Endohedrally doped cage clusters

J Zhao, Q Du, S Zhou, V Kumar - Chemical Reviews, 2020 - ACS Publications
The discovery of carbon fullerene cages and their solids opened a new avenue to build
materials from stable cage clusters as “artificial atoms” or “superatoms” instead of atoms …

Recent progress in theoretical and experimental studies of metal-doped silicon clusters: Trend among elements of periodic table

U Farooq, S Naz, HG Xu, B Yang, XL Xu… - Coordination Chemistry …, 2020 - Elsevier
Metal doped silicon clusters with potential applications in the field of optoelectronics,
magnetic and nanomaterials have been extensively studied during last decade. Here in, a …

Formation of metal-encapsulating Si cage clusters

H Hiura, T Miyazaki, T Kanayama - Physical Review Letters, 2001 - APS
We report the formation of a series of metal-containing hydrogenated silicon clusters using
an ion trap. Mass analyses reveal that many types of transition metal ions M+(M= Hf, Ta, W …

Metal-encapsulated fullerenelike and cubic caged clusters of silicon

V Kumar, Y Kawazoe - Physical Review Letters, 2001 - APS
We report metal-encapsulated caged clusters of silicon from ab initio pseudopotential plane
wave calculations using generalized gradient approximation for the exchange-correlation …

Geometric and electronic structures of metal (M)-doped silicon clusters (M= Ti, Hf, Mo and W)

M Ohara, K Koyasu, A Nakajima, K Kaya - Chemical physics letters, 2003 - Elsevier
We have studied geometric and electronic structures of metal (M) atom doped silicon (Si)
clusters, MSin (M= Ti, Hf, Mo and W), using mass spectrometry, a chemical-probe method …

[BOOK][B] Handbook of nanophysics: clusters and fullerenes

KD Sattler - 2010 - taylorfrancis.com
The field of nanoscience was pioneered in the 1980s with the groundbreaking research on
clusters, which later led to the discovery of fullerenes. Handbook of Nanophysics: Clusters …

Electronic counting rules for the stability of metal-silicon clusters

J Ulises Reveles, SN Khanna - Physical Review B—Condensed Matter and …, 2006 - APS
First principles electronic structure calculations have been carried out to examine the
stability of cationic, neutral, and anionic M Si 15, M Si 16, and M Si 17 (M= Sc, Ti, and V) …

Ti deposited C20 and Si20 fullerenes for hydrogen storage application, DFT study

HY Ammar, HM Badran - International journal of hydrogen energy, 2021 - Elsevier
In this work, Ti deposited C 20, Si 20, and KSi 20 as hydrogen storage materials have been
studied utilizing the DFT (B3LYP and M06-2X)/6-311 g (d, p). The encapsulated K atom in …

Mass spectrometric stability study of binary MSn clusters (S= Si, Ge, Sn, Pb, and M= Cr, Mn, Cu, Zn)

S Neukermans, X Wang, N Veldeman… - International Journal of …, 2006 - Elsevier
In this paper, we present a mass spectrometric stability investigation of a series of metal
doped group IVA (semi-) metal clusters. Binary metal (M) doped semi-metal (S) MSn (S= Si …

Photoelectron spectroscopy of chromium-doped silicon cluster anions

W Zheng, JM Nilles, D Radisic… - The Journal of chemical …, 2005 - pubs.aip.org
The photoelectron spectra of chromium-doped silicon cluster anions, Cr Si n−⁠, were
measured over the size range, n= 8–12⁠. Their vertical detachment energies were …