Computational Exploration of Polymer Mechanochemistry: Quantitation of Activation Force and Systematic Discovery of Reaction Sites by the Extended Artificial Force-Induced Reaction Method

J Julong Jiang (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)) K Koji Kubota (Division of Applied Chemistry, Graduate School of Engineering) Y Yu Harabuchi (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)) M Mingoo Jin (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)) Z Zhi Jian Wang (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)) T Tasuku Nakajima (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)) H Hajime Ito (Division of Applied Chemistry, Graduate School of Engineering) J Jian Ping Gong S Satoshi Maeda (Institute for Chemical Reaction Design and Discovery (WPI-ICReDD))

Article Details

Volume / Issue Vol. 147, Issue 36
Published September 10, 2025
Pages 32502-32521
ISSN 0002-7863
Publisher American Chemical Society

Journal Info

Journal of the American Chemical Society

American Chemical Society

ISSN: 0002-7863 Physical Sciences

Authors (9)

J

Julong Jiang

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)

K

Koji Kubota

Division of Applied Chemistry, Graduate School of Engineering

Y

Yu Harabuchi

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)

M

Mingoo Jin

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)

Z

Zhi Jian Wang

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)

T

Tasuku Nakajima

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)

H

Hajime Ito

Division of Applied Chemistry, Graduate School of Engineering

J

Jian Ping Gong

S

Satoshi Maeda

Institute for Chemical Reaction Design and Discovery (WPI-ICReDD)