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The Journal of Physical Chemistry. B|November 9, 2023
Ion-Type Dependence of DNA Electronic Excitation in Water under Proton, α-Particle, and Carbon Ion Irradiation: A First-Principles Simulation StudyChristopher Shepard, Yosuke KanaiPhysical Chemistry Chemical Physics : PCCP|May 1, 2018
Dependence of hot electron transfer on surface coverage and adsorbate species at semiconductor-molecule interfacesLesheng Li, Yosuke KanaiJournal of Chemical Theory and Computation|December 29, 2017
Free Energy Profile of NaCl in Water: First-Principles Molecular Dynamics with SCAN and ωB97X-V Exchange-Correlation FunctionalsYi Yao, Yosuke KanaiJournal of the American Chemical Society|November 28, 2012
Role of four-fold coordinated titanium and quantum confinement in CO2 reduction at titania surfaceDonghwa Lee, Yosuke KanaiThe Journal of Physical Chemistry Letters|April 5, 2016
Excited Electron Dynamics at Semiconductor-Molecule Type-II Heterojunction Interface: First-Principles Dynamics SimulationLesheng Li, Yosuke KanaiPhysical Chemistry Chemical Physics : PCCP|February 17, 2022
Nonlinear electronic excitation in water under proton irradiation: a first principles studyChristopher Shepard, Yosuke KanaiJournal of the American Chemical Society|March 14, 2019
Electronic Excitation Dynamics in DNA under Proton and α-Particle IrradiationDillon C Yost, Yosuke KanaiNano Letters|February 23, 2008
Role of semiconducting and metallic tubes in P3HT/carbon-nanotube photovoltaic heterojunctions: density functional theory calculationsYosuke Kanai, Jeffrey C GrossmanChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|September 8, 2021
First Principles Dynamics Study of Excited Hole Relaxation in DNAJian Cheng Wong, Yosuke KanaiNano Letters|June 6, 2007
Insights on interfacial charge transfer across P3HT/fullerene photovoltaic heterojunction from Ab initio calculationsYosuke Kanai, Jeffrey C GrossmanPageof 9