Buscar
Mostrando ítems 1-10 de 385
Bonding, structure, and stability of Na n Phe m n clusters: some surprising results from an experimental and theoretical investigation in gas phase
(Hindawi Publishing Corporation, 2018)
DFT Studies of the Interactions of a Graphene Layer with Small Water Aggregates
(2011)
We have investigated the structure, adsorption, electronic states, and charge
transfer of small water aggregates on the surface of a graphene layer using density functional theory. Our calculations were focused on water ...
Theoretical study of the microscopic solvation of alkali and alkaline-earth monohydroxides in (H2O)m (m ≤ 3) clusters
(Elsevier Science, 2014-12)
A density functional mPW1PW91 study of the most stable conformers of MOH(H2O)0–3 clusters (M = alkali or alkaline-earth atom) was performed, along with quantum chemistry CCSD(T,Full) calculations for M = Li and Be. The ...
Synthesis of Highly Stable Surfactant-free Cu5 Clusters in Water
(American Chemical Society, 2016-07)
We report the synthesis, for the first time, of small, highly monodisperse Cu5 clusters in water without any surfactant or protective agent. For this purpose, we used a new approach based on the kinetic control of the ...
Synthesis of water-soluble gold clusters in nanosomes displaying robust photoluminescence with very large Stokes shift
(Elsevier, 2015-06)
This paper reports a novel procedure using nanosomes, made of bola-hydroxyl and mercapto-palmitic acids, for the production of gold clusters with robust luminescent emissions and very large Stokes shifts. It shows that ...
Hydration of Barium Monohydroxide in (H2O)1-3 Clusters: Theory and Experiment
(American Chemical Society, 2013-06)
The ionization energies (IEe´s) of small BaOH(H2O)m clusters (m = 1-3), as generated in a laser vaporization-supersonic expansion source have been determined by laser photoionization experiments over the 3.65?4.55 eV energy ...
Groups travel further: pelagic metamorphosis and polyp clustering allow higher dispersal potential in sun coral propagules
(Berlin, 2014-03-08)
We report that planulae produced by Tubastraea coccinea can metamorphose and aggregate in groups of up to eight polyps in the water column, without previous settlement on benthic substrate. We also evaluated the survival ...
Hydrophobic meddling in small water clusters
(SPRINGER, 2013-08-01)
What would be the effects on the nature of hydrogen bonds, on the energies, and on the overall structural possibilities of replacing some hydrogen atoms by small hydrophobic groups in small water networks? Aiming at ...
Water molecule clusters measured at water/air interfaces using atomic force microscopy
(Royal Soc ChemistryCambridgeInglaterra, 2005)