MATCHING POLYNOMIALS OF FULLERENE CLUSTERS

被引：35

作者：

BALASUBRAMANIAN, K

机构：

[1] Department of Chemistry and Biochemistry, Arizona State University, Tempe

来源：

CHEMICAL PHYSICS LETTERS | 1993年 / 201卷 / 1-4期

关键词：

D O I：

10.1016/0009-2614(93)85075-Y

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：

Matching polynomials of fullerene cages for C20-C50 are computed and analyzed. Based on these results the first few coefficients of the matching polynomials of C60-C90 cages are obtained. The matching polynomials thus computed are useful in the characterization of aromaticities, computation of the grand canonical partition functions, resonance energies, thermodynamic properties, topological indices and properties of these cages.

引用

页码：306 / 314

页数：9

共 39 条

[1] COMPUTER-GENERATION OF SPECTRA OF GRAPHS - APPLICATIONS TO C60 CLUSTERS AND OTHER SYSTEMS
BALASUBRAMANIAN, K
LIU, XY
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1988, 9 (04) : 406 - 415
[2] CHARACTERISTIC-POLYNOMIALS OF FULLERENE CAGES
BALASUBRAMANIAN, K
[J]. CHEMICAL PHYSICS LETTERS, 1992, 198 (06) : 577 - 586
[3] COMPUTER-GENERATION OF CHARACTERISTIC-POLYNOMIALS OF EDGE-WEIGHTED GRAPHS, HETEROGRAPHS, AND DIRECTED-GRAPHS
BALASUBRAMANIAN, K
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1988, 9 (03) : 204 - 211
[4] TREE PRUNING AND LATTICE STATISTICS ON BETHE LATTICES
Balasubramanian, K.
[J]. JOURNAL OF MATHEMATICAL CHEMISTRY, 1988, 2 (01) : 69 - 82
[5] APPLICATIONS OF COMBINATORICS AND GRAPH-THEORY TO SPECTROSCOPY AND QUANTUM-CHEMISTRY
BALASUBRAMANIAN, K
[J]. CHEMICAL REVIEWS, 1985, 85 (06) : 599 - 618
[6] COMPUTER-GENERATION OF THE CHARACTERISTIC-POLYNOMIALS OF CHEMICAL GRAPHS
BALASUBRAMANIAN, K
[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY, 1984, 5 (04) : 387 - 394
[7] THE USE OF FRAMES METHOD FOR THE CHARACTERISTIC-POLYNOMIALS OF CHEMICAL GRAPHS
BALASUBRAMANIAN, K
[J]. THEORETICA CHIMICA ACTA, 1984, 65 (01): : 49 - 58
[8] BALASUBRAMANIAN K, 1986, MATH COMPUTATIONAL C
[9] CURL RF, 1991, SCI AM OCT, P54
[10] A THEORETICAL STUDY OF pi-HYDROCARBON-IRON TRICARBONYL COMPLEXES
Dias, Jerry Ray
[J]. JOURNAL OF MATHEMATICAL CHEMISTRY, 1990, 4 (01) : 127 - 142

← 1 2 3 4 →