Book and thesis
Papers
Quantitative evaluation of noncovalent interactions with negative fragmentation approach including basis set superposition error correction Bulletin of the Chemical Society of Japan 97 (9),pp.uoae091 (Co-authored) 2024/09/25
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Structure comparison of heme-binding sites in heme protein predicted by AlphaFold3 and AlphaFold2 Chemistry Letters 53,pp.upae148 (Co-authored) 2024/08/22
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C-H bond dissociation enthalpy prediction with machine learning reinforced semi-empirical quantum mechanical calculations Chemistry Letters 53,pp.upae016 (Co-authored) 2024/02/27
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Computational exploration of minimum energy reaction pathway of N2O formation from intermediate I of P450nor using an active center model International Journal of Molecular Sciences 24 (24),pp.17172 (Co-authored) 2023/12/06
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Semi-empirical and machine learning-based prediction of site of metabolisms mediated by aldehyde oxidase Chemical Physics Letters 833,pp.140942 (Co-authored) 2023/11/17
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Random forest classifier of heme proteins using porphyrin distortions and axial ligands of heme Chemistry Letters 52,pp.503-507 (Co-authored) 2023/06/30
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Highly sensitive colorimetric detection of histidine using histidyl‑tRNA synthetase as the bioreceptor Biomedical Materials & Devices 1,pp.1022-1027 (Co-authored) 2023/04/10
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Unraveling binding mechanism and stability of urease inhibitors: A QM/MM MD study Molecules 28 (6),pp.2697 (Co-authored) 2023/03/17
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Negative fragmentation approach for investigating the depolarization effect of neighboring residues on hydrogen bonds in π-helix Chemical Physics Letters,pp.140361 (Co-authored) 2023/02/24
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Serial X-ray fluorescence holography: development and application to the oxygen evolving complex of photosystem II Journal of Synchrotron Radiation,pp.368-378 (Co-authored) 2023/02/24
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Quantum chemical studies on hydrogen bonds in helical secondary structures Biophysical Reviews,pp.1369-1378 (Co-authored) 2023/01/17
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Prediction of protein function from tertiary structure of the active site in heme proteins by convolutional neural network Biomolecules,pp.137 (Co-authored) 2023/01/09
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Effects of active-center reduction of plant-type ferredoxin on its structure and dynamics: computational analysis using molecular dynamics simulations International Journal of Molecular Sciences,pp.15913 (Co-authored) 2022/12/15
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Structures and mechanisms of actin ATP hydrolysis The Proceedings of the National Academy of Sciences,pp.e2122641119 (Co-authored) 2022/10/18
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Effects of light-emitting diode irradiation pattern on the anthocyanin content of broccoli sprouts in a plant factory for the production of functional foods. Japan Journal of Food Engineering,pp.71-78 (Co-authored) 2022/10/01
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Conformational preference of flavonols and its effect on the chemical properties involved in radical scavenging activity Chemistry,pp.1123-1135 (Co-authored) 2022/09/22
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Elucidation of the correlation between the heme distortion and the tertiary structure of heme-binding pocket by convolutional neural network Biomolecules,pp.1172 (Co-authored) 2022/08/24
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Depolarizing effects in hydrogen bond energy in 310-helices revealed by quantum chemical analysis International Journal of Molecular Sciences,pp.9032 (Co-authored) 2022/08/12
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Evaluation of an appropriate standard hydrogen electrode potential for computing redox potentials of catechins with density functional theory Chemistry Letters,pp.673-677 (Co-authored) 2022/07/01
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Structure of heme-binding pocket in heme protein is generally rigid and can be predicted by AlphaFold2 Chemistry Letters,pp.704-708 (Co-authored) 2022/07/01
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Predicting reaction mechanisms for the threonine-residue stereoinversion catalyzed by a dihydrogen phosphate ion ACS Omega,pp.18306-18314 (Co-authored) 2022/05/26
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QM/MM molecular dynamics simulations revealed catalytic mechanism of urease Journal of Physical Chemistry B,pp.2087-2097 (Co-authored) 2022/03/22
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Theoretical Prediction of the Redox Potential of Catechins with First Principle Calculation Journal of Computational Chemistry, Japan,pp.137-139 (Co-authored) 2022/03/17
