title: Anode distance effect on field electron emission from carbon nanotubes: a molecular/quantum mechanical simulation.
abstract: Field electron emission from single-walled (5,5) carbon nanotubes was simulated with a quantum chemistry method, emphasizing the effect of distance between the anode and apex. The emission probability and the field enhancement factor were obtained for different anode-apex separations with two representative applied macroscopic fields. The quantum chemistry simulation was compared to the classical finite element calculation. It was found that the field enhancement factor was overestimated by about a factor 2 in the classical calculation (for the capped carbon nanotube). The effective work function lowering due to the field penetration into the apex has important contribution to the emission probability. A peculiar decrease of the effective work function with the anode-apex separation was found for the capped carbon nanotube, and its quantum mechanical origin is discussed.
authors.affiliation: State Key Laboratory of Optoelectronic Materials and Technologies, School of Physics and Engineering, Sun Yat-sen University, Guangzhou, 510275, People's Republic of China.
authors.forename: Chunshan
authors.initials: C
authors.lastname: He
authors.forename: Weiliang
authors.initials: W
authors.lastname: Wang
authors.forename: Shaozhi
authors.initials: S
authors.lastname: Deng
authors.forename: Ningsheng
authors.initials: N
authors.lastname: Xu
authors.forename: Zhibing
authors.initials: Z
authors.lastname: Li
authors.forename: Guihua
authors.initials: G
authors.lastname: Chen
authors.forename: Jie
authors.initials: J
authors.lastname: Peng
mesh_terms: D004566:Electrodes; D004583:Electrons; D008956:Models, Chemical; D037742:Nanotubes, Carbon / Q000737:chemistry*; D011789:Quantum Theory
chemical_list: D037742:Nanotubes, Carbon