Structural properties of nanoclusters: Energetic, thermodynamic, and kinetic effects
The structural properties of free nanoclusters are reviewed. Special attention is paid to the
interplay of energetic, thermodynamic, and kinetic factors in the explanation of cluster …
interplay of energetic, thermodynamic, and kinetic factors in the explanation of cluster …
Quantum mechanical studies of large metal, metal oxide, and metal chalcogenide nanoparticles and clusters
Metal, metal oxide, and metal chalcogenide materials have a wide variety of applications.
For example, many metal clusters and nanoparticles are used as catalysts for reactions …
For example, many metal clusters and nanoparticles are used as catalysts for reactions …
Modern aspects of the Jahn− Teller effect theory and applications to molecular problems
IB Bersuker - Chemical reviews, 2001 - ACS Publications
I begin this review with a statement that the socalled Jahn-Teller (JT) effect (hereafter JTE),
pseudo-JTE (PJTE), and Renner-Teller effect (RTE), jointly JT vibronic coupling effects, are …
pseudo-JTE (PJTE), and Renner-Teller effect (RTE), jointly JT vibronic coupling effects, are …
Structures of medium-sized silicon clusters
KM Ho, AA Shvartsburg, B Pan, ZY Lu, CZ Wang… - Nature, 1998 - nature.com
Silicon is the most important semiconducting material in the microelectronics industry. If
current miniaturization trends continue, minimum device features will soon approach the …
current miniaturization trends continue, minimum device features will soon approach the …
Observation of a magic discrete family of ultrabright Si nanoparticles
G Belomoin, J Therrien, A Smith, S Rao… - Applied Physics …, 2002 - pubs.aip.org
We demonstrate that electrochemically etched, hydrogen capped Si n H x clusters with n
larger than 20 are obtained within a family of discrete sizes. These sizes are 1.0 (Si 29), 1.67 …
larger than 20 are obtained within a family of discrete sizes. These sizes are 1.0 (Si 29), 1.67 …
Structure of nanoscale silicon clusters
Abstract Using the Car-Parrinello method, we have obtained unforeseen structures for the
low-lying isomers of Si 45 and other midsized Si clusters. They are formed by two shells of …
low-lying isomers of Si 45 and other midsized Si clusters. They are formed by two shells of …
[BOOK][B] What are Microclusters?
S Sugano, H Koizumi, S Sugano, H Koizumi - 1998 - Springer
Classification of the fragments which are obtained by successive division of material is given
according to their sizes. The particles are called fine particles when they consist of the order …
according to their sizes. The particles are called fine particles when they consist of the order …
Clusters as new materials
W Eberhardt - Surface Science, 2002 - Elsevier
Over the past two decades methods have been developed to produce clusters with an
exactly determined number of atoms. Due to their finite size these small particles have totally …
exactly determined number of atoms. Due to their finite size these small particles have totally …
Clusters of aluminium, a density functional study
R Ahlrichs, SD Elliott - Physical Chemistry Chemical Physics, 1999 - pubs.rsc.org
Density functional calculations have been performed to study the structure and energetics of
mainly neutral Aln with n up to 153. Clusters up to n= 15 have been investigated …
mainly neutral Aln with n up to 153. Clusters up to n= 15 have been investigated …
Structures and dynamical properties of and clusters with n up to 13
ZY Lu, CZ Wang, KM Ho - Physical Review B, 2000 - APS
Car-Parrinello molecular dynamics simulated annealings were carried out for clusters Si n,
Ge n, and Sn n (n<~ 1 3). We investigate the temperature regions in which these clusters …
Ge n, and Sn n (n<~ 1 3). We investigate the temperature regions in which these clusters …