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Development of a one-step analysis method for several amino acids using a microfluidic paper-based analytical device Scientific Reports,pp.3427 (Co-authored) 2022/03/03
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Global analysis of heme proteins to elucidate the correlation between heme distortion and heme-binding pocket Journal of Chemical Information and Modeling,pp.775-784 (Co-authored) 2022/03/03
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Analysis of fluctuation in the heme-binding pocket and heme distortion in hemoglobin and myoglobin Life,pp.210 (Co-authored) 2022/01/29
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Short-lived intermediate in N2O generation by P450 NO reductase captured by time-resolved IR spectroscopy and XFEL crystallography The Proceedings of the National Academy of Sciences,pp.e2101481118 (Co-authored) 2021/05/18
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Spin-projected QM/MM free energy simulations for oxidation reaction of guanine in B-DNA by singlet oxygen ChemPhysChem,pp.561-568 (Co-authored) 2021/03/17
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PyDISH: Database and analysis tools for heme porphyrin distortion in heme proteins Database: The Journal of Biological Databases and Curation,pp.baaa066 (Co-authored) 2020/10/02
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Quantitative assessment of reparameterized PM6 (rPM6) for hydrogen abstraction reactions Molecular Physics,pp.e1700313 (Co-authored) 2020/07/15
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Microfluidic paper-based analytical device for histidine determination Applied Biochemistry and Biotechnology,pp.812-821 (Co-authored) 2020/06/27
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Effects of a remote mutation from the contact paratope on the structure of CDR-H3 in an anti-HIV neutralizing antibody PG16 Scientific Reports,pp.19840 (Co-authored) 2019/12/27
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Singlet-Triplet energy gaps in binuclear copper complexes and organic diradicals by approximate spin projected spin-unrestricted coupled cluster method Chemistry Letters,pp.1441-1444 (Co-authored) 2019/11/08
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Hydrogen bond energies in α-helical peptides revealed by precise DFT calculations and molecular tailoring approach Journal of Computational Chemistry,pp.2043-2052 (Co-authored) 2019/05/17
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Quantitative assessment of rPM6 for fluorine- and chlorine-containing metal complexes: Comparison with experimental, first-principles and other semiempirical results Molecules,pp.3332 (Co-authored) 2018/12/15
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Zn2+-Binding to the Voltage-Gated Proton Channel Hv1/VSOP Journal of Physical Chemistry B,pp.9076-9080 (Co-authored) 2018/10/04
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Transition state search using rPM6: iron- and manganese-catalyzed oxidation reactions as a test case Bulletin of the Chemical Society of Japan,pp.1377-1389 (Co-authored) 2018/09/27
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Statistical and quantum-chemical analysis of heme porphyrin distortion effect in heme proteins: differences between oxidoreductases and oxygen carrier proteins Chemical Physics Letters,pp.108-112 (Co-authored) 2018/09/05
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Computational study on atomic structures, electronic properties, and chemical reactions at surfaces and interfaces and in biomaterials Journal of the physical society of Japan,pp.061013 (Co-authored) 2018/05/30
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rPM6 parameters for phosphorus and sulfur containing open-shell molecules Molecular Physics,pp.602-610 (Co-authored) 2018/02/21
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Density functional study of porphyrin distortion effects on redox potential of heme Journal of Computational Chemistry,pp.139-142 (Co-authored) 2017/12/07
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Capturing an initial intermediate during enzymatic reaction of P450nor using time-resolved XFEL crystallography and caged-substrate Nature Communications,pp.1585 (Co-authored) 2017/11/17
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Assessment of semi-empirical molecular orbital calculations for describing magnetic interactions Polyhedron,pp.52-57 (Co-authored) 2017/10/24
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rPM6 parameters for manganese and application to transition state search for oxidation reactions of cyclohexene by manganese(IV)-oxo species Chemistry Letters,pp.1567-1569 (Co-authored) 2017/09/02
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UNO DMRG CASCI calculations of effective exchange integrals for m-phenylene-bis-methylene spin clusters Molecular Physics,pp.2154-2167 (Co-authored) 2017/08/30
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Recycling of biodiesel fuel wastewater for use as a liquid fertilizer for hydroponics Journal of Material Cycles and Waste Management,pp.999-1007 (Co-authored) 2017/07/01
