Kaito Takahashi

No 1, Sec. 4 Roosevelt Rd
TPQ 10617, Taiwan

Last Updated: 09/26/2026

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Found 57 publications

Can single reference density functional theory methods describe spin state crossing for 3d transition metal carbon monoxide association?

Can single reference density functional theory methods describe spin state crossing for 3d transition metal carbon monoxide association?

Journal: Physical chemistry chemical physics : PCCP

Published: February 18, 2026

Multistate Transition Metal Carbonyl Bonding Beyond Minimum Energy Pathway: Nonlocality of Spin-Orbit Interaction.

Multistate Transition Metal Carbonyl Bonding Beyond Minimum Energy Pathway: Nonlocality of Spin-Orbit Interaction.

Journal: Inorganic chemistry

Published: January 13, 2025

Comment on "UV Absorption Spectroscopy of the Conformer-Dependent Reactivity of the Four Carbon Criegee Intermediate of Methyl Vinyl Ketone Oxide: An Ab initio Quantum Dynamics Study".

Comment on "UV Absorption Spectroscopy of the Conformer-Dependent Reactivity of the Four Carbon Criegee Intermediate of Methyl Vinyl Ketone Oxide: An Ab initio Quantum Dynamics Study".

Journal: The journal of physical chemistry. A

Published: January 31, 2024

Kinetics of the Simplest Criegee Intermediate Reaction with Water Vapor: Revisit and Isotope Effect.

Kinetics of the Simplest Criegee Intermediate Reaction with Water Vapor: Revisit and Isotope Effect.

Journal: The journal of physical chemistry. A

Published: September 21, 2023

Substituent Dependence on the Reactions of Criegee Intermediates with Carbon Dioxide and Carbon Monoxide.

Substituent Dependence on the Reactions of Criegee Intermediates with Carbon Dioxide and Carbon Monoxide.

Journal: ChemPlusChem

Published: July 09, 2023

Enhanced Electrocatalytic CO2 Reduction Reactivity of S- and N-Doped Fe-Embedded Graphene.

Enhanced Electrocatalytic CO2 Reduction Reactivity of S- and N-Doped Fe-Embedded Graphene.

Journal: ChemPlusChem

Published: June 25, 2023

Reaction Kinetics of Criegee Intermediates with Nitric Acid.

Reaction Kinetics of Criegee Intermediates with Nitric Acid.

Journal: The journal of physical chemistry. A

Published: August 31, 2022

Wave Packet Calculation of Absolute UV Cross Section of Criegee Intermediates.

Wave Packet Calculation of Absolute UV Cross Section of Criegee Intermediates.

Journal: The journal of physical chemistry. A

Published: August 30, 2022

Mechanism and kinetics of the reaction of the Criegee intermediate CH2OO with acetic acid studied using a step-scan Fourier-transform IR spectrometer.

Mechanism and kinetics of the reaction of the Criegee intermediate CH2OO with acetic acid studied using a step-scan Fourier-transform IR spectrometer.

Journal: Physical chemistry chemical physics : PCCP

Published: August 02, 2022

Understanding the interaction between transition metal doping and ligand atoms of ZnS and ZnO monolayers to promote the CO2 reduction reaction.

Understanding the interaction between transition metal doping and ligand atoms of ZnS and ZnO monolayers to promote the CO2 reduction reaction.

Journal: Physical chemistry chemical physics : PCCP

Published: May 18, 2022

Absolute photodissociation cross sections of thermalized methyl vinyl ketone oxide and methacrolein oxide.

Absolute photodissociation cross sections of thermalized methyl vinyl ketone oxide and methacrolein oxide.

Journal: Physical chemistry chemical physics : PCCP

Published: April 20, 2022

Experimental and Computational Studies of Criegee Intermediate syn-CH3CHOO Reaction with Hydrogen Chloride.

Experimental and Computational Studies of Criegee Intermediate syn-CH3CHOO Reaction with Hydrogen Chloride.

Journal: The journal of physical chemistry. A

Published: September 24, 2021

Showing 1-12 of 57

Last Updated: 09/26/2026