Takao Tsuneda - Search Results

Year	Number of Results
2003	1
2004	1
2005	3
2006	2
2007	3
2008	3
2009	1
2010	5
2011	2
2012	2
2013	3
2014	2
2016	1
2017	2
2018	5
2019	4
2020	6
2021	2
2022	4
2023	3
2024	3

1

Singlet fission initiating organic photosensitizations.

Tsuneda T, Taketsugu T. Tsuneda T, et al. Sci Rep. 2024 Jan 8;14(1):829. doi: 10.1038/s41598-023-50860-4. Sci Rep. 2024. PMID: 38191637 Free PMC article.

2

Density Functional Theory as a Data Science.

Tsuneda T. Tsuneda T. Chem Rec. 2020 Jul;20(7):618-639. doi: 10.1002/tcr.201900081. Epub 2019 Dec 13. Chem Rec. 2020. PMID: 31833636 Review.

3

Roles of Singlet Fission in the Photosensitization of Silicon Phthalocyanine.

Tsuneda T, Taketsugu T. Tsuneda T, et al. J Phys Chem Lett. 2023 Dec 28;14(51):11587-11596. doi: 10.1021/acs.jpclett.3c02921. Epub 2023 Dec 15. J Phys Chem Lett. 2023. PMID: 38100084

4

Water-oxidation mechanism of cobalt phosphate co-catalyst in artificial photosynthesis: a theoretical study.

Tsuneda T, Ten-No SL. Tsuneda T, et al. Phys Chem Chem Phys. 2022 Feb 16;24(7):4674-4682. doi: 10.1039/d1cp05816a. Phys Chem Chem Phys. 2022. PMID: 35134101 Free article.

5

Reply to the 'Comment on "Theoretical investigations on hydrogen peroxide decomposition in aquo"' by W. H. Koppenol, Phys. Chem. Chem. Phys., 2021, 23, DOI: 10.1039/D1CP03545B.

Tsuneda T, Taketsugu T. Tsuneda T, et al. Phys Chem Chem Phys. 2021 Nov 24;23(45):26006-26008. doi: 10.1039/d1cp04003k. Phys Chem Chem Phys. 2021. PMID: 34766606

6

One-to-One Correspondence between Reaction Pathways and Reactive Orbitals.

Hasebe M, Tsutsumi T, Taketsugu T, Tsuneda T. Hasebe M, et al. Among authors: tsuneda t. J Chem Theory Comput. 2021 Nov 9;17(11):6901-6909. doi: 10.1021/acs.jctc.1c00693. Epub 2021 Oct 25. J Chem Theory Comput. 2021. PMID: 34694803

7

Unveiling the Nature of Chemical Bonds in Real Space.

Hara T, Hasebe M, Tsuneda T, Naito T, Nakamura Y, Katayama N, Taketsugu T, Sawa H. Hara T, et al. Among authors: tsuneda t. J Am Chem Soc. 2024 Aug 28;146(34):23825-23830. doi: 10.1021/jacs.4c05673. Epub 2024 Jul 17. J Am Chem Soc. 2024. PMID: 39021088

8

Synthesis and Synthetic Application of Chloro- and Bromofuroxans.

Matsubara R, Ando A, Hasebe H, Kim H, Tsuneda T, Hayashi M. Matsubara R, et al. Among authors: tsuneda t. J Org Chem. 2020 May 1;85(9):5959-5972. doi: 10.1021/acs.joc.0c00326. Epub 2020 Apr 13. J Org Chem. 2020. PMID: 32242666

9

Total and orbital density-based analyses of molecules revealing long-range interaction regions.

Hasebe M, Tsutsumi T, Taketsugu T, Tsuneda T. Hasebe M, et al. Among authors: tsuneda t. J Comput Chem. 2023 Dec 5;44(31):2391-2403. doi: 10.1002/jcc.27204. Epub 2023 Sep 1. J Comput Chem. 2023. PMID: 37658482

10

A dual-level state-specific time-dependent density-functional theory.

Tokura S, Sato T, Tsuneda T, Nakajima T, Hirao K. Tokura S, et al. Among authors: tsuneda t. J Comput Chem. 2008 Jun;29(8):1187-97. doi: 10.1002/jcc.20871. J Comput Chem. 2008. PMID: 18161684

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