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Common folding processes of mini-proteins: Partial formations of secondary structures initiate the immediate protein folding Journal of Computational Chemistry,pp.790-797 (Co-authored) 2017/03/03
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Applicability of density functional tight binding method with dispersion correction to investigate the adsorption of porhyrin/porphycene metal complexes on graphene Chemistry Letters,pp.51-52 (Co-authored) 2016/12/02
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Reparameterization of PM6 applied to organic diradical molecules Journal of Physical Chemistry A,pp.8750-8760 (Co-authored) 2016/11/03
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Inverse Ubbelohde effect in the short hydrogen bond of Photosystem II: Relation between H/D isotope effect and symmetry in potential energy profile Journal of Computational Chemistry,pp.2140-2145 (Co-authored) 2016/07/26
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Elastic properties of dynein motor domain obtained from all-atom molecular dynamics simulations Protein Engineering, Design & Selection,pp.317-326 (Co-authored) 2016/06/26
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TaBoo SeArch (TBSA) algorithm with a modified inverse histogram for reproducing biologically relevant rare-events of proteins Journal of Chemical Theory and Computation,pp.2436-2445 (Co-authored) 2016/05/10
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Development of massive multi-level molecular dynamics simulation program, Platypus (PLATform for dYnamic Protein Unified Simulation), for the elucidation of protein functions Journal of Computational Chemistry,pp.1125-1132 (Co-authored) 2016/05/05
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Direct interaction between the voltage-sensors produces coorperative sustained deactivation in voltage-gated H+ channel dimers Journal of Biological Chemistry,pp.5935-5947 (Co-authored) 2016/03/11
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Density functional study of molecular interactions in secondary structures of proteins Biophysics and Physicobiology,pp.27-35 (Co-authored) 2016/02/13
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Efficient conformational sampling of proteins based on a multi-dimensional inverse histogram: An application to folding of chignolin in explicit solvent Chemical Physics Letters,pp.68-75 (Co-authored) 2015/06/16
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Enhanced conformational sampling method for proteins based on the TaBoo SeArch (TBSA) algorithm: Application to the folding of a mini-protein, chignolin Journal of Computational Chemistry,pp.763-772 (Co-authored) 2015/04/15
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Protein folding pathways extracted by OFLOOD: Outlier FLOODing method Journal of Computational Chemistry,pp.97-102 (Co-authored) 2015/01/15
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NMR characterization of the interaction of the endonuclease domain of MutL with divalent metal ions and ATP PLos One,pp.e98554 (Co-authored) 2014/06/05
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Mg2+-dependent interactions of ATP with the cystathionine-β-synthase (CBS) domains of a magnesium transporter Journal of Biological Chemistry,pp.14731-14739 (Co-authored) 2014/05/23
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H2O2-dependent substrate oxidation by an engineered diiron site in a bacterial hemerythrin Chemical Communications,pp.3421-3423 (Co-authored) 2014/04/04
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Fluctuation Flooding Method (FFM) for accelerating conformational transitions on proteins Journal of Chemical Physics,pp.125103 (Co-authored) 2014/03/28
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Density functional study of the phosphate diester hydrolysis of RNA in RNA/DNA hybrid by RNase H Molecular Physics,pp.355-364 (Co-authored) 2014/02/01
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Molecular dynamics simulations accelerated by GPU for biological macromolecules with a non-Ewald scheme for electrostatic interactions Journal of Chemical Theory and Computation,pp.5599-5609 (Co-authored) 2013/12/10
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Crystal structure, exogenous ligand binding and redox properties of an engineered diiron active site in a bacterial hemerythrin Inorganic Chemistry,pp.13014-13020 (Co-authored) 2013/11/18
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Evaluations of the conformational search accuracy of CAMDAS using experimental three-dimensional structures of protein-ligand complexes Journal of Physics: Conference Series,pp.012028 (Co-authored) 2013/08/12
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Quantum chemical study of conformational preferences in intermediates and transition states of the hydrolysis of dimethyl phosphate Journal of Physics: Conference Series,pp.012058 (Co-authored) 2013/08/12
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Theoretical studies of effect of protein environment on electronic structures and chemical indices of the active site of oxygenated and deoxygenated hemerythrin International Journal of Quantum Chemistry,pp.497-503 (Co-authored) 2013/02/13
