Departamento de Química Física
Departamento
Universitat Autònoma de Barcelona
Barcelona, EspañaPublicacións en colaboración con investigadores/as de Universitat Autònoma de Barcelona (12)
2021
-
Deconvolution of Phonon Scattering by Ferroelectric Domain Walls and Point Defects in a PbTiO3Thin Film Deposited in a Composition-Spread Geometry
ACS Applied Materials and Interfaces, Vol. 13, Núm. 38, pp. 45679-45685
2019
-
Ferroelectric Domain Walls in PbTiO3 Are Effective Regulators of Heat Flow at Room Temperature
Nano Letters, Vol. 19, Núm. 11, pp. 7901-7907
2018
-
Influence of the donor unit on the rectification ratio in tunnel junctions based on donor-acceptor SAMs using PTM units as acceptors
Physical Chemistry Chemical Physics, Vol. 20, Núm. 40, pp. 25638-25647
2017
-
Tetrathiafulvalene–Polychlorotriphenylmethyl Dyads: Influence of Bridge and Open-Shell Characteristics on Linear and Nonlinear Optical Properties
Chemistry - A European Journal, Vol. 23, Núm. 46, pp. 11067-11075
2014
-
In vivo theranostics at the peri-infarct region in cerebral ischemia
Theranostics, Vol. 4, Núm. 1, pp. 90-105
2013
-
Intra- and intermolecular charge transfer in aggregates of tetrathiafulvalene-triphenylmethyl radical derivatives in solution
Journal of the American Chemical Society, Vol. 135, Núm. 18, pp. 6958-6967
-
Thermomagnetic molecular system based on TTF-PTM radical: Switching the spin and charge delocalization
Journal of Physical Chemistry Letters, Vol. 4, Núm. 16, pp. 2721-2726
1998
-
Comparison of electrostatic similarity approaches applied to a series of ketanserin analogues with 5-HT(2A) antagonistic activity
Quantitative Structure-Activity Relationships, Vol. 17, Núm. 3, pp. 199-204
1994
-
Theoretical Study on the Metabolism of Caffeine by Cytochrome P‐450 1A2 and its Inhibition
Quantitative Structure‐Activity Relationships, Vol. 13, Núm. 3, pp. 281-284
1993
-
Antiserotoninergic activity of 2‐aminoethylbenzocyclanones in rat aorta: Structure‐activity relationships
Journal of Pharmaceutical Sciences, Vol. 82, Núm. 5, pp. 513-517
-
MEPSIM: A computational package for analysis and comparison of molecular electrostatic potentials
Journal of Computer-Aided Molecular Design, Vol. 7, Núm. 3, pp. 337-347
-
Quantitative comparison of molecular electrostatic potential distributions from several semiempirical and ab initio wave functions
Journal of Computational Chemistry, Vol. 14, Núm. 8, pp. 922-927