

Research output: Contribution to journalArticle

Porphyrins
Iron
Ligands
Oxidation
Electrolysis

Lithium-richest phase of lithium tetrelides Li17TT4 (TT = Si, Ge, Sn, and Pb) as an electride

Tsuji, Y., Hashimoto, W. & Yoshizawa, K., Jan 1 2019, In : Bulletin of the Chemical Society of Japan. 92, 7, p. 1154-1169 16 p.

Research output: Contribution to journalArticle

Lithium
Carrier concentration
Electrons
Atoms
Stoichiometry

Local structures and electronic properties of In atoms in In-doped ZnO

Hori, Y., Shiota, Y., Ida, T., Yoshizawa, K. & Mizuno, M., Sep 1 2019, In : Thin Solid Films. 685, p. 428-433 6 p.

Research output: Contribution to journalArticle

Zinc Oxide
Indium
Zinc oxide
Electronic properties
zinc oxides
Molecular oxygen
Methane
Oxidation
Hydroxylation
Isomerization

Methane Activation at the Metal-Support Interface of Ni 4 -CeO 2 (111) Catalyst: A Theoretical Study

Singha, R. K., Tsuji, Y., Mahyuddin, M. H. & Yoshizawa, K., Apr 18 2019, In : Journal of Physical Chemistry C. 123, 15, p. 9788-9798 11 p.

Research output: Contribution to journalArticle

Methane
methane
Metals
Chemical activation
routes
5 Citations (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., Jan 1 2019, In : Catalysis Science and Technology. 9, 8, p. 1744-1768 25 p.

Research output: Contribution to journalReview article

Zeolites
Hydroxylation
Methane
Methanol
Metals
3 Citations (Scopus)

Molecular understanding of the adhesive interactions between silica surface and epoxy resin: Effects of interfacial water

Higuchi, C., Tanaka, H. & Yoshizawa, K., Jan 5 2019, In : Journal of Computational Chemistry. 40, 1, p. 164-171 8 p.

Research output: Contribution to journalArticle

Epoxy Resins
Epoxy Resin
Adhesives
Adhesion
Silica
2 Citations (Scopus)

Molybdenum-Catalyzed Ammonia Formation Using Simple Monodentate and Bidentate Phosphines as Auxiliary Ligands

Ashida, Y., Arashiba, K., Tanaka, H., Egi, A., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., Jul 15 2019, In : Inorganic chemistry. 58, 14, p. 8927-8932 6 p.

Research output: Contribution to journalArticle

Phosphines
Molybdenum
Ammonia
phosphines
molybdenum

Observation of Proton Transfer Coupled Spin Transition and Trapping of Photoinduced Metastable Proton Transfer State in an Fe(II) Complex

Nakanishi, T., Hori, Y., Sato, H., Wu, S. Q., Okazawa, A., Kojima, N., Yamamoto, T., Einaga, Y., Hayami, S., Horie, Y., Okajima, H., Sakamoto, A., Shiota, Y., Yoshizawa, K. & Sato, O., Sep 11 2019, In : Journal of the American Chemical Society. 141, 36, p. 14384-14393 10 p.

Research output: Contribution to journalArticle

Spin Trapping
Proton transfer
Protons
Observation
Hydrazones

Real-space observation of far- and near-field-induced photolysis of molecular oxygen on an Ag(110) surface by visible light

Lin, C., Ikeda, K., Shiota, Y., Yoshizawa, K. & Kumagai, T., Oct 14 2019, In : Journal of Chemical Physics. 151, 14, 144705.

Research output: Contribution to journalArticle

Molecular oxygen
Photolysis
photolysis
far fields
near fields

Redox behaviour of the β-dihydroporphycene cobalt complex: study on the effect of hydrogenation of the ligand

Hashimoto, K., Koide, T., Okawara, T., Shimakoshi, H., Hori, Y., Shiota, Y., Yoshizawa, K. & Hisaeda, Y., Jan 1 2019, In : Dalton Transactions. 48, 3, p. 872-881 10 p.

