Resonant processes and Coulomb interactions in (C59N)2

被引:15
|
作者
Schulte, K.
Wang, L.
Moriarty, P. J.
Prassides, K.
Tagmatarchis, N.
机构
[1] Univ Nottingham, Sch Phys & Astron, Nottingham NG7 2RD, England
[2] Univ Sci Labs, Dept Chem, Durham DH1 3LE, England
[3] Natl Hellen Res Fdn, Inst Theoret & Phys Chem, GR-11635 Athens, Greece
来源
JOURNAL OF CHEMICAL PHYSICS | 2007年 / 126卷 / 18期
基金
英国工程与自然科学研究理事会;
关键词
D O I
10.1063/1.2730787
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We have determined the on-site molecular Coulomb interaction energy U of a (C59N)(2) bulk film and find values ranging from 1.10 +/- 0.10 eV for the highest occupied molecular orbital to 1.35 +/- 0.10 eV for the deeper lying orbitals, comparable to values found in C-60. The on-site Coulomb interaction between a carbon core hole and valence electrons, U-c, is, however, substantially lower than in C-60 at 1.35 +/- 0.07 eV. Resonant photoemission (RESPES) results show a weakened participator decay channel, especially around the N 1s threshold, where resonance of the highest occupied molecular orbital shoulder is absent. Near-edge x-ray absorption fine structure and constant initial state measurements, taken in parallel with the RESPES data, indicate, however, that matrix element effects cannot be ruled out. (C) 2007 American Institute of Physics.
引用
收藏
页数:6
相关论文
共 50 条
  • [31] The electronic structure of (C59N)2 from high energy spectroscopy
    Haffner, S
    Pichler, T
    Knupfer, M
    Umlauf, B
    Friedlein, R
    Golden, MS
    Fink, J
    Keshavarz-K, M
    Bellavia-Lund, C
    Sastre, A
    Hummelen, JC
    Wudl, F
    EUROPEAN PHYSICAL JOURNAL B, 1998, 1 (01): : 11 - 17
  • [32] Chemisorption of azafullerene on silicon:: isolating C59N monomers
    Butcher, MJ
    Jones, FH
    Cotier, BN
    Taylor, MDR
    Moriarty, P
    Beton, PH
    Prassides, K
    Tagmatarchis, N
    Comicioli, C
    Ottaviani, C
    Crotti, C
    MATERIALS SCIENCE AND ENGINEERING B-SOLID STATE MATERIALS FOR ADVANCED TECHNOLOGY, 2000, 74 (1-3): : 202 - 205
  • [33] Photolysis of (C59N)(2) studied by time-resolved EPR
    Gruss, A
    Dinse, KP
    Hirsch, A
    Nuber, B
    Reuther, U
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1997, 119 (37) : 8728 - 8729
  • [34] ESR signal in azafullerene (C59N)(2) induced by thermal homolysis
    Simon, F
    Arcon, D
    Tagmatarchis, N
    Garaj, S
    Forro, L
    Prassides, K
    JOURNAL OF PHYSICAL CHEMISTRY A, 1999, 103 (35): : 6969 - 6971
  • [35] Effect of high hydrostatic pressure on the intramolecular modes of (C59N)2
    Arvanitidis, J
    Papagelis, K
    Meletov, KP
    Kourouklis, GA
    Ves, S
    Kordatos, K
    Wudl, F
    Prassides, K
    PHYSICAL REVIEW B, 1999, 59 (04): : 3180 - 3183
  • [36] C59N单分子整流器
    王克东
    李斌
    杨金龙
    侯建国
    物理, 2006, (03) : 188 - 192
  • [37] Production of C59N:C60 solid solution
    Fülöp, F
    Rockenbauer, A
    Simon, F
    Pekker, S
    Korecz, L
    Garaj, S
    Jánossy, A
    NANONETWORK MATERIALS: FULLERENES, NANOTUBES AND RELATED SYSTEMS, 2001, 590 : 329 - 332
  • [38] C59N on silicon surfaces:: monomers, dimers and multilayers
    Butcher, MJ
    Jones, FH
    Beton, PH
    Moriarty, P
    Prassides, K
    Tagmatarchis, N
    ELECTRONIC PROPERTIES OF NOVEL MATERIALS - SCIENCE AND TECHNOLOGY OF MOLECULAR NANOSTRUCTURES, 1999, 486 : 165 - 169
  • [39] Investigations of thick films of C59N doped with potassium
    Marenne, I
    Rudolf, P
    Schiessling, J
    Brühwiler, PA
    Silien, C
    Auerhammer, J
    Pichler, T
    Golden, MS
    Tagmatarchis, N
    Prassides, K
    ELECTRONIC PROPERTIES OF MOLECULAR NANOSTRUCTURES, 2001, 591 : 20 - 24
  • [40] Theoretical investigation of the heterofullerenes C59N and C69N and their dimers
    Ren, AM
    Feng, JK
    Sun, XY
    Li, W
    Tian, WQ
    Sun, CC
    Zheng, XH
    Zerner, MC
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2000, 78 (06) : 422 - 436