Zobrazeno 1 - 7
of 7
pro vyhledávání: '"Yaroslav V. Shtogun"'
Autor:
Lilia M. Woods, Yaroslav V. Shtogun
Publikováno v:
The Journal of Physical Chemistry Letters. 1:1356-1362
van der Waals interactions between finite-length single-wall carbon nanotubes and graphene nanoribbons are calculated including all many-body contributions. Comparative studies between the total tw...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::48df62e24b7a493fa2a2aa0d9f8f14df
https://doi.org/10.1021/jz100309m
https://doi.org/10.1021/jz100309m
Autor:
Yaroslav V. Shtogun, Lilia M. Woods
Publikováno v:
Carbon. 47:3252-3262
The combined effect of radial deformation and defects on the properties of semiconducting single wall carbon nanotubes are studied using density functional theory. A Stone–Thrower–Wales defect, a substitutional nitrogen impurity, and a mono-vacan
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::13097f589ebaff92622497708d0665af
https://doi.org/10.1016/j.carbon.2009.07.042
https://doi.org/10.1016/j.carbon.2009.07.042
Autor:
Yaroslav V. Shtogun, Lilia M. Woods
Publikováno v:
The Journal of Physical Chemistry C. 113:4792-4796
The electronic structure of radially deformed single walled carbon nanotubes under transverse external electric fields is studied by self-consistent density functional theory methods. The energy band structure modifications are analyzed, revealing th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5a9c83324a7f983f3908e632c3e7d8cd
https://doi.org/10.1021/jp807206m
https://doi.org/10.1021/jp807206m
Publikováno v:
The Journal of Physical Chemistry C. 111:18174-18181
The adsorption of adenine, thymine, and their radicals on the surfaces of metallic and semiconducting single-wall carbon nanotubes are studied by local density approximation within density functional theory. The energies and equilibrium distances for
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d6e393c58ce8ef2688bfd2f52fadce2c
https://doi.org/10.1021/jp074270g
https://doi.org/10.1021/jp074270g
Autor:
Yu. Kirgizov, E. Buzaneva, Peter Scharff, Yury I. Prylutskyy, Olga P. Matyshevska, Anna Yu. Karlash, Yaroslav V. Shtogun, A. Benilov, Kiril O. Gorchinskyy
Publikováno v:
Materials Science and Engineering: C. 15:249-252
We have studied the effects of the electronic structure self-formation and charge transfer for the planar system of layers from DNA unwrapped double helix, DNA double helix, DNA unwrapped double helix with carbon nanotubes (CNT) in the separated sect
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1fa660efeaf7488f6d62c31ea2b8a1e9
https://doi.org/10.1016/s0928-4931(01)00309-5
https://doi.org/10.1016/s0928-4931(01)00309-5
Autor:
Yaroslav V. Shtogun, Lilia M. Woods
Publikováno v:
Carbon Nanotubes
In this chapter we discuss electronic and magnetic carbon nanotube properties under two external factors: radial deformation and various defects along with radial deformation and external electric fields. Our analysis is based on density functional t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2a651c1db833d759ba1f4f72517e6241
https://doi.org/10.5772/39418
https://doi.org/10.5772/39418
Autor:
Yaroslav V. Shtogun, Lilia M. Woods
Publikováno v:
Journal of Applied Physics. 107:061803
First principle density functional theory calculations for radially deformed and defective single wall (8,0) carbon nanotube are reported. Structural changes in terms of radial cross-sectional geometry and bond length changes are studied for differen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::478d3ce3ff0226f4145b0124bee52d9f
https://doi.org/10.1063/1.3340519
https://doi.org/10.1063/1.3340519