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D-6h-au-42 isomer: a golden aromatic toroid involving superatomic -orbitals that follow the huckel (4n+2) rule
(2016)
Recently, it has been shown that the superatom concept is intimately connected to relevant tools of great chemical significance, such as the Lewis structure model and the VSEPR theory, which has been employed to understand ...
SPIN-ORBIT EFFECTS ON HEAVY-METAL OCTAHEDRAL CLUSTERS
(ELSEVIER SCIENCE BV, 1993)
The relativistic electronic structure of octahedral Mo6, W6, Ag6 and Au6 clusters has been investigated using the self-consistent field Dirac scattered wave (SCF-DSW) method. It is shown that spin-orbit interaction breaks ...
Crystal structures and magnetic order of La(0.5+delta)A(0.5-delta)Mn(0.5+epsilon)Ru(0.5-epsilon)O(3) (A=Ca,Sr,Ba): Possible orbital glass ferromagnetic state
(American Physical SocCollege PkEUA, 2004)
¿Qué tan cuántica es la química cuántica?How quantum is quantum chemistry?
(Universidad Nacional de QuilmesUniversidad Nacional de Tres de Febrero, 2019-04-01)
El propósito del presente trabajo será poner de manifiesto que la química cuántica es una disciplina basada primariamente en modelos, y no en teorías que establecen un marco conceptual específico y autónomo. Esta característica ...
Charge injection in an LED with a hybrid composite as the emissive layer
(ElsevierLausanne, 2011-07)
Understanding and controlling charge transport are crucial to achieve optimized organic devices, including light emitting diodes. In this study, we investigate the charge injection in devices made with a hybrid composite ...
Charge injection in an LED with a hybrid composite as the emissive layer
(Elsevier B.V., 2011-07-20)
Understanding and controlling charge transport are crucial to achieve optimized organic devices, including light emitting diodes. In this study, we investigate the charge injection in devices made with a hybrid composite ...
Charge injection in an LED with a hybrid composite as the emissive layer
(Elsevier B.V., 2011-07-20)
Understanding and controlling charge transport are crucial to achieve optimized organic devices, including light emitting diodes. In this study, we investigate the charge injection in devices made with a hybrid composite ...
Um estudo de primeiros princípios sobre a origem e os mecanismos da ferroeletricidade nos compostos multiferróicos RMnO3 (R=Y, Lu)
(Universidade Federal de SergipePós-Graduação em FísicaBrasilUFS, 2017)