OKAZAWA Kazuki

Affiliation

Center for Computational Sciences

Official title

Assistant Professor

ORCID

Career history


2024-04 -- (current)	University of TsukubaCenter for Computational SciencesAssistant Professor
2023-04 -- 2024-03	日本学術振興会特別研究員（DC2）

Degree


2024-03	博士（工学）	九州大学

Academic societies


2022-04 -- (current)	Japan Society of Theoretical Chemistry
2019-11 -- (current)	Chemical Society of Japan
2019-04 -- (current)	JAPAN SOCIETY FOR MOLECULAR SCIENCE

Honors & Awards


2022-11	第45回ケモインフォマティクス討論会優秀ポスター賞

Articles

Complexation-Triggered Fluctuation of π-Conjugation on an Antiaromatic Dicyanoanthracene Dianion
Imagawa Taiki; Okazawa Kazuki; Yoshizawa Kazunari; Yos...
Chemistry (Weinheim an der Bergstrasse, Germany)/29(70), 2023-12-14
PubMed
Hückel Molecular Orbital Analysis for Stability and Instability of Stacked Aromatic and Stacked Antiaromatic Systems
Tsuji Yuta; Okazawa Kazuki; Yoshizawa Kazunari
The Journal of organic chemistry/88(21)/pp.14887-14898, 2023-11-03
PubMed
Exploring Metal Nanocluster Catalysts for Ammonia Synthesis Using Informatics Methods: A Concerted Effort of Bayesian Optimization, Swarm Intelligence, and First-Principles Computation
Tsuji Yuta; Yoshioka Yuta; Okazawa Kazuki; Yoshizawa ...
ACS omega/8(33)/pp.30335-30348, 2023-08-22
PubMed
Frontier Orbital Views of Stacked Aromaticity
Okazawa Kazuki; Tsuji Yuta; Yoshizawa Kazunari
The journal of physical chemistry. A/127(22)/pp.4780-4786, 2023-06-08
PubMed
Molecular Understanding of Adhesion of Epoxy Resin to Graphene and Graphene Oxide Surfaces in Terms of Orbital Interactions
Shrestha Amit; Sumiya Yosuke; Okazawa Kazuki; Uwabe T...
Langmuir : the ACS journal of surfaces and colloids/39(15)/pp.5514-5526, 2023-04-18
PubMed
Mechanistic origins of accelerated hydrogenation of mixed alkylaromatics by synchronised adsorption over Rh/SiO2
Cherkasov Nikolay; Asano Shunsaku; Tsuji Yuta; Okazawa...
Reaction Chemistry & Engineering/8(6)/pp.1341-1348, 2023-03
Extraordinary Acceleration of an Electrophilic Reaction Driven by the Polar Surface of 2D Aluminosilicate Nanosheets
L Torad Nagy; Tsuji Yuta; Alowasheeir Azhar; Momotake ...
Small (Weinheim an der Bergstrasse, Germany)/19(11), 2023-03-01
PubMed
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
岡澤一樹; 辻雄太; 吉澤一成
Journal of Computational Chemistry Japan, 2023-01
Exploring the Optimal Alloy for Nitrogen Activation by Combining Bayesian Optimization with Density Functional Theory Calculations
Okazawa Kazuki; Tsuji Yuta; Kurino Keita; Yoshida Mas...
ACS omega/7(49)/pp.45403-45408, 2022-12-13
PubMed
Graph-theoretical exploration of the relation between conductivity and connectivity in heteroatom-containing single-molecule junctions
Okazawa Kazuki; Tsuji Yuta; Yoshizawa Kazunari
The Journal of chemical physics/156(9), 2022-03-07
PubMed
Topology Dictates Magnetic and Conductive Properties of a π-Stacked System: Insight into Possible Coexistence of Magnetic and Conductive Systems
Tsuji Yuta; Okazawa Kazuki; Kurino Keita; Yoshizawa K...
The Journal of Physical Chemistry C/126(6)/pp.3244-3256, 2022-01
Electronic Origin of Catalytic Activity of TiH2 for Ammonia Synthesis
Tsuji Yuta; Okazawa Kazuki; Kobayashi Yoji; Kageyama ...
The Journal of Physical Chemistry C/125(7)/pp.3948-3960, 2021-02
Mechanical Control of Molecular Conductance and Diradical Character in Bond Stretching and π-Stack Compression
Tsuji Yuta; Okazawa Kazuki; Chen Bo; Yoshizawa Kazunari
The Journal of Physical Chemistry C/124(42)/pp.22941-22958, 2020-09
Graph Theoretical Study on the Conductivity of Single-Molecular Junctions Containing Heteroatoms
岡澤一樹; 辻雄太; 吉澤一成
Journal of Computer Chemistry, Japan/19(4)/pp.158-160, 2020
CiNii
Understanding Single-Molecule Parallel Circuits on the Basis of Frontier Orbital Theory
Okazawa Kazuki; Tsuji Yuta; Yoshizawa Kazunari
The Journal of Physical Chemistry C/124(5)/pp.3322-3331, 2020-01
Time-resolved infrared study of photo-induced ring-closure reaction of trans-2-hydroxychalcone
Kondoh Masato; Takizawa Chinatsu; Okazawa Kazuki; Akas...
Journal of Photochemistry and Photobiology A: Chemistry/389/p.112280, 2019-12
Photo-Induced Ring-Opening Reaction of Flav-3-en-2-ol Monitored by Time-Resolved Infrared Spectroscopy
Masato Kondoh; Sakuta Akira; Okazawa Kazuki; Akase Da...
Journal of Physical Chemistry B/123(40)/pp.8499-8504, 2019-10
PubMed
Theoretical Study on the Relation between the Frontier Orbital and the Conductance in Aromatic Single-Molecular Parallel Circuits
岡澤一樹; 辻雄太; 吉澤一成
Journal of Computer Chemistry, Japan/18(5)/pp.227-229, 2019
CiNii

Professional activities


2024-04 -- 2024-05	Japan Society for Theoretical Chemistry	第26回理論化学討論会実行委員

(Last updated: 2024-04-19)