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Density functional studies of the structural variety of the Cu2S2 core of the CuA site International Journal of Quantum Chemistry,pp.3756-3762 (Co-authored) 2012/12/15
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Creation of a binuclear purple copper site within a de novo coiled-coil protein Biochemistry,pp.7901-7907 (Co-authored) 2012/10/09
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Coordination effects on the electronic structure of the CuA site of cytochrome c oxidase Chemical Physics Letters,pp.197-201 (Co-authored) 2012/04/02
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Electronic structures of the Cu2S2 core of the CuA site in cytochrome c oxidase and nitrous oxide reductase International Journal of Quantum Chemistry,pp.208-218 (Co-authored) 2012/01/01
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Possible mechanisms of water splitting reaction based on proton and electron release pathways revealed for CaMn4O5 cluster of PSII refined to 1.9 Å X-ray resolution International Journal of Quantum Chemistry,pp.253-276 (Co-authored) 2012/01/01
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Theory for trivial trajectory parallelization of multicanonical molecular dynamics and application to a polypeptide in water Journal of Computational Chemistry,pp.97-102 (Co-authored) 2011/05/01
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Theoretical studies on electronic structure and magnetic properties of mixed-valence uteroferrin active site International Journal of Quantum Chemistry,pp.702-710 (Co-authored) 2011/03/05
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Electronic structures of a [4Fe-4S] cluster, [Fe4S4(SCH3)3(CH3COO)], in dark-operative protochlorophyllide oxidoreductase (DPOR) Chemical Physics Letters,pp.296-300 (Co-authored) 2011/02/17
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Creation of a type 1 blue copper site within a de novo coiled-coil protein scaffold Journal of the American Chemical Society,pp.18191-18198 (Co-authored) 2010/12/29
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Electronic structures of heme a of cytochrome c oxidase in the redox states. -Charge density migration to the propionate groups of heme a- Journal of Computational Chemistry,pp.954-962 (Co-authored) 2010/04/15
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Density functional study of roles of porphyrin ring in electronic structures of heme International Journal of Quantum Chemistry,pp.3583-3591 (Co-authored) 2009/12/01
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The effect of the side chain length of Asp and Glu on coordination structure of Cu2+ in a de novo designed protein Biopolymers,pp.907-916 (Co-authored) 2009/11/01
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Theoretical studies of the magnetic couplings and the chemical indices of the biomimetic models of oxyhemocyanin and oxytyrosinase Inorganica Chim Acta,pp.4578-4584 (Co-authored) 2009/09/15
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Membrane attachment facilitates ligand access to the active site in monoamine oxidase A Biochemistry,pp.5864-5873 (Co-authored) 2009/06/30
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Hybrid-DFT study on electronic structures of the active site of sweet potato purple acid phosphatase. -The origin of stronger antiferromagnetic couplings than other purple acid phosphatase- The Journal of Physical Chemistry A,pp.5099-5104 (Co-authored) 2009/04/30
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Theoretical investigation of the electronic asymmetry of the special pair cation radical in the photosynthetic type-II reaction center The Journal of Physical Chemistry B,pp.13923-13933 (Co-authored) 2008/11/06
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A theoretical approach to a novel pathway of proton translocation of cytochrome c oxidase AIP Conference Proceedings,pp.60-63 (Co-authored) 2008/09/17
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Cyclopropanecarboxylic acid esters as potential prodrugs with enhanced hydrolytic stability Organic Letters,pp.509-511 (Co-authored) 2008/02/07
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Theoretical studies on electronic structures and chemical indices of the active site in oxygenated and deoxygenated hemerythrin Bulletin of the Chemical Society of Japan,pp.91-102 (Co-authored) 2008/01/10
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Theoretical analysis of the electronic asymmetry of the special pair in the photosynthetic reaction center: Effect of structural asymmetry and protein environment Chemical Physics Letters,pp.324-329 (Co-authored) 2007/10/25
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Hybrid density functional study of ligand coordination effects on the magnetic couplings and the dioxygen binding of the models of hemocyanin International Journal of Quantum Chemistry,pp.3103-3119 (Co-authored) 2007/09/20
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Theory of chemical bonds in metalloenzymes. IX. Theoretical study on the active site of the ribonucleotide reductase and the related species International Journal of Quantum Chemistry,pp.3250-3265 (Co-authored) 2007/09/20
