Okada K - Search Results

1

Theoretical Study on Singlet Fission Dynamics and Triplet Migration Process in Symmetric Heterotrimer Models.

Miyamoto H, Okada K, Tada K, Kishi R, Kitagawa Y. Miyamoto H, et al. Among authors: okada k. Molecules. 2024 Nov 19;29(22):5449. doi: 10.3390/molecules29225449. Molecules. 2024. PMID: 39598837 Free PMC article.

2

Evaluation of Aromaticity for Open-Shell Singlet Dicyclopenta-Fused Acenes and Polyacenes Based on a Magnetically Induced Current.

Nagami T, Fujiyoshi JY, Tonami T, Watanabe KI, Yamane M, Okada K, Kishi R, Nakano M, Champagne B, Liégeois V. Nagami T, et al. Among authors: okada k. Chemistry. 2018 Sep 12;24(51):13457-13466. doi: 10.1002/chem.201802696. Epub 2018 Aug 29. Chemistry. 2018. PMID: 29985530

3

Theoretical Study on Open-Shell Singlet Character and Second Hyperpolarizabilities in Cofacial π-Stacked Dimers Composed of Weak Open-Shell Antiaromatic Porphyrins.

Fujiyoshi JY, Tonami T, Yamane M, Okada K, Kishi R, Muhammad S, Al-Sehemi AG, Nozawa R, Shinokubo H, Nakano M. Fujiyoshi JY, et al. Among authors: okada k. Chemphyschem. 2018 Nov 5;19(21):2863-2871. doi: 10.1002/cphc.201800745. Epub 2018 Sep 20. Chemphyschem. 2018. PMID: 30080316

4

Quantum Master Equation Approach to Singlet Fission Dynamics in Pentacene Linear Aggregate Models: Size Dependences of Excitonic Coupling Effects.

Nakano M, Nagami T, Tonami T, Okada K, Ito S, Kishi R, Kitagawa Y, Kubo T. Nakano M, et al. Among authors: okada k. J Comput Chem. 2019 Jan 5;40(1):89-104. doi: 10.1002/jcc.25539. Epub 2018 Sep 18. J Comput Chem. 2019. PMID: 30226650

5

Monte Carlo Wavefunction Approach to Singlet Fission Dynamics of Molecular Aggregates.

Nakano M, Okada K, Nagami T, Tonami T, Kishi R, Kitagawa Y. Nakano M, et al. Among authors: okada k. Molecules. 2019 Feb 1;24(3):541. doi: 10.3390/molecules24030541. Molecules. 2019. PMID: 30717244 Free PMC article.

6

Theoretical Molecular Design of Phenanthrenes for Singlet Fission by Diazadibora-Substitution.

Nagami T, Miyamoto H, Yoshida W, Okada K, Tonami T, Nakano M. Nagami T, et al. Among authors: okada k. J Phys Chem A. 2020 Aug 27;124(34):6778-6789. doi: 10.1021/acs.jpca.0c05359. Epub 2020 Aug 18. J Phys Chem A. 2020. PMID: 32786996

7

Quantum design for singlet-fission-induced nonlinear optical systems: Effects of π-conjugation length and molecular packing of butterfly-shaped acenes.

Tonami T, Nagami T, Okada K, Yoshida W, Miyamoto H, Nakano M. Tonami T, et al. Among authors: okada k. J Chem Phys. 2020 Aug 28;153(8):084304. doi: 10.1063/5.0013985. J Chem Phys. 2020. PMID: 32872890

8

Vibronic coupling density analysis and quantum dynamics simulation for singlet fission in pentacene and its halogenated derivatives.

Nagami T, Tonami T, Okada K, Yoshida W, Miyamoto H, Nakano M. Nagami T, et al. Among authors: okada k. J Chem Phys. 2020 Oct 7;153(13):134302. doi: 10.1063/5.0024746. J Chem Phys. 2020. PMID: 33032409

9

Theoretical Study on Singlet Fission in Aromatic Diaza s-Indacene Dimers.

Nagami T, Sugimori R, Sakai R, Okada K, Nakano M. Nagami T, et al. Among authors: okada k. J Phys Chem A. 2021 Apr 29;125(16):3257-3267. doi: 10.1021/acs.jpca.0c11598. Epub 2021 Apr 9. J Phys Chem A. 2021. PMID: 33834780

10

Theoretical Study on Singlet Fission Dynamics in Slip-Stack-like Pentacene Ring-Shaped Aggregate Models.

Miyamoto H, Okada K, Tokuyama K, Nakano M. Miyamoto H, et al. Among authors: okada k. J Phys Chem A. 2021 Jul 1;125(25):5585-5600. doi: 10.1021/acs.jpca.1c03934. Epub 2021 Jun 18. J Phys Chem A. 2021. PMID: 34142826

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