Armando Beltran
Armando Beltran
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Crystal growth in colloidal tin oxide nanocrystals induced by coalescence at room temperature
ER Leite, TR Giraldi, FM Pontes, E Longo, A Beltran, J Andres
Applied Physics Letters 83 (8), 1566-1568, 2003
Static simulation of bulk and selected surfaces of anatase TiO2
A Beltran, JR Sambrano, M Calatayud, FR Sensato, J Andres
Surface science 490 (1-2), 116-124, 2001
Density functional theory calculation of the electronic structure of Ba 0.5 Sr 0.5 TiO 3: photoluminescent properties and structural disorder
E Longo, E Orhan, FM Pontes, CD Pinheiro, ER Leite, JA Varela, ...
Physical Review B 69 (12), 125115, 2004
Density functional theory study of the brookite surfaces and phase transitions between natural titania polymorphs
A Beltran, L Gracia, J Andres
The Journal of Physical Chemistry B 110 (46), 23417-23423, 2006
Room-temperature photoluminescence of Ba Ti O 3: Joint experimental and theoretical study
E Orhan, JA Varela, A Zenatti, MFC Gurgel, FM Pontes, ER Leite, E Longo, ...
Physical Review B 71 (8), 085113, 2005
A Systematic Density Functional Theory Study of VxOy+ and VxOY (X = 2−4, Y = 2−10) Systems
M Calatayud, J Andrés, A Beltrán
The Journal of Physical Chemistry A 105 (42), 9760-9775, 2001
Thermodynamic argument about nanoribbon growth
A Beltrán, J Andrés, E Longo, ER Leite
Applied physics letters 83 (4), 635-637, 2003
Periodic study on the structural and electronic properties of bulk, oxidized and reduced SnO2 (1 1 0) surfaces and the interaction with O2
FR Sensato, R Custódio, M Calatayud, A Beltrán, J Andrés, JR Sambrano, ...
Surface Science 511 (1-3), 408-420, 2002
Topological analysis of electron density in depleted homopolar chemical bonds
R Llusar, A Beltrán, J Andrés, S Noury, B Silvi
Journal of computational chemistry 20 (14), 1517-1526, 1999
Luminescence database I—minerals and materials
CM MacRae, NC Wilson
Microscopy and Microanalysis 14 (2), 184-204, 2008
Structure and Bonding of Chlorine Oxides and Peroxides:  ClOx, ClOx- (x = 1−4), and Cl2Ox (x = 1−8)
A Beltrán, J Andrés, S Noury, B Silvi
The Journal of Physical Chemistry A 103 (16), 3078-3088, 1999
Electronic and structural properties of SnxTi1− xO2 solid solutions: a periodic DFT study
FR Sensato, R Custodio, E Longo, A Beltrán, J Andrés
Catalysis today 85 (2-4), 145-152, 2003
Theoretical Study on the Molecular Mechanism for the Reaction of VO2+ with C2H4
L Gracia, JR Sambrano, VS Safont, M Calatayud, A Beltrán, J Andrés
The Journal of Physical Chemistry A 107 (17), 3107-3120, 2003
A theoretical analysis of adsorption and dissociation of CH3OH on the stoichiometric SnO2 (110) surface
M Calatayud, J Andrés, A Beltrán
Surface science 430 (1-3), 213-222, 1999
Presence of excited electronic state in CaWO4 crystals provoked by a tetrahedral distortion: An experimental and theoretical investigation
L Gracia, VM Longo, LS Cavalcante, A Beltrán, W Avansi, MS Li, ...
Journal of Applied Physics 110 (4), 043501, 2011
A theoretical study on the structure, energetics and bonding of VOx+ and VOx (x= 1–4) systems
M Calatayud, B Silvi, J Andrés, A Beltran
Chemical physics letters 333 (6), 493-503, 2001
Quantum-mechanical analysis of the equation of state of anatase TiO 2
M Calatayud, P Mori-Sánchez, A Beltrán, AM Pendás, E Francisco, ...
Physical Review B 64 (18), 184113, 2001
DFT Study of the Reaction between VO2+ and C2H6
L Gracia, J Andrés, VS Safont, A Beltrán, JR Sambrano
Organometallics 23 (4), 730-739, 2004
Topological Analysis of Multiple Metal−Metal Bonds in Dimers of the M2(Formamidinate)4 Type with M = Nb, Mo, Tc, Ru, Rh, and Pd
R Llusar, A Beltrán, J Andrés, F Fuster, B Silvi
The Journal of Physical Chemistry A 105 (41), 9460-9466, 2001
The hierarchy of localization basins: a tool for the understanding of chemical bonding exemplified by the analysis of the VOx and VOx+ (x= 1–4) systems
M Calatayud, J Andrés, A Beltrán, B Silvi
Theoretical Chemistry Accounts 105 (4-5), 299-308, 2001
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