Andrés J - Search Results

1

Selective Synthesis of α-, β-, and γ-Ag₂WO₄ Polymorphs: Promising Platforms for Photocatalytic and Antibacterial Materials.

Alvarez-Roca R, Gouveia AF, de Foggi CC, Lemos PS, Gracia L, da Silva LF, Vergani CE, San-Miguel M, Longo E, Andrés J. Alvarez-Roca R, et al. Among authors: andres j. Inorg Chem. 2021 Jan 18;60(2):1062-1079. doi: 10.1021/acs.inorgchem.0c03186. Epub 2020 Dec 29. Inorg Chem. 2021. PMID: 33372756

2

Molecular structure of the molybdenum oxo-diperoxo compound MoO(O(2))(2)(OPy)(H(2)O): a computational and X-ray study.

Sensato FR, Cass QB, Longo E, Zukerman-Schpector J, Custodio R, Andrés J, Hernandes MZ, Longo RL. Sensato FR, et al. Among authors: andres j. Inorg Chem. 2001 Nov 5;40(23):6022-5. doi: 10.1021/ic010020h. Inorg Chem. 2001. PMID: 11681920

3

Sulfide and sulfoxide oxidations by mono- and diperoxo complexes of molybdenum. A density functional study.

Sensato FR, Custodio R, Longo E, Safont VS, Andres J. Sensato FR, et al. Among authors: andres j. J Org Chem. 2003 Jul 25;68(15):5870-4. doi: 10.1021/jo034261d. J Org Chem. 2003. PMID: 12868919

4

Density functional theory study of the brookite surfaces and phase transitions between natural titania polymorphs.

Beltrán A, Gracia L, Andrés J. Beltrán A, et al. Among authors: andres j. J Phys Chem B. 2006 Nov 23;110(46):23417-23. doi: 10.1021/jp0643000. J Phys Chem B. 2006. PMID: 17107193

5

Combined theoretical and experimental analysis of the bonding in the heterobimetallic cubane-type Mo(3)NiS(4) and Mo(3)CuS(4) core clusters.

Andrés J, Feliz M, Fraxedas J, Hernandez V, López-Navarrete JT, Llusar R, Sauthier G, Sensato FR, Silvi B, Bo C, Campanera JM. Andrés J, et al. Inorg Chem. 2007 Mar 19;46(6):2159-66. doi: 10.1021/ic061853g. Epub 2007 Feb 16. Inorg Chem. 2007. PMID: 17302404

6

Characterization of the high-pressure structures and phase transformations in SnO2. A density functional theory study.

Gracia L, Beltrán A, Andrés J. Gracia L, et al. Among authors: andres j. J Phys Chem B. 2007 Jun 14;111(23):6479-85. doi: 10.1021/jp067443v. Epub 2007 May 22. J Phys Chem B. 2007. PMID: 17516672

7

A theoretical study on the electronic structure of Au-XO(0,-1,+1) (X=C, N, and O) complexes: effect of an external electric field.

Tielens F, Gracia L, Polo V, Andrés J. Tielens F, et al. Among authors: andres j. J Phys Chem A. 2007 Dec 20;111(50):13255-63. doi: 10.1021/jp076089d. Epub 2007 Nov 17. J Phys Chem A. 2007. PMID: 18020318

8

Theoretical study on the reaction mechanism of VO2+ with propyne in gas phase.

Gracia L, Polo V, Sambrano JR, Andrés J. Gracia L, et al. Among authors: andres j. J Phys Chem A. 2008 Feb 28;112(8):1808-16. doi: 10.1021/jp7109548. Epub 2008 Feb 6. J Phys Chem A. 2008. PMID: 18251530

9

Toward an understanding of intermediate- and short-range defects in ZnO single crystals. A combined experimental and theoretical study.

Lima RC, Macario LR, Espinosa JW, Longo VM, Erlo R, Marana NL, Sambrano JR, dos Santos ML, Moura AP, Pizani PS, Andrés J, Longo E, Varela JA. Lima RC, et al. Among authors: andres j. J Phys Chem A. 2008 Sep 25;112(38):8970-8. doi: 10.1021/jp8022474. Epub 2008 Jul 25. J Phys Chem A. 2008. PMID: 18652436

10

Density functional theory study on the structural and electronic properties of low index rutile surfaces for TiO2/SnO2/TiO2 and SnO2/TiO2/SnO2 composite systems.

Beltrán A, Andrés J, Sambrano JR, Longo E. Beltrán A, et al. Among authors: andres j. J Phys Chem A. 2008 Sep 25;112(38):8943-52. doi: 10.1021/jp801604n. Epub 2008 Aug 5. J Phys Chem A. 2008. PMID: 18680263

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