Kazuki Okazawa
Kyushu University
H-index: 4
Asia-Japan
Top articles of Kazuki Okazawa
Hückel Molecular Orbital Analysis for Stability and Instability of Stacked Aromatic and Stacked Antiaromatic Systems
The Journal of Organic Chemistry
2023/10/17
A machine learning approach to designing tough and degradable polyamides based on multiblock structures
2023/9/11
Complexation‐Triggered Fluctuation of π‐Conjugation on an Antiaromatic Dicyanoanthracene Dianion
Chemistry–A European Journal
2023/12/14
Exploring Metal Nanocluster Catalysts for Ammonia Synthesis Using Informatics Methods: A Concerted Effort of Bayesian Optimization, Swarm Intelligence, and First-Principles …
ACS omega
2023/8/7
Frontier Orbital Views of Stacked Aromaticity
The Journal of Physical Chemistry A
2023/5/27
Molecular understanding of adhesion of epoxy resin to graphene and graphene oxide surfaces in terms of orbital interactions
Langmuir
2023/4/7
Extraordinary Acceleration of an Electrophilic Reaction Driven by the Polar Surface of 2D Aluminosilicate Nanosheets
Small
2023/3
Mechanistic origins of accelerated hydrogenation of mixed alkylaromatics by synchronised adsorption over Rh/SiO 2
Reaction Chemistry & Engineering
2023
Exploring the optimal alloy for nitrogen activation by combining Bayesian optimization with density functional theory calculations
ACS omega
2022/11/30
Graph-theoretical exploration of the relation between conductivity and connectivity in heteroatom-containing single-molecule junctions
The Journal of Chemical Physics
2022/3/7
Topology dictates magnetic and conductive properties of a π-stacked system: insight into possible coexistence of magnetic and conductive systems
The Journal of Physical Chemistry C
2022/1/28
積層芳香族性を有する π スタック単分子接合の伝導特性に関する理論的研究
Journal of Computer Chemistry, Japan
2022
Electronic Origin of Catalytic Activity of TiH2 for Ammonia Synthesis
The Journal of Physical Chemistry C
2021/2/11
Mechanical Control of Molecular Conductance and Diradical Character in Bond Stretching and π-Stack Compression
The Journal of Physical Chemistry C
2020/9/24
Time-resolved infrared study of photo-induced ring-closure reaction of trans-2-hydroxychalcone
Journal of Photochemistry and Photobiology A: Chemistry
2020/2/15
Kazuki Okazawa
H-Index: 2
Misako Aida
H-Index: 10
Understanding single-molecule parallel circuits on the basis of frontier orbital theory
The Journal of Physical Chemistry C
2020/1/15
ヘテロ原子を含んだ単分子接合の導電性に関するグラフ理論的研究
Journal of Computer Chemistry, Japan
2020
Co-Authors
