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Items: 1 to 20 of 115

1.

Quantum master equation approach to singlet fission dynamics in pentacene ring-shaped aggregate models.

Nakano M.

J Chem Phys. 2019 Jun 21;150(23):234305. doi: 10.1063/1.5100116.

PMID:
31228908
2.
3.

Near-infrared absorption by intramolecular charge-transfer transition in 5,10,15,20-tetra(N-carbazolyl)porphyrin through protonation.

Kawano SI, Kawada S, Kitagawa Y, Teramoto R, Nakano M, Tanaka K.

Chem Commun (Camb). 2019 Mar 5;55(20):2992-2995. doi: 10.1039/c8cc09667h.

PMID:
30785132
4.

A Tetrasilicon Analogue of Bicyclo[1.1.0]but-1(3)-ene Containing a Si=Si Double Bond with an Inverted Geometry.

Iwamoto T, Abe T, Sugimoto K, Hashizume D, Matsui H, Kishi R, Nakano M, Ishida S.

Angew Chem Int Ed Engl. 2019 Mar 22;58(13):4371-4375. doi: 10.1002/anie.201900824. Epub 2019 Feb 21.

PMID:
30720237
5.

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

Nakano M, Okada K, Nagami T, Tonami T, Kishi R, Kitagawa Y.

Molecules. 2019 Feb 1;24(3). pii: E541. doi: 10.3390/molecules24030541.

6.

A Phosphorus Analogue of p-Quinodimethane with a Planar P4 Ring: A Metal-Free Diphosphorus Source.

Rottschäfer D, Neumann B, Stammler HG, Kishi R, Nakano M, Ghadwal RS.

Chemistry. 2019 Mar 1;25(13):3244-3247. doi: 10.1002/chem.201805932. Epub 2019 Feb 4.

PMID:
30716177
7.

Enhancement of Antiaromatic Character via Additional Benzoannulation into Dibenzo[ a, f]pentalene: Syntheses and Properties of Benzo[ a]naphtho[2,1- f]pentalene and Dinaphtho[2,1- a, f]pentalene.

Konishi A, Okada Y, Kishi R, Nakano M, Yasuda M.

J Am Chem Soc. 2019 Jan 9;141(1):560-571. doi: 10.1021/jacs.8b11530. Epub 2018 Dec 21.

PMID:
30525568
8.

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.

J Comput Chem. 2019 Jan 5;40(1):89-104. doi: 10.1002/jcc.25539. Epub 2018 Sep 18.

PMID:
30226650
9.

Thiophene and its sulfur inhibit indenoindenodibenzothiophene diradicals from low-energy lying thermal triplets.

Dressler JJ, Teraoka M, Espejo GL, Kishi R, Takamuku S, Gómez-García CJ, Zakharov LN, Nakano M, Casado J, Haley MM.

Nat Chem. 2018 Nov;10(11):1134-1140. doi: 10.1038/s41557-018-0133-5. Epub 2018 Sep 17.

PMID:
30224686
10.

Diradical Character Enhancement by Spacing: N-Heterocyclic Carbene Analogues of Müller's Hydrocarbon.

Rottschäfer D, Busch J, Neumann B, Stammler HG, van Gastel M, Kishi R, Nakano M, Ghadwal RS.

Chemistry. 2018 Nov 7;24(62):16537-16542. doi: 10.1002/chem.201804524. Epub 2018 Oct 18.

PMID:
30187988
11.

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.

Chemphyschem. 2018 Nov 5;19(21):2863-2871. doi: 10.1002/cphc.201800745. Epub 2018 Sep 20.

PMID:
30080316
12.

Intermolecular Packing Effects on Singlet Fission in Oligorylene Dimers.

Nagami T, Ito S, Kubo T, Nakano M.

ACS Omega. 2017 Aug 31;2(8):5095-5103. doi: 10.1021/acsomega.7b00655. Epub 2017 Aug 29.

13.

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.

Chemistry. 2018 Sep 12;24(51):13457-13466. doi: 10.1002/chem.201802696. Epub 2018 Aug 29.

PMID:
29985530
14.

Exploring the novel donor-nanotube archetype as an efficient third-order nonlinear optical material: asymmetric open-shell carbon nanotubes.

Muhammad S, Nakano M, Al-Sehemi AG, Irfan A, Chaudhry AR, Tonami T, Ito S, Kishi R, Kitagawa Y.

Nanoscale. 2018 Sep 13;10(35):16499-16507. doi: 10.1039/c8nr03009j.

PMID:
29872826
15.

Multistep thermal decomposition of granular sodium perborate tetrahydrate: a kinetic approach to complex reactions in solid-gas systems.

Koga N, Kameno N, Tsuboi Y, Fujiwara T, Nakano M, Nishikawa K, Iwasaki Murata A.

Phys Chem Chem Phys. 2018 May 9;20(18):12557-12573. doi: 10.1039/c8cp01138a.

PMID:
29693102
16.

Open-Shell Character Dependences of the Second Hyperpolarizability in Two-Dimensional Tetraradicaloids.

Matsui H, Ito S, Nakano M.

J Phys Chem A. 2018 Apr 12;122(14):3680-3687. doi: 10.1021/acs.jpca.7b12456. Epub 2018 Mar 30.

PMID:
29562122
17.

Quantum Chemical Design Guidelines for Absorption and Emission Color Tuning of fac-Ir(ppy)₃ Complexes.

Natori Y, Kitagawa Y, Aoki S, Teramoto R, Tada H, Era I, Nakano M.

Molecules. 2018 Mar 5;23(3). pii: E577. doi: 10.3390/molecules23030577.

18.

Benzonorcorrole NiII Complexes: Enhancement of Paratropic Ring Current and Singlet Diradical Character by Benzo-Fusion.

Yoshida T, Takahashi K, Ide Y, Kishi R, Fujiyoshi JY, Lee S, Hiraoka Y, Kim D, Nakano M, Ikeue T, Yamada H, Shinokubo H.

Angew Chem Int Ed Engl. 2018 Feb 19;57(8):2209-2213. doi: 10.1002/anie.201712961. Epub 2018 Jan 24.

PMID:
29327805
19.

Tunability of Open-Shell Character, Charge Asymmetry, and Third-Order Nonlinear Optical Properties of Covalently Linked (Hetero)Phenalenyl Dimers.

Minamida Y, Kishi R, Fukuda K, Matsui H, Takamuku S, Yamane M, Tonami T, Nakano M.

Chemistry. 2018 Feb 6;24(8):1913-1921. doi: 10.1002/chem.201704679. Epub 2018 Jan 5.

PMID:
29193349
20.

Synthesis of the Unknown Indeno[1,2-a]fluorene Regioisomer: Crystallographic Characterization of Its Dianion.

Dressler JJ, Zhou Z, Marshall JL, Kishi R, Takamuku S, Wei Z, Spisak SN, Nakano M, Petrukhina MA, Haley MM.

Angew Chem Int Ed Engl. 2017 Nov 27;56(48):15363-15367. doi: 10.1002/anie.201709282. Epub 2017 Oct 24.

PMID:
28985444

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