Hydrogen storage in carbon nanotubes

被引:20
作者
Lee, SM
An, KH
Kim, WS
Lee, YH [1 ]
Park, YS
Seifert, G
Frauenheim, T
机构
[1] Jeonbuk Natl Univ, Dept Semicond Sci & Technol, Natl Res Lab, Jeonju 561756, South Korea
[2] Jeonbuk Natl Univ, Semicond Phys Res Ctr, Jeonju 561756, South Korea
[3] Univ Gesamthsch Paderborn, Fachbereich Phys, D-33095 Paderborn, Germany
关键词
density functional calculations; local density approximations; fullerenes and derivatives;
D O I
10.1016/S0379-6779(00)00667-6
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
Several hydrogen adsorption and stored geometries on carbon nanotubes are identified by density-functional calculations. Hydrogens can be stored in an arch type or zigzag type up to coverage 1.0, and stored inside capillary with higher coverage. The C-H bond formation changes the electronic structures of metallic carbon nanotubes to semiconductors. It suggest that doping or additional conductive materials to the nanotube electrode is required in electrochemical hydrogen storage process.
引用
收藏
页码:1189 / 1190
页数:2
相关论文
共 6 条
[1]   Storage of hydrogen in single-walled carbon nanotubes [J].
Dillon, AC ;
Jones, KM ;
Bekkedahl, TA ;
Kiang, CH ;
Bethune, DS ;
Heben, MJ .
NATURE, 1997, 386 (6623) :377-379
[2]   Hydrogen adsorption in carbon materials [J].
Dresselhaus, MS ;
Williams, KA ;
Eklund, PC .
MRS BULLETIN, 1999, 24 (11) :45-50
[3]   Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties [J].
Elstner, M ;
Porezag, D ;
Jungnickel, G ;
Elsner, J ;
Haugk, M ;
Frauenheim, T ;
Suhai, S ;
Seifert, G .
PHYSICAL REVIEW B, 1998, 58 (11) :7260-7268
[4]   Hydrogen adsorption and storage in carbon nanotubes [J].
Lee, SM ;
Park, KS ;
Choi, YC ;
Park, YS ;
Bok, JM ;
Bae, DJ ;
Nahm, KS ;
Choi, YG ;
Yu, SC ;
Kim, NG ;
Frauenheim, T ;
Lee, YH .
SYNTHETIC METALS, 2000, 113 (03) :209-216
[5]   Hydrogen storage in single-walled carbon nanotubes [J].
Lee, SM ;
Lee, YH .
APPLIED PHYSICS LETTERS, 2000, 76 (20) :2877-2879
[6]   Electrochemical storage of hydrogen in nanotube materials [J].
Nützenadel, C ;
Züttel, A ;
Chartouni, D ;
Schlapbach, L .
ELECTROCHEMICAL AND SOLID STATE LETTERS, 1999, 2 (01) :30-32