scholarly journals Atomistic simulation of oxygen molecule adsorption on vicinal silicon surface

2018 ◽  
Author(s):  
Mauludi Ariesto Pamungkas
2014 ◽  
Vol 41 (3) ◽  
pp. 63-67 ◽  
Author(s):  
D. M. Kurmasheva ◽  
V. D. Travkin ◽  
P. O. Kapralov ◽  
V. G. Artemova ◽  
V. I. Tikhonov ◽  
...  

2013 ◽  
Vol 543 ◽  
pp. 447-450
Author(s):  
Zahra Karami Horastani ◽  
S. Javad Hashemifar ◽  
S. Masoud Sayedi ◽  
Mohammad Hossein Sheikhi ◽  
Reza Alaei

By using spin polarized density functional calculations, we investigate the effect of oxygen molecule adsorption on the structural and electrical properties of (8, 0) single wall carbon nanotube. The obtained results indicate endothermic chemisorption of O2on the nanotube surface with a large binding energy of about 598 meV and a significant charge transfer of about 0.43 e-per molecule. We find that despite the triplet ground state configuration of free oxygen molecule, adsorbed oxygen on the nanotube prefers a zero moment spin singlet state. It is discussed that O2chemisorption dopes the (8, 0) carbon nanotube with hole carries and thus increases its work function from 4.34 to 4.89eV. This hole doping effect may show potential applications of carbon nanotubes in conductivity and thermopower electric based sensors.


ChemPhysChem ◽  
2016 ◽  
Vol 18 (1) ◽  
pp. 101-110 ◽  
Author(s):  
Shaobin Tang ◽  
Weihua Wu ◽  
Liangxian Liu ◽  
Junjing Gu

1990 ◽  
Vol 23 (22) ◽  
pp. 4872-4873 ◽  
Author(s):  
Shinichi Yano ◽  
Kenji Tadano ◽  
Eisaku Hirasawa ◽  
Jun Yamauchi

2007 ◽  
Vol 353 (5-7) ◽  
pp. 594-598 ◽  
Author(s):  
A. Hemeryck ◽  
N. Richard ◽  
A. Estève ◽  
M. Djafari Rouhani

Author(s):  
T. Sato ◽  
S. Kitamura ◽  
T. Sueyoshl ◽  
M. Iwatukl ◽  
C. Nielsen

Recently, the growth process and relaxation process of crystalline structures were studied by observing a SI nano-pyramid which was built on a Si surface with a UHV-STM. A UHV-STM (JEOL JSTM-4000×V) was used for studying a heated specimen, and the specimen was kept at high temperature during observation. In this study, the nano-fabrication technique utilizing the electromigration effect between the STM tip and the specimen was applied. We observed Si atoms migrated towords the tip on a high temperature Si surface.Clean surfaces of Si(lll)7×7 and Si(001)2×l were prepared In the UHV-STM at a temperature of approximately 600 °C. A Si nano-pyramid was built on the Si surface at a tunneling current of l0nA and a specimen bias voltage of approximately 0V in both polarities. During the formation of the pyramid, Images could not be observed because the tip was stopped on the sample. After the formation was completed, the pyramid Image was observed with the same tip. After Imaging was started again, the relaxation process of the pyramid started due to thermal effect.


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