Adsorption—from theory to practice

A Dąbrowski - Advances in colloid and interface science, 2001 - Elsevier
Adsorption at various interfaces has concerned scientists since the beginning of this century.
This phenomenon underlies a number of extremely important processes of utilitarian …

[HTML][HTML] Stimulation in fullerene for adsorbing pollutant gases: A review

PS Agrawal, PN Belkhode, DS Brijpuriya… - Chemical Physics …, 2023 - Elsevier
The catalytic activities of fullerene are affected largely by different shapes and surface
arrangements influencing catalyst activity and stability a lot. Surface structures of metal …

A density functional theory investigation on amantadine drug interaction with pristine and B, Al, Si, Ga, Ge doped C60 fullerenes

C Parlak, Ö Alver - Chemical Physics Letters, 2017 - Elsevier
Amantadine is a well-known drug for its treatment effect on Parkinson's disease and
influenza infection or hepatitis. Heteroatom doped fullerenes have been extensively …

Heterofullerenes

JC Hummelen, C Bellavia-Lund, F Wudl - Fullerenes and Related …, 1999 - Springer
The state of the art in heterofullerene chemistry and physics is reviewed with emphasis on
azafullerenes. The macroscopic synthetic methods that have been developed for aza [60] …

Structures of silicon-doped carbon clusters

JL Fye, MF Jarrold - The Journal of Physical Chemistry A, 1997 - ACS Publications
Gas phase ion mobility measurements have been used to examine the geometries of silicon-
doped carbon cluster cations, C n Si+ (n= 3− 69). The observed isomers resemble those …

Boron−Nitrogen (BN) Substitution of Fullerenes:  C60 to C12B24N24 CBN Ball

J Pattanayak, T Kar, S Scheiner - The Journal of Physical …, 2002 - ACS Publications
Semiempirical MNDO and density functional theory (B3LYP/3-21G) were used to examine
the relative stability of the isomers of successive BN-substituted fullerenes C60-2 x (BN) x …

Photolysis experiments on SiC mixed clusters: From silicon carbide clusters to silicon-doped fullerenes

M Pellarin, C Ray, J Lermé, JL Vialle… - The Journal of …, 1999 - pubs.aip.org
Silicon carbon binary clusters are generated in a laser vaporization source from Si x C 1− x
mixed targets (x= 0 to 50%). We have first analyzed stoichiometric (SiC) n (n⩽ 40) clusters …

Silicon-carbon mixed clusters

M Pellarin, C Ray, P Mélinon, J Lermé, JL Vialle… - Chemical physics …, 1997 - Elsevier
Binary clusters SinCm are produced in a laser vaporization source from SixC1− x mixed
targets. Different composition regimes are investigated by abundance and photoinduced …

Structural, Electronic, and Vibrational Properties of C60−nNn (n = 1−12)

H Sharma, I Garg, K Dharamvir… - The Journal of Physical …, 2009 - ACS Publications
Ab initio investigation of structural, electronic and vibrational properties of nitrogen-doped
fullerenes (C60− n N n, for n= 1− 12) has been performed using numerical atomic orbital …

Theoretical Studies of the Substitution Patterns in Heterofullerenes C60-xNx and C60-xBx (x = 2−8)

Z Chen, X Zhao, A Tang - The Journal of Physical Chemistry A, 1999 - ACS Publications
Possible structures of heterofullerenes C60-x N x and C60-x B x (x= 2− 8) have been
calculated using semiempirical MNDO, AM1, PM3, and ab initio methods in order to …