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4 results in Authors: Mikiya Fujii

Theoretical and Computational Chemistry

Proposal of an Approach to Explore Photocatalysts by Two-stage Machine Learning Model

Wataru Takahara, Ryuto Baba, Yosuke Harashima, Tomoaki Takayama, Shogo Takasuka, Yuichi Yamaguchi, Akihiko Kudo, Mikiya Fujii

Version 1 posted 30 July 2024

154

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Physical Chemistry

Hot dissociation, hole shrinkage, and hole re-delocalization in P3HT/PCBM organic photovoltaics

Mikiya Fujii, Hiroaki Benten, Shohei Koda, Eisuke Kawashima, Kohei Yamamoto, Seira Hoshino, Kenji Mishima, Hideo Ohkita, Koichi Yamashita

Version 1 posted 26 December 2023

172

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Materials Chemistry

Bayesian optimization of radical polymerization reactions in a flow synthesis system

Shogo Takasuka, Sho Ito, Shunto Oikawa, Yosuke Harashima, Tomoaki Takayama, Aniruddha Nag, Araki Wakiuchi, Tsuyoshi Ando, Tetsunori Sugawara, Miho Hatanaka, Tomoyuki Miyao, Takamitsu Matsubara, Yu-ya Ohnishi, Hiroharu Ajiro, Mikiya Fujii

Version 2 posted 05 April 2024

507

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Theoretical and Computational Chemistry

CopDDB: a descriptor database for copolymers and its applications to machine learning

Takayoshi Yoshimura, Hiromoto Kato, Shunto Oikawa, Taichi Inagaki, Shigehito Asano, Tetsunori Sugawara, Tomonori Miyao, Takamitsu Matsubara, Hiroharu Ajiro, Mikiya Fujii, Yu-ya Ohnishi, Miho Hatanaka

Version 2 posted 16 August 2024

491

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