Molecular Insights into the Mechanical Properties of Polymer–Fullerene Bulk Heterojunctions for Organic Photovoltaic Applications

Yuta Yoshimoto,Sou Sugiyama,Shuntaro Shimada,Toshihiro Kaneko,Shu Takagi,Ikuya Kinefuchi

Molecular Insights into the Mechanical Properties of Polymer–Fullerene Bulk Heterojunctions for Organic Photovoltaic Applications

2021

Yuta Yoshimoto
Sou Sugiyama
Shuntaro Shimada
Toshihiro Kaneko
Shu Takagi
Ikuya Kinefuchi

We investigate the mechanical properties of π-conjugated polymeric materials composed of regioregular poly(3-hexylthiophene) (P3HT) and fullerene C60 using coarse-grained molecular dynamics simulat...

Keywords:

Molecular dynamics
Nanotechnology
Fullerene
Heterojunction
Materials science
Photovoltaic system
Polymer

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