Tetsuya Taketsugu mainly investigates Molecule, Computational chemistry, Ab initio quantum chemistry methods, Ab initio and Adsorption. The Molecule study combines topics in areas such as Photodissociation, Photochemistry and Adiabatic process. His studies in Computational chemistry integrate themes in fields like Field, Excited state, Claisen rearrangement and Isomerization.
His Ab initio study integrates concerns from other disciplines, such as Potential energy and Atomic physics. His Adsorption research incorporates elements of Chemical physics, Hexagonal boron nitride, Nanoparticle, Surface and Catalysis. His study in Catalysis is interdisciplinary in nature, drawing from both Inorganic chemistry and Vacancy defect.
Tetsuya Taketsugu focuses on Atomic physics, Ab initio, Molecule, Computational chemistry and Photochemistry. His Ab initio research includes themes of Molecular physics, Potential energy, Ab initio quantum chemistry methods and Molecular orbital. His studies deal with areas such as Reaction path and Transition state as well as Computational chemistry.
His Photochemistry research integrates issues from Isomerization and Dissociation. The study incorporates disciplines such as Catalysis, Adsorption and Density functional theory in addition to Dissociation. In Density functional theory, Tetsuya Taketsugu works on issues like Inorganic chemistry, which are connected to Monolayer.
The scientist’s investigation covers issues in Catalysis, Molecular physics, Adsorption, Photochemistry and Density functional theory. His Catalysis research is multidisciplinary, incorporating perspectives in Inorganic chemistry, Decomposition, Combustion and Ammonia. His Molecular physics study incorporates themes from Electric field, Complete active space, Ab initio, Molecular vibration and Surface hopping.
His research in Adsorption intersects with topics in Cathode, Surface, Oxygen, Electron transfer and Steam reforming. His Photochemistry research incorporates themes from Ion, Hydrolysis, Intramolecular force and Dissociation. Tetsuya Taketsugu interconnects Scanning tunneling microscope and Iridium in the investigation of issues within Density functional theory.
Tetsuya Taketsugu mainly focuses on Chemical physics, Cluster, Raman spectroscopy, Inorganic chemistry and Plasmon. His research integrates issues of Molecular physics and Electric field in his study of Raman spectroscopy. His work investigates the relationship between Electric field and topics such as Nanoclusters that intersect with problems in Density functional theory.
His Inorganic chemistry research includes elements of Proton-coupled electron transfer, Rotating ring-disk electrode, Thermal desorption spectroscopy, Electrolyte and Catalysis. The various areas that he examines in his Plasmon study include Bond length, Adsorption, Light intensity, Alloy and Binding energy. His Molecular vibration study contributes to a more complete understanding of Molecule.
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Ab initio vibrational state calculations with a quartic force field: applications to H2CO, C2H4, CH3OH, CH3CCH, and C6H6.
Kiyoshi Yagi;Kimihiko Hirao;Tetsuya Taketsugu;Michael W. Schmidt.
Journal of Chemical Physics (2004)
Spectroscopic tracking of structural evolution in ultrafast stilbene photoisomerization.
Satoshi Takeuchi;Sanford Ruhman;Takao Tsuneda;Mahito Chiba.
Boron Nitride Nanosheet on Gold as an Electrocatalyst for Oxygen Reduction Reaction: Theoretical Suggestion and Experimental Proof
Kohei Uosaki;Ganesan Elumalai;Hidenori Noguchi;Takuya Masuda.
Journal of the American Chemical Society (2014)
Direct Vibrational Self-Consistent Field Method: Applications to H2O and H2CO
Kiyoshi Yagi;Tetsuya Taketsugu;Kimihiko Hirao;Mark S. Gordon.
Journal of Chemical Physics (2000)
Intrinsic reaction coordinate: Calculation, bifurcation, and automated search
Satoshi Maeda;Yu Harabuchi;Yuriko Ono;Tetsuya Taketsugu.
International Journal of Quantum Chemistry (2015)
Exploring transition state structures for intramolecular pathways by the artificial force induced reaction method.
Satoshi Maeda;Tetsuya Taketsugu;Keiji Morokuma.
Journal of Computational Chemistry (2014)
Generation of full-dimensional potential energy surface of intramolecular hydrogen atom transfer in malonaldehyde and tunneling dynamics
Kiyoshi Yagi;Tetsuya Taketsugu;Kimihiko Hirao.
Journal of Chemical Physics (2001)
Ab initio molecular dynamics simulation of photoisomerization in azobenzene in the nπ* state
Yusuke Ootani;Kiminori Satoh;Akira Nakayama;Takeshi Noro.
Journal of Chemical Physics (2009)
From Graphene Nanoribbons on Cu(111) to Nanographene on Cu(110): Critical Role of Substrate Structure in the Bottom-Up Fabrication Strategy.
Konstantin A. Simonov;Nikolay A. Vinogradov;Alexander S. Vinogradov;Alexander V. Generalov.
ACS Nano (2015)
Functionalization of Monolayer h-BN by a Metal Support for the Oxygen Reduction Reaction
Andrey Lyalin;Akira Nakayama;Kohei Uosaki;Tetsuya Taketsugu.
Journal of Physical Chemistry C (2013)
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