岡澤一樹(オカザワカズキ)

所属

計算科学研究センター

職名

助教

ORCID

職歴


2024-04 -- (現在)	筑波大学計算科学研究センター助教
2023-04 -- 2024-03	日本学術振興会特別研究員（DC2）

取得学位


2024-03	博士（工学）	九州大学

所属学協会


2022-04 -- (現在)	理論化学会
2019-11 -- (現在)	日本化学会
2019-04 -- (現在)	分子科学会

受賞


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

論文

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
日本コンピュータ化学会, 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
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
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
芳香族単分子並列回路の電気伝導度とフロンティア軌道の関係
岡澤一樹; 辻雄太; 吉澤一成
Journal of Computer Chemistry, Japan/18(5)/pp.227-229, 2019
CiNii

学協会等委員


2024-04 -- 2024-05	理論化学会	第26回理論化学討論会実行委員

(最終更新日: 2024-04-19)

岡澤 一樹(オカザワ カズキ)

岡澤一樹(オカザワカズキ)