Research field (3)：
Nano/micro-systems
, Nanostructure physics
, Basic physical chemistry
Research keywords (1)：
電子状態・理論化学・計算科学・物理化学・化学物理
Research theme for competitive and other funds (1)：
2021 - 2023 有機薄膜太陽電池界面における電荷移動型エキシトンの解離と動的過程
Papers (34)：
Aiko Anzai, Yuzuru Kurosaki, Morihisa Saeki, Azusa Muraoka. A DFT study on photodissociation of the palladium tetrachloride anion PdCl42- in solution. Chemical Physics. 2024. 579. 112182-112182
Sumire Ikeyama, Azusa Muraoka. Influence of vibronic interaction of charge transfer excitons in PTB7/BTA-based nonfullerene organic solar cells. The Journal of Chemical Physics. 2023
Masanori Kaneko, Ayane Suzaki, Azusa Muraoka, Kazuma Gotoh, Koichi Yamashita. Neural network to predict 23Na NMR spectra of Nan clusters. Journal of Materials Informatics. 2023. 3. 2. 8-8
Narumi FUJIWARA, Koichi YAMASHITA, Azusa MURAOKA. Theoretical Study on the Reaction Mechanism of the Water-Splitting Process on Cobalt Oxide Catalysts. Journal of Computer Chemistry, Japan. 2022. 21. 2. 45-47
Yuika BABA, Hidehiro SAKURAI, Azusa MURAOKA. Structural Symmetry and Spin Multiplicity of Sumanene Derivative Radical Molecules. Journal of Computer Chemistry, Japan. 2022. 21. 2. 55-57
Azusa Muraoka, Hiroshi Ushiyama, Koichi Yamashita. Helical inversion reaction pathways for ortho-phenylenes by DFT method. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY. 2013. 246
Lectures and oral presentations (133)：
theoretical study on Processes of Charge Transfer Excitons at the Interface of Organic Solar Cells
(2023)
Dynamic processes of charge-transfer excitons at the donoracceptor interface of organic thin-film solar cells
(103rd CSJ Annual Meeting (2023) 2023)
Machine learning for donor material exploration in fullerene-based organic thin-film solar cells
(IPEROP23 2023)
First-principles calculations of defect structures in Sn perovskite solar cell materials
(IPEROP23 2023)
First-Principles Study of Ge Alloying in CsSnI3 Perovskite Solar Cells Materials and their Defects Structures
(IPEROP23 2023)
Amrican Chemical Society
, The Chemical Society of Japan
, The Japan Society of Applied Physics
, American Physical Society
, Japan Society of Molecular Science
