De Angelis F - Search Results

1

New [(D-terpyridine)-Ru-(D or A-terpyridine)][4-EtPhCO2]2 complexes (D = electron donor group; A = electron acceptor group) as active second-order non linear optical chromophores.

Colombo A, Locatelli D, Roberto D, Tessore F, Ugo R, Cavazzini M, Quici S, De Angelis F, Fantacci S, Ledoux-Rak I, Tancrez N, Zyss J. Colombo A, et al. Among authors: de angelis f. Dalton Trans. 2012 Jun 14;41(22):6707-14. doi: 10.1039/c2dt30183k. Epub 2012 Apr 17. Dalton Trans. 2012. PMID: 22508154

2

Absorption spectrum and solvatochromism of the [Ru(4,4'-COOH-2,2'-bpy)2(NCS)2] molecular dye by time dependent density functional theory.

Fantacci S, De Angelis F, Selloni A. Fantacci S, et al. Among authors: de angelis f. J Am Chem Soc. 2003 Apr 9;125(14):4381-7. doi: 10.1021/ja0207910. J Am Chem Soc. 2003. PMID: 12670263

3

A combined computational and experimental study of polynuclear Ru-TPPZ complexes: insight into the electronic and optical properties of coordination polymers.

Fantacci S, De Angelis F, Wang J, Bernhard S, Selloni A. Fantacci S, et al. Among authors: de angelis f. J Am Chem Soc. 2004 Aug 11;126(31):9715-23. doi: 10.1021/ja048421u. J Am Chem Soc. 2004. PMID: 15291575

4

Mechanism of the initial conformational transition of a photomodulable peptide.

Andruniów T, Fantacci S, De Angelis F, Ferré N, Olivucci M. Andruniów T, et al. Among authors: de angelis f. Angew Chem Int Ed Engl. 2005 Sep 19;44(37):6077-81. doi: 10.1002/anie.200501145. Angew Chem Int Ed Engl. 2005. PMID: 16108079 No abstract available.

5

Photophysical properties of [Ru(phen)2(dppz)]2+ intercalated into DNA: an integrated Car-Parrinello and TDDFT study.

Fantacci S, De Angelis F, Sgamellotti A, Marrone A, Re N. Fantacci S, et al. Among authors: de angelis f. J Am Chem Soc. 2005 Oct 19;127(41):14144-5. doi: 10.1021/ja054368d. J Am Chem Soc. 2005. PMID: 16218583

6

The unexpected similar second-order NLO response for nearly planar and largely twisted push-pull stilbazole chromophores: EFISH and theoretical TD-DFT evidence.

Locatelli D, Quici S, Roberto D, De Angelis F. Locatelli D, et al. Among authors: de angelis f. Chem Commun (Camb). 2005 Nov 21;(43):5405-7. doi: 10.1039/b509258b. Epub 2005 Oct 4. Chem Commun (Camb). 2005. PMID: 16261228

7

Terpyridine Zn(II), Ru(III), and Ir(III) complexes: the relevant role of the nature of the metal ion and of the ancillary ligands on the second-order nonlinear response of terpyridines carrying electron donor or electron acceptor groups.

Tessore F, Roberto D, Ugo R, Pizzotti M, Quici S, Cavazzini M, Bruni S, De Angelis F. Tessore F, et al. Among authors: de angelis f. Inorg Chem. 2005 Nov 28;44(24):8967-78. doi: 10.1021/ic050975q. Inorg Chem. 2005. PMID: 16296852

8

A time-dependent density functional theory investigation on the nature of the electronic transitions involved in the nonlinear optical response of [Ru(CF3CO2)3T] (T = 4'-(C6H4-p-NBu2)-2,2':6',2''-terpyridine).

De Angelis F, Fantacci S, Sgamelotti A, Cariati F, Roberto D, Tessore F, Ugo R. De Angelis F, et al. Dalton Trans. 2006 Feb 14;(6):852-9. doi: 10.1039/b509123c. Epub 2005 Nov 7. Dalton Trans. 2006. PMID: 16437181

9

Synthesis, characterization, and DFT-TDDFT computational study of a ruthenium complex containing a functionalized tetradentate ligand.

Barolo C, Nazeeruddin MK, Fantacci S, Di Censo D, Comte P, Liska P, Viscardi G, Quagliotto P, De Angelis F, Ito S, Grätzel M. Barolo C, et al. Among authors: de angelis f. Inorg Chem. 2006 Jun 12;45(12):4642-53. doi: 10.1021/ic051970w. Inorg Chem. 2006. PMID: 16749827

10

Electronic transitions involved in the absorption spectrum and dual luminescence of tetranuclear cubane [Cu4I4(pyridine)4] cluster: a density functional theory/time-dependent density functional theory investigation.

De Angelis F, Fantacci S, Sgamellotti A, Cariati E, Ugo R, Ford PC. De Angelis F, et al. Inorg Chem. 2006 Dec 25;45(26):10576-84. doi: 10.1021/ic061147f. Inorg Chem. 2006. PMID: 17173412

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