Literatura académica sobre el tema "Pd/Ru(0001) interface"

In this work, the effects of 20 transition element additions on the interfacial adhesion energy and electronic structure of Al(111)/6H-SiC(0001) interfaces have been studied by the first-principles method. For pristine Al(111)/6H-SiC(0001) interfaces, both Si-terminated and C-terminated interfaces have covalent bond characteristics. The C-terminated interface has higher binding energy, which is mainly due to the stronger covalent bond formed by the larger charge transfer between C and Al. The results show that the introduction of many transition elements, such as 3d transitional group Mn, Fe, Co, Ni, Cu, Zn and 4d transitional group Tc, Ru, Rh, Pd, Ag, can improve the interfacial adhesion energy of the Si-terminated Al(111)/6H-SiC(0001) interface. However, for the C-terminated Al(111)/6H-SiC(0001) interface, only the addition of Co element can improve the interfacial adhesion energy. Bader charge analysis shows that the increase of interfacial binding energy is mainly attributed to more charge transfer.

Obtaining detailed information regarding the interfacial characteristics of metal/hexagonal-TMN composites is imperative for developing these materials with optimal mechanical properties. To this end, we systematically investigate the work of adhesion, fracture toughness, and interfacial stability of M/Cr2N and M/V2N interfaces using first-principles calculations. The orientation (0001) of hexagonal phases and (111) of fcc phases are selected as the interface orientations. Accordingly, we construct M/Cr2N interface models by considering 1N, 2N, and Cr terminations of Cr2N(0001), as well as two stacking sequences (top and hollow sites) for the 1N- and 2N-terminated interface models, respectively. The M/V2N interface models are constructed in the same way. The V-terminated Ni/V2N interface is demonstrated to provide a good combination of the work of adhesion, fracture toughness, and interfacial stability. Therefore, the Ni/V2N interface model can be regarded as the preferred configuration among the metal/hexagonal-TMN interface models considered. The present results offer a practical perspective for tailoring the interfaces in metal/hexagonal-TMN composite materials to obtain improved mechanical properties.

AbstractThis report concerns the properties of an interface formed between Pd films deposited onto the surface of (0001)-oriented n-type GaN at room temperature (RT) under ultrahigh vacuum. The surface of clean substrate and the stages of Pd-film growth were characterized in situ by X-ray photoelectron spectroscopy (XPS), scanning tunneling microscopy (STM), ultraviolet photoelectron spectroscopy (UPS), and low energy electron diffraction (LEED).As-deposited Pd films are grainy, cover the substrate surface uniformly and reproduce its topography. Electron affinity of the clean n-GaN surface amounts to 3.1 eV. The work function of the Pd-film is equal to 5.3 eV. No chemical interaction has been found at the Pd/GaN interface formed at RT. The Schottky barrier height of the Pd/GaN contact is equal to 1.60 eV.

The growth process of platinum on Ru (0001) near room temperature was characterized using photoelectron spectroscopy of high resolution. The binding energy position and intensity of the Pt 4f7/2 and Ru 3d5/2 core levels as well as the shape and structure of the valence band spectra corresponding to the different stages of the deposition were analyzed. Up to ca. two adsorbate monolayers, the intensity changes of the peaks indicated layer-by-layer growth mode. The surface core level shifts of Ru and Pt levels were evaluated as -0.33 and -0.476 eV, respectively. The valence band spectra show a rather weak interaction between the d-bands of Pt and Ru .

