Geodesic
Adiabatic and vertical ionization potentials of single-walled carbon nanotubes
Nanosistemy: fizika, himiâ, matematika, Tome 3 (2012) no. 6, pp. 70-74

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Vertical and adiabatic ionization potentials of a model of single-wall carbon nanotubes (SWNT) were calculated by the DFT method. The changes of ionization potentials of structures with various lengths and diameters were analyzed. Geometry changes of SWNTs with various lengths upon ionization were revealed.
Keywords: SWNT, ionization potential, DFT, BP86. 
@article{NANO_2012_3_6_a6,
     author = {I. K. Petrushenko and N. A. Ivanov},
     title = {Adiabatic and vertical ionization potentials of single-walled carbon nanotubes},
     journal = {Nanosistemy: fizika, himi\^a, matematika},
     pages = {70--74},
     publisher = {mathdoc},
     volume = {3},
     number = {6},
     year = {2012},
     language = {ru},
     url = {http://geodesic.mathdoc.fr/item/NANO_2012_3_6_a6/}
}
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I. K. Petrushenko; N. A. Ivanov. Adiabatic and vertical ionization potentials of single-walled carbon nanotubes. Nanosistemy: fizika, himiâ, matematika, Tome 3 (2012) no. 6, pp. 70-74. http://geodesic.mathdoc.fr/item/NANO_2012_3_6_a6/