CALCULATION OF ELECTRONIC STRUCTURE OF CINNAMIC ACID BY SEMI-EMPIRICAL LCAO-SCF-MO METHOD

被引：14

|

作者：

NAKAMURA, K

KIKUCHI, S

机构：

来源：

BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN | 1967年 / 40卷 / 05期

关键词：

D O I：

10.1246/bcsj.40.1027

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

收藏

页码：1027 / +

相关论文

共 50 条

[1] CORRECT ORTHOGONALIZATION OF THE BASIS SET IN A SEMI-EMPIRICAL SCF-LCAO-MO CALCULATION
MOLDOVEANU, S
GRIGORAS, S
RUSU, I
MEDESAN, A
INDIAN JOURNAL OF CHEMISTRY SECTION A-INORGANIC BIO-INORGANIC PHYSICAL THEORETICAL & ANALYTICAL CHEMISTRY, 1979, 17 (03): : 211 - 217
[2] ON PARAMETERIZATION IN SEMI-EMPIRICAL LCAO MO METHOD
NAKAJIMA, T
BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN, 1965