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Theoretical study on the magnetic interactions of active site in hemerythrin Polyhedron,pp.2701-2707 (Co-authored) 2006/11/17
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Quantum mechanical study of the proton transfer via a peptide bond in the novel proton translocation pathway of cytochrome c oxidase Chemical Physics Letters,pp.149-155 (Co-authored) 2006/10/19
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Mechanistic insights in charge-transfer-induced luminescence of 1,2-dioxetanones with a substituent of low oxidation potentials Journal of the American Chemical Society,pp.8667-8679 (Co-authored) 2005/06/22
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Benchmarking the conductor-like polarizable continuum model (CPCM) for aqueous solvation free energies of neutral and ionic organic molecules Journal of Chemical Theory and Computation,pp.70-77 (Co-authored) 2005/01/01
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Conformational preferences in the transition states and tetrahedral intermediates of transacylations. Relationships to enzyme-bound conformations of phosphonate inhibitors of lipases and esterases The Journal of Physical Chemistry A,pp.11740-11751 (Co-authored) 2004/12/30
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Spin and pseudo spins in theoretical chemistry. A unified view for superposed and entangled quantum systems Bulletin of the Korean Chemical Society,pp.864-880 (Co-authored) 2003/06/01
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Theoretical calculations of effective exchange integrals by spin projected and unprojected broken-symmetry methods. I. Cluster models of K2NiF4-type solids Journal of Chemical Physics,pp.9747-9761 (Co-authored) 2003/06/01
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Theoretical studies on contributions of SOMO–SOMO and other couplings to the magnetic interaction in radical clusters Synthetic Metals,pp.593-595 (Co-authored) 2003/03/13
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Systematic comparisons between broken-symmetry and symmetry-adapted approaches to transition states by chemical indices. A case study of the Diels–Alder reactions The Journal of Physical Chemistry A,pp.682-694 (Co-authored) 2003/02/06
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Hybrid density functional theory studies on the magnetic interactions and weak covalent bonding for the phenalenyl radical dimeric pair Journal of the American Chemical Society,pp.11122-11130 (Co-authored) 2002/09/18
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Analytical and ab initio studies of effective exchange interactions, polyradical charcter, unpaired electron density and information entropy in radical clusters (R)N: Allyl radical cluster (N = 2–10) and hydrogen radical cluster (N = 50) International Journal of Quantum Chemistry,pp.370-385 (Co-authored) 2002/08/21
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Theoretical investigation of magnetic parameters in two dimensional sheets of pure organic BEDT-TTF and BETS molecules by using ab initio MO and DFT methods Molecular Physics,pp.2641-2652 (Co-authored) 2002/08/01
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Extended Hartree–Fock (EHF) theory of chemical reactions VI. Hybrid DFT and post-Hartree–Fock approaches for concerted and non-concerted transition structures of the Diels–Alder reaction Molecular Physics,pp.717-727 (Co-authored) 2002/06/01
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Effective exchange integrals and chemical indices for a phenalenyl radical dimeric pair Chemical Physics Letters,pp.17-23 (Co-authored) 2002/05/24
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Theoretical Studies on the Electronic Structures of d-p Conjugated Systems: Molecule-based Magnets and Non-heme Oxygen Transport Proteins (Sole-authored) 2002/03/25
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Theoretical studies of magnetic interactions in Mn(II)(hfac)2{di(4-pyridyl)phenylcarbene} and Cu(II)(hfac)2{di(4-pyridyl)phenylcarbene} Journal of the American Chemical Society,pp.450-461 (Co-authored) 2002/01/23
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Theoretical studies on electronic states of hole-doped copper oxides Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.507-512 (Co-authored) 2002
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Theoretical studies on magnetic interaction of M-π conjugated systems via pyrimidine coupler Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.531-536 (Co-authored) 2002
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Theoretical study on the magnetic interaction for manganese oxides Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.335-340 (Co-authored) 2002
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Theoretical study of the magnetic interaction for M–O–M type metal oxides. Comparison of broken-symmetry approaches Polyhedron,pp.1177-1184 (Co-authored) 2001/05/30
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Theoretical studies on the magnetic and reversible dioxygen binding of the active site in hemocyanin Chemical Physics Letters,pp.395-403 (Co-authored) 2001/03/02
