1ST-PRINCIPLE CALCULATIONS OF THE IONIZATION-POTENTIALS AND ELECTRON-AFFINITIES OF THE SPHEROIDAL MOLECULES C-60 AND LAC60

被引：94

作者：

ROSEN, A ^{[1
]}

WASTBERG, B ^{[1
]}

机构：

[1] GOTHENBURG UNIV, S-41296 GOTHENBURG, SWEDEN

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1988年 / 110卷 / 26期

关键词：

D O I：

10.1021/ja00234a024

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

收藏

页码：8701 / 8703

页数：3

相关论文

共 25 条

[1] HIGH-PRESSURE PROPERTIES OF GRAPHITE AND ITS INTERCALATION COMPOUNDS
CLARKE, R
UHER, C
[J]. ADVANCES IN PHYSICS, 1984, 33 (05) : 469 - 566
[2] CARBON CLUSTERS REVISITED - THE SPECIAL BEHAVIOR OF C-60 AND LARGE CARBON CLUSTERS
COX, DM
REICHMANN, KC
KALDOR, A
[J]. JOURNAL OF CHEMICAL PHYSICS, 1988, 88 (03) : 1588 - 1597
[3] C60LA - A DEFLATED SOCCER BALL
COX, DM
TREVOR, DJ
REICHMANN, KC
KALDOR, A
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108 (09) : 2457 - 2458
[4] DELBENE J, 1968, J CHEM PHYS, V48, P4050
[5] DELBENE J, 1968, J CHEM PHYS, V48, P1807
[6] THE UV ABSORPTION-SPECTRUM OF C-60 (BUCKMINSTERFULLERENE) - A NARROW-BAND AT 3860-A
HEATH, JR
CURL, RF
SMALLEY, RE
[J]. JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (07) : 4236 - 4238
[7] LANTHANUM COMPLEXES OF SPHEROIDAL CARBON SHELLS
HEATH, JR
OBRIEN, SC
ZHANG, Q
LIU, Y
CURL, RF
KROTO, HW
TITTEL, FK
SMALLEY, RE
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (25) : 7779 - 7780
[8] IONSHITA T, 1986, PHYS REV LETT, V57, P2560
[9] KALDOR A, 1986, Z PHYS D, V3, P95
[10] SELF-CONSISTENT EQUATIONS INCLUDING EXCHANGE AND CORRELATION EFFECTS
KOHN, W
SHAM, LJ
[J]. PHYSICAL REVIEW, 1965, 140 (4A): : 1133 - &