Search results for " metal"

Theoretical Analysis of the M12Ag32(SR)404– and X@M12Ag32(SR)304– Nanoclusters (M = Au, Ag; X = H, Mn)

2014

We analyze the electronic structure and optical properties of the recently reported, structurally known M12Ag32(SR)304– clusters (M = Au, Ag) by using density functional theory and time-dependent density functional perturbation theory. Effects of the chemical changes in the metal core, charge of the cluster, and nature of the thiolate ligand on the electronic structure and optical absorption are reported. In addition, doping the metal core with a magnetic transition metal atom (Mn) or hydrogen (protons) is discussed. Although all these clusters can be considered as 18-electron superatoms with a shell configuration 1S2 1P6 1D10, we find that the optical spectrum is sensitive to the charge st…

Role of Vibrational Dynamics in Electronic Relaxation of Cr(acac)3

2015

Ultrafast energy relaxation of Cr(acac)3 dissolved in tetrachloroethylene (TCE) is studied by time-resolved infrared (TRIR) spectroscopy by using electronic and vibrational excitation. After electronic excitation at 400 or 345 nm, the ground state recovers in two time scales: 15 ps (major pathway) and 800 ps (minor pathway), corresponding to fast electronic transition to the ground state and intermediate trapping on the long-lived (2)E state followed by intersystem crossing (ISC) to the ground state. The quantum yield for the fast recovery of the ground state depends on the excitation wavelength, being higher for 345 nm. Vibrational cooling (VC) occurs on the electronic excited states with …

Total Structure and Electronic Structure Analysis of Doped Thiolated Silver [MAg24(SR)18]2– (M = Pd, Pt) Clusters

2015

With the incorporation of Pd or Pt atoms, thiolated Ag-rich 25-metal-atom nanoclusters were successfully prepared and structurally characterized for the first time. With a composition of [PdAg24(SR)18](2-) or [PtAg24(SR)18](2-), the obtained 25-metal-atom nanoclusters have a metal framework structure similar to that of widely investigated Au25(SR)18. In both clusters, a M@Ag12 (M = Pd, Pt) core is capped by six distorted dimeric -RS-Ag-SR-Ag-SR- units. However, the silver-thiolate overlayer gives rise to a geometric chirality at variance to Au25(SR)18. The effect of doping on the electronic structure was studied through measured optical absorption spectra and ab initio analysis. This work d…

Sand clams of Ganzirri marine coastal lagoon in Messina (Italy). Extraction and ICP-MS analysis

2008

This paper studies the possible forms or phases of heavy metals in sediments of a marine coastal lagoon, called Ganzirri, located in the Sicilian coast of the Messina’s strait by using sequential extraction. To reduce the extraction time of the Tessier method, the last step of speciation was carried out by mineralization in a microwave oven. Here we report the results of the distribution of As, Be, Cd, Co, Cr, Cu, Mo, Ni, Pb, Sb, Se, Tl, V and Zn, in four fractions of sediments samples and the concentration of the same metals in clams. This study looked at three bivalve mollusc species, Tapes decussates, Chamelea gallina and Cardium edule, raised in the sediment considered and discussed the…

New methodologies in transition metal catalysis. Organofluorine chemistry as the benchmark application.

2017

A lo largo de las últimas décadas, los compuestos organofluorados han encontrado numerosas aplicaciones dentro del campo de las industrias farmacéutica y agroquímica, así como en ciencias de los materiales. Dadas las singulares propiedades del átomo de flúor, éste es capaz de inducir alteraciones significativas en propiedades físico-químicas de las moléculas como lipofilia, distribución de cargas, acidez-basicidad, capacidad de formar enlaces de hidrógeno e incluso, equilibrios conformacionales. Sin embargo, la presencia de flúor en productos naturales es escasa. De hecho, la gran mayoría de las moléculas orgánicas que contienen flúor son sintéticas. De ahí el gran interés por parte de la c…

Sintesi di complessi metallici e studio della loro interazione con acido desossiribonucleico.

2011

TRANSITION METAL OXIDES AS SELECTIVE CONTACTS FOR C-SI SOLAR CELLS

2021

Monitoring Volcanic Eruptions Using Trace Metals In Tree-Rings: Preliminary Results From Mt. Etna

2010

8. Active volcanoes can influence surrounding vegetation both through passive degassing during quiescent periods and through eruptive degassing, by introducing into the atmosphere several metals as gases and particles. The chemical composition of tree-rings has been generally used to investigate the effects of anthropogenic gas emissions and dendrochemical methods have successfully recorded variations in the pollution levels. The use of tree-rings analysis in active volcanic areas has shown that vascular plants could be used as archives of volcanogenic metals deposition. Tree cores of Pinus Nigra and Populus tremula were collected in sites located both on the downwind (Citelli and Mt. Fonta…

Nanofilm Low Cost Oxygen Sensors

2009

Abstract The resitivity change of ultra thin metals under air exposure is used for vacuum or inert gas packaging control. In order to reach low cost, single use applications, few nm thin Aluminum layers were deposited on PET substrates and combined with wireless electronic readout circuitry. The sensor respose is characterized by resistance changes and explained in terms of multiphase diffusion mechanisms which are very sensitive to technological parameters.

La vida imaginaria del científico. El caso del cómic 'The Manhattan Projects'

2014

Aquest article analitza The Manhattan Projects, serie de comics que explica una historia alternativa sobre el fi nal de la Segona Guerra Mundial en que el Projecte Manhattan amaga altres activitats mes relacionades amb la ciencia-fi ccio. Aquest treball analitza la translacio del concepte de vida imaginaria encunyat per Marcel Schwob a la historia de la ciencia en el segle XX.