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EHF theory of chemical reactions V. The nature of manganese-oxygen bonds by hybrid density functional theory (DFT) and coupled-cluster (CC) methods International Journal of Quantum Chemistry,pp.34-43 (Co-authored) 2001/01/01
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Density-functional study of intramolecular ferromagnetic interaction through m-phenylene coupling unit (II): Examination of functional dependency Journal of Chemical Physics,pp.10486-10504 (Co-authored) 2000/12/15
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Density functional and post–Hartree–Fock studies on effective exchange interaction of d-π-d conjugated systems involving m-phenylene type bridge International Journal of Quantum Chemistry,pp.681-691 (Co-authored) 2000/10/20
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Density functional study of intramolecular ferromagnetic interaction through m-phenylene coupling unit (I): UBLYP, UB3LYP, and UHF calculation Journal of Chemical Physics,pp.4035-4051 (Co-authored) 2000/09/08
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Ab initio computations of effective exchange integrals for H–H, H–He–H and Mn2O2 complex: comparison of broken-symmetry approaches Chemical Physics Letters,pp.223-230 (Co-authored) 2000/03/17
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Theoretical studies of the antiferromagnetic model clusters for K2MX4 type solids Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.133-138 (Co-authored) 2000
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Theoretical studies on magnetic interaction of di-µ-oxo bridged manganese dimers Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.157-162 (Co-authored) 2000
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Theoretical studies on magnetic interaction of Mn-π conjugated systems Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.291-296 (Co-authored) 2000
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Theoretical studies on magnetic interactions of dichromium tetraacetate by using hybrid density functional theory Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.145-150 (Co-authored) 2000
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Theoretical study on necessary conditions for reversible photoinduced magnetization: cobalt-iron cyanide system Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.151-156 (Co-authored) 2000
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Experimental and theoretical studies on the selectivity of GGG triplets toward one-electron oxidation in B-form DNA Journal of the American Chemical Society,pp.8712-8719 (Co-authored) 1999/09/29
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Density functional study of intramolecular ferromagnetic interaction through m-phenylene coupling unit. III. Possibility of high-spin polymer Journal of Chemical Physics,pp.1309-4051 (Co-authored) 1999/07/15
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Symmetry and broken symmetries in molecular orbital descriptions of unstable molecules II. Alignment, frustration and tunneling of spins in mesoscopic molecular magnets Theoretical Chemistry Accounts,pp.328-345 (Co-authored) 1999/06/01
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Theoretical studies of the effective exchange interactions and photoinduced magnetism in manganese and copper di(4-pyridyl)carbene complexes Chemical Physics Letters,pp.309-316 (Co-authored) 1999/02/26
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Theoretical studies of decomposition reactions of dioxetane, dioxetanone, and related species. CT induced luminescence mechanism revisited Bulletin of the Chemical Society of Japan,pp.213-225 (Co-authored) 1999/02/10
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Ab initio crystal orbital study of ferromagnetic interaction of spins in polymer comprising phenylenevinylene Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals,pp.613-622 (Co-authored) 1999
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Electronic structures of organometallic conjugated systems. Possibilities of molecular magnets, magnetic conductors and spin-mediated superconductors composed of metallocene units Journal of Organometallic Chemistry,pp.177-187 (Co-authored) 1998/10/30
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Theoretical study of electronic structures of one-dimensional magnetic clusters composed of doublet lithium and copper atoms Journal of Molecular Structure: THEOCHEM,pp.89-107 (Co-authored) 1998/09/28
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Ab initio size-consistent calculations of effective exchange interactions in mesoscopic magnetic clusters composed of triplet methylenes and quartet nitrogen atoms Bulletin of the Chemical Society of Japan,pp.2097-2108 (Co-authored) 1998/09/10
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Hubbard and Heisenberg models for four-site four-electron systems. Group-theoretical interrelationships and applications to multinuclear transition-metal clusters Bulletin of the Chemical Society of Japan,pp.573-588 (Co-authored) 1998/03/10