2008/2009
L'obiettivo di questa tesi è l'applicazione della spettroscopia di fotoemissione allo studio di nanoparticelle supportate e di sistemi a bassa dimensionalità. Ad una primo periodo dedicato allo sviluppo del rivelatore e del software per un nuovo analizzatore d'energia per elettroni installato presso la linea di luce SuperESCA ad Elettra, è seguita una fase durante la quale ho eseguito una serie di esperimenti mirati ad esplorare le potenzialità del nuovo apparato sperimentale. Il primo risultato ottenuto riguarda la comprensione della relazione che intercorre tra le variazioni della reattività chimica del sistema Pd/Ru(0001) e il numero degli strati di Pd cresciuti in modo pseudomorfico sul substrato di rutenio. La risoluzione temporale raggiunta con la nuova strumentazione ci ha permesso di studiare processi dinamici su una scala temporale fino ad ora inaccessibile per la spettroscopia di fotoemissione dai livelli di core: in particolare abbiamo studiato la crescita del grafene ad alta temperatura sulla superficie (111) dell'iridio e la reattività chimica di nanocluster di Pt supportati su MgO. Nel primo caso abbiamo messo in evidenza come la formazione del grafene proceda attraverso la nucleazione di nano-isole di carbonio che assumono una peculiare forma di cupola. Nel secondo caso siamo riusciti a seguire sia la dinamica del processo di adsorbimento di CO, sia la reazione CO + 1/2 O2 -> CO2 sulle nanoparticelle di Pt depositate su un film ultra-sottile di ossido di magnesio. Infine, abbiamo caratterizzato la morfologia di nanoparticelle di Pd, Pt, Rh e Au cresciute su diversi substrati a base di carbonio, in particolare grafite, nanotubi a parete singola e grafene. Tra i vari risultati abbiamo compreso come l'interazione metallo-substrato dipenda dalla dimensione delle nano-particelle e abbiamo evidenziato il ruolo centrale dei difetti del substrato nei processi di nucleazione e intercalazione.
The objective of this thesis is the application of photoelectron spectroscopy for the investigation of supported nanoclusters and low-dimensional systems. After a first stage devoted to the development of the detector and the software for the electron energy analyser installed on the SuperESCA beamline at Elettra, during the PhD project I've performed a series of experiments aimed to explore the capabilities of the new experimental apparatus. One of the first results concerns the understanding of the relation between the modifications in the chemical reactivity of the Pd/Ru(0001) system and the thickness of the pseudomorphically grown Pd overlayer. The temporal resolution achieved with the new experimental set-up allowed us to study dynamical processes on a new time scale, in particular the graphene growth process at high temperature on the Ir(111) surface and the chemical reactivity of Pt nanoclusters supported on MgO. In the former case, we discovered that graphene formation proceeds via preliminary nucleation of dome-shaped C nano-islands. In the second case, we succeded in following both the dynamics of CO adsorption process and the CO + 1/2 O2 -> CO2 reaction on Pt nanoclusters grown on a ultra-thin film of magnesium oxide. Finally, the morphology of Pd, Pt, Rh and Au nanoclusers grown on different carbon-based substrates (namely graphite, single-walled carbon nanotubes and graphene) has been characterized. Among the results we report the understanding of the dependence of the metal-substrate interaction on the cluster size and the role of defects in the nucleation and intercalation processes.
XXII Ciclo
1972

The possibility of the existence of ferromagnetic order in Ru monolayers on the C(0001) graphite surface is studied using electron induced spin-polarized secondary electron emission (SPSEE). Below a surface Curie temperature of approximately 250K we find ferromagnetic order of the Ru monolayer. The growth mode of Ru on C(0001) is investigated by Auger electron spectroscopy (AES). We find, that the initial growth occurs laterally until a homogenous monolayer is formed. Our study provides the first observation of spontaneous, two-dimensional ferromagnetic order of a 4d transition element. To investigate the spin-polarization and domain pattern in ultrathin films and multilayers, we develop a novel technique: scanning ion microscopy with polarization analysis (SIMPA). A highly focused Ga$\sp+$-ion beam from a liquid metal ion source is moved over a sample to locally eject secondary electrons, whose spin-polarization is determined by using a medium energy Mott polarimeter. We show that the sputtering by the ion beam can be well controlled and utilized for nano-lithography and spin-resolved sputter depth profiling. We use SIMPA and the surface magneto-optic Kerr effect to study exchange coupling in Fe/Mn/Fe/Pd(100) multilayers. The intervening Mn layer is grown in a wedge shape ranging in thickness from 0 to 9 monolayers. Our results show that both Fe layers are coupled ferromagnetically for the entire Mn thickness range. Growth mode and structure are analyzed by AES and medium electron energy diffraction.