The properties of elements from atoms to bulk can be divided into two regimes:(i) a scalable
regime where properties vary smoothly as some power law until they reach the bulk limit and …

Understanding the energy it takes to build or break chemical bonds is essential for scientists
and engineers in a wide range of innovative fields, including catalysis, nanomaterials …

Functional molecular nanoarchitectures (FMNs) are highly relevant for the development of
future nanotechnology devices. Profound knowledge about the atomically controlled …

Vibrational spectroscopy measurements are described for mass-selected metal cation-
molecular complexes using the technique of infrared resonance-enhanced …

A systematic theoretical study of the equilibrium geometries and total energies of Cr
encapsulated in Si clusters reveals that Cr Si 12 is more stable than its neighbors. The origin …

We investigate the electronic and magnetic properties of the proposed one-dimensional
transition metal (TM= Sc, Ti, V, Cr, and Mn)− benzene (Bz) sandwich polymers by means of …

The requirement of energy in our daily life is continuously increased. We consume different
type of fossil fuel (like oil, coal and natural gas) resources in order to obtain energy. Due to …

(Cobalt) n (benzene) m− cluster anions,(n, m) were generated by laser vaporization and
studied by both mass spectrometry and anion photoelectron spectroscopy. Our assignment …

Metal− benzene complexes of the form M (benzene) n (M= Ti, V, Fe, Co, Ni) are produced in
the gas-phase environment of a molecular beam by laser vaporization in a pulsed nozzle …

Results on structural, energetic, electronic, and magnetic properties of linear sandwich V n
Bz n+ 1 clusters obtained using high-accuracy density functional computations are …