Research output: Contribution to journalArticle

Cobalt
Hydrogenation
Ligands
Anions
Electrons

Role of Amino Acid Residues for Dioxygen Activation in the Second Coordination Sphere of the Dicopper Site of pMMO

Miyanishi, M., Abe, T., Hori, Y., Shiota, Y. & Yoshizawa, K., Sep 16 2019, In : Inorganic chemistry. 58, 18, p. 12280-12288 9 p.

Research output: Contribution to journalArticle

tyrosine
amino acids
Protons
Chemical activation
glutamates
1 Citation (Scopus)

Synthesis and Catalytic Reactivity of Bis(molybdenum-trihalide) Complexes Bridged by Ferrocene Skeleton toward Catalytic Nitrogen Fixation

Itabashi, T., Arashiba, K., Tanaka, H., Konomi, A., Eizawa, A., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., Jul 22 2019, In : Organometallics. 38, 14, p. 2863-2872 10 p.

Research output: Contribution to journalArticle

Nitrogen fixation
nitrogenation
Molybdenum
musculoskeletal system
molybdenum

Thermochemistry and Kinetics of the Thermal Degradation of 2-Methoxyethanol as Possible Biofuel Additives

Abdel-Rahman, M. A., Al-Hashimi, N., Shibl, M. F., Yoshizawa, K. & El-Nahas, A. M., Dec 1 2019, In : Scientific reports. 9, 1, 4535.

Research output: Contribution to journalArticle

Open Access
Biofuels
Hot Temperature
Alcohols
Renewable Energy
Temperature

Visible light-driven cross-coupling reactions of alkyl halides with phenylacetylene derivatives for C(sp3)-C(sp) bond formation catalyzed by a B12 complex

Chen, L., Kametani, Y., Imamura, K., Abe, T., Shiota, Y., Yoshizawa, K., Hisaeda, Y. & Shimakoshi, H., Jan 1 2019, In : Chemical Communications. 55, 87, p. 13070-13073 4 p.

Research output: Contribution to journalArticle

Photocatalysts
Derivatives
Vitamin B 12
Catalysts
Temperature
2018
10 Citations (Scopus)

Adsorption and Activation of Methane on the (110) Surface of Rutile-type Metal Dioxides

Tsuji, Y. & Yoshizawa, K., Jul 12 2018, In : Journal of Physical Chemistry C. 122, 27, p. 15359-15381 23 p.

Research output: Contribution to journalArticle

Methane
dioxides
rutile
methane
Metals
4 Citations (Scopus)

Aerobic oxidation of alkanes on icosahedron gold nanoparticle Au55

Staykov, A. T., Miwa, T. & Yoshizawa, K., Aug 1 2018, In : Journal of Catalysis. 364, p. 141-153 13 p.

Research output: Contribution to journalArticle

Alkanes
Gold
Paraffins
alkanes
Hydroxylation
7 Citations (Scopus)

Catalytic Performance of a Dicopper-Oxo Complex for Methane Hydroxylation

Hori, Y., Shiota, Y., Tsuji, T., Kodera, M. & Yoshizawa, K., Jan 2 2018, In : Inorganic chemistry. 57, 1, p. 8-11 4 p.

Research output: Contribution to journalArticle

Hydroxylation
Methane
methane
Chemical activation
methane monooxygenase
25 Citations (Scopus)

Catalytic Reduction of Molecular Dinitrogen to Ammonia and Hydrazine Using Vanadium Complexes

Sekiguchi, Y., Arashiba, K., Tanaka, H., Eizawa, A., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., Jul 16 2018, In : Angewandte Chemie - International Edition. 57, 29, p. 9064-9068 5 p.

Research output: Contribution to journalArticle

hydrazine
Vanadium
Hydrazine
Ammonia
Bearings (structural)
5 Citations (Scopus)

Cobalt-Carbon Bond Formation Reaction via Ligand Reduction of Porphycene-Cobalt(II) Complex and Its Noninnocent Reactivity

Koide, T., Aritome, I., Saeki, T., Morita, Y., Shiota, Y., Yoshizawa, K., Shimakoshi, H. & Hisaeda, Y., Jan 1 2018, In : ACS Omega. 3, 4, p. 4027-4034 8 p.

Research output: Contribution to journalArticle

Cobalt
Carbon
Ligands
Metals
porphycene
4 Citations (Scopus)

Combined theoretical and experimental study on alcoholysis of amides on CeO2 surface: A catalytic interplay between Lewis acid and base sites

Kamachi, T., Siddiki, S. M. A. H., Morita, Y., Rashed, M. N., Kon, K., Toyao, T., Shimizu, K. I. & Yoshizawa, K., Apr 1 2018, In : Catalysis Today. 303, p. 256-262 7 p.

Research output: Contribution to journalArticle

Lewis Bases
Lewis Acids
Amides
Catalysts
Acids
5 Citations (Scopus)

Contribution of Coulomb Interactions to a Two-Step Crystal Structure Phase Transformation Coupled with a Significant Change in Spin Crossover Behavior for a Series of Charged FeII Complexes from 2,6-Bis(2-methylthiazol-4-yl)pyridine

Takahashi, K., Okai, M., Mochida, T., Sakurai, T., Ohta, H., Yamamoto, T., Einaga, Y., Shiota, Y., Yoshizawa, K., Konaka, H. & Sasaki, A., Feb 5 2018, In : Inorganic Chemistry. 57, 3, p. 1277-1287 11 p.

Research output: Contribution to journalArticle

Coulomb interactions
Sulfur
phase transformations
Cations
Enthalpy

Density-Functional Tight-Binding Study on the Effects of Interfacial Water in the Adhesion Force between Epoxy Resin and Alumina Surface

Yoshizawa, K., Murata, H. & Tanaka, H., Nov 27 2018, In : Langmuir. 34, 47, p. 14428-14438 11 p.

Research output: Contribution to journalArticle

Epoxy Resins
Aluminum Oxide
epoxy resins
Epoxy resins
adhesion
4 Citations (Scopus)

DFT exploration of active site motifs in methane hydroxylation by Ni-ZSM-5 zeolite

Mahyuddin, M. H. & Yoshizawa, K., Jan 1 2018, In : Catalysis Science and Technology. 8, 22, p. 5875-5885 11 p.

Research output: Contribution to journalArticle

Hydroxylation
Methane
Density functional theory
Methanol
Chemical activation
6 Citations (Scopus)

Dioxygen Activation on Cu-MOR Zeolite: Theoretical Insights into the Formation of Cu2O and Cu3O3 Active Species

Mahyuddin, M. H., Tanaka, T., Staykov, A. T., Shiota, Y. & Yoshizawa, K., Aug 20 2018, In : Inorganic Chemistry. 57, 16, p. 10146-10152 7 p.

Research output: Contribution to journalArticle

Zeolites
Chemical activation
activation
Oxygen
Methane
14 Citations (Scopus)

Disilaruthena- and Ferracyclic Complexes Containing Isocyanide Ligands as Effective Catalysts for Hydrogenation of Unfunctionalized Sterically Hindered Alkenes

Sunada, Y., Ogushi, H., Yamamoto, T., Uto, S., Sawano, M., Tahara, A., Tanaka, H., Shiota, Y., Yoshizawa, K. & Nagashima, H., Mar 21 2018, In : Journal of the American Chemical Society. 140, 11, p. 4119-4134 16 p.

Research output: Contribution to journalArticle

Hydrogenation
Cyanides
Alkenes
Olefins
Ligands
1 Citation (Scopus)

Effects of electron-phonon coupling on quantum interference in polyenes

Tsuji, Y. & Yoshizawa, K., Oct 7 2018, In : Journal of Chemical Physics. 149, 13, 134115.

Research output: Contribution to journalArticle

Polyenes
interference
Atoms
Electrons
Electrodes
4 Citations (Scopus)

Formation and Isolation of a Four-Electron-Reduced Porphyrin Derivative by Reduction of a Stable 20π Isophlorin

Suzuki, W., Kotani, H., Ishizuka, T., Shiota, Y., Yoshizawa, K. & Kojima, T., Feb 12 2018, In : Angewandte Chemie - International Edition. 57, 7, p. 1973-1977 5 p.

Research output: Contribution to journalArticle

Porphyrins
Derivatives
Electrons
Conformations
Protons
10 Citations (Scopus)

Ground-State Copper(III) Stabilized by N-Confused/N-Linked Corroles: Synthesis, Characterization, and Redox Reactivity

Maurya, Y. K., Noda, K., Yamasumi, K., Mori, S., Uchiyama, T., Kamitani, K., Hirai, T., Ninomiya, K., Nishibori, M., Hori, Y., Shiota, Y., Yoshizawa, K., Ishida, M. & Furuta, H., Jun 6 2018, In : Journal of the American Chemical Society. 140, 22, p. 6883-6892 10 p.

Research output: Contribution to journalArticle

Organometallics
Ground state
Oxidation-Reduction
Copper
Shells (structures)
2 Citations (Scopus)

Importance of the Reactant-State Potentials of Chromium(V)-Oxo Complexes to Determine the Reactivity in Hydrogen-Atom Transfer Reactions

Kotani, H., Kaida, S., Ishizuka, T., Mieda, K., Sakaguchi, M., Ogura, T., Shiota, Y., Yoshizawa, K. & Kojima, T., Nov 5 2018, In : Inorganic Chemistry. 57, 21, p. 13929-13936 8 p.

Research output: Contribution to journalArticle

Chromium
Hydrogen
chromium
hydrogen atoms
reactivity
2 Citations (Scopus)

Interaction of SrO-terminated SrTiO3 surface with oxygen, carbon dioxide, and water

Staykov, A., Fukumori, S., Yoshizawa, K., Sato, K., Ishihara, T. & Kilner, J., Jan 1 2018, In : Journal of Materials Chemistry A. 6, 45, p. 22662-22672 11 p.

Research output: Contribution to journalArticle

Carbon Dioxide
Carbon dioxide
Oxygen
Water
Molecular oxygen
3 Citations (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., Aug 20 2018, In : Inorganic Chemistry. 57, 16, p. 9683-9695 13 p.

Research output: Contribution to journalReview article

Iron
Ligands
iron
ligands
methylidyne
5 Citations (Scopus)

Mechanistic Insights into Homogeneous Electrocatalytic and Photocatalytic Hydrogen Evolution Catalyzed by High-Spin Ni(II) Complexes with S2N2-Type Tetradentate Ligands

Hong, D., Tsukakoshi, Y., Kotani, H., Ishizuka, T., Ohkubo, K., Shiota, Y., Yoshizawa, K., Fukuzumi, S. & Kojima, T., Jun 18 2018, In : Inorganic Chemistry. 57, 12, p. 7180-7190 11 p.

Research output: Contribution to journalArticle

Protons
Hydrogen
chelates
Ligands
ligands
29 Citations (Scopus)

Methane Partial Oxidation over [Cu2(μ-O)]2+ and [Cu3(μ-O)3]2+ Active Species in Large-Pore Zeolites

Mahyuddin, M. H., Tanaka, T., Shiota, Y., Staykov, A. T. & Yoshizawa, K., Feb 2 2018, In : ACS Catalysis. 8, 2, p. 1500-1509 10 p.

Research output: Contribution to journalArticle

Zeolites
Methane
Oxidation
Methanol
Density functional theory
1 Citation (Scopus)

NH Tautomerism of a Quadruply Fused Porphyrin: Rigid Fused Structure Delays the Proton Transfer

Saegusa, Y., Ishizuka, T., Shiota, Y., Yoshizawa, K. & Kojima, T., Jan 11 2018, In : Journal of Physical Chemistry B. 122, 1, p. 316-327 12 p.

Research output: Contribution to journalArticle

Pyrroles
Proton transfer
Porphyrins
rigid structures
porphyrins
2 Citations (Scopus)

Synthesis and reactivity of titanium- and zirconium-dinitrogen complexes bearing anionic pyrrole-based PNP-type pincer ligands

Sekiguchi, Y., Meng, F., Tanaka, H., Eizawa, A., Arashiba, K., Nakajima, K., Yoshizawa, K. & Nishibayashi, Y., Jan 1 2018, In : Dalton Transactions. 47, 33, p. 11322-11326 5 p.

Research output: Contribution to journalArticle

hydrazine
Bearings (structural)
Pyrroles
X ray analysis
Titanium