Molecular design for efficient singlet fission S Ito, T Nagami, M Nakano Journal of Photochemistry and Photobiology C: Photochemistry Reviews 34, 85-120, 2018 | 131 | 2018 |
Fundamental of diradical-character-based molecular design for singlet fission T Minami, S Ito, M Nakano The Journal of Physical Chemistry Letters 4 (13), 2133-2137, 2013 | 126 | 2013 |
Diradical Character Based Design for Singlet Fission of Condensed-Ring Systems with 4nπ Electrons S Ito, T Minami, M Nakano The Journal of Physical Chemistry C 116 (37), 19729-19736, 2012 | 103 | 2012 |
Theoretical study of singlet fission in oligorylenes T Minami, S Ito, M Nakano The journal of physical chemistry letters 3 (18), 2719-2723, 2012 | 102 | 2012 |
Role of a singlet diradical character in carbon nanomaterials: a novel hot spot for efficient nonlinear optical materials S Muhammad, M Nakano, AG Al-Sehemi, Y Kitagawa, A Irfan, ... Nanoscale 8 (42), 17998-18020, 2016 | 90 | 2016 |
Biphenalenylidene: isolation and characterization of the reactive intermediate on the decomposition pathway of phenalenyl radical K Uchida, S Ito, M Nakano, M Abe, T Kubo Journal of the American Chemical Society 138 (7), 2399-2410, 2016 | 73 | 2016 |
Theoretical molecular design of heteroacenes for singlet fission: Tuning the diradical character by modifying π-conjugation length and aromaticity S Ito, M Nakano The Journal of Physical Chemistry C 119 (1), 148-157, 2015 | 71 | 2015 |
Design principles of electronic couplings for intramolecular singlet fission in covalently-linked systems S Ito, T Nagami, M Nakano The Journal of Physical Chemistry A 120 (31), 6236-6241, 2016 | 58 | 2016 |
Density analysis of intra-and intermolecular vibronic couplings toward bath engineering for singlet fission S Ito, T Nagami, M Nakano The journal of physical chemistry letters 6 (24), 4972-4977, 2015 | 52 | 2015 |
Quantum master equation approach to singlet fission dynamics of realistic/artificial pentacene dimer models: relative relaxation factor analysis M Nakano, S Ito, T Nagami, Y Kitagawa, T Kubo The Journal of Physical Chemistry C 120 (40), 22803-22815, 2016 | 47 | 2016 |
Signature of singlet open-shell character on the optically allowed singlet excitation energy and singlet–triplet energy gap T Minami, S Ito, M Nakano The Journal of Physical Chemistry A 117 (9), 2000-2006, 2013 | 46 | 2013 |
Diradical character-based design for singlet fission of bisanthene derivatives: aromatic-ring attachment and π-plane twisting S Ito, T Nagami, M Nakano The journal of physical chemistry letters 7 (19), 3925-3930, 2016 | 42 | 2016 |
Intermolecular packing effects on singlet fission in oligorylene dimers T Nagami, S Ito, T Kubo, M Nakano ACS omega 2 (8), 5095-5103, 2017 | 38 | 2017 |
Exploring the novel donor-nanotube archetype as an efficient third-order nonlinear optical material: asymmetric open-shell carbon nanotubes S Muhammad, M Nakano, AG Al-Sehemi, A Irfan, AR Chaudhry, T Tonami, ... Nanoscale 10 (35), 16499-16507, 2018 | 37 | 2018 |
Singlet fission in pancake-bonded systems S Ito, T Nagami, M Nakano Physical Chemistry Chemical Physics 19 (8), 5737-5745, 2017 | 29 | 2017 |
Functional dependence of excitation energy for pentacene/C60 model complex in the nonempirically tuned long‐range corrected density functional theory T Minami, S Ito, M Nakano International Journal of Quantum Chemistry 113 (3), 252-256, 2013 | 29 | 2013 |
Quantum master equation approach to singlet fission dynamics in pentacene linear aggregate models: Size dependences of excitonic coupling effects M Nakano, T Nagami, T Tonami, K Okada, S Ito, R Kishi, Y Kitagawa, ... Journal of Computational Chemistry 40 (1), 89-104, 2019 | 26 | 2019 |
Diradical and ionic characters of open-shell singlet molecular systems M Nakano, K Fukuda, S Ito, H Matsui, T Nagami, S Takamuku, Y Kitagawa, ... The Journal of Physical Chemistry A 121 (4), 861-873, 2017 | 25 | 2017 |
Enhancement of the third-order nonlinear optical properties in open-shell singlet transition-metal dinuclear systems: effects of the group, of the period, and of the charge of … H Fukui, Y Inoue, T Yamada, S Ito, Y Shigeta, R Kishi, B Champagne, ... The Journal of Physical Chemistry A 116 (22), 5501-5509, 2012 | 24 | 2012 |
Diradical character and nonlinear optical properties of buckyferrocenes: focusing on the use of suitably modified fullerene fragments S Muhammad, S Ito, M Nakano, R Kishi, K Yoneda, Y Kitagawa, M Shkir, ... Physical Chemistry Chemical Physics 17 (8), 5805-5816, 2015 | 23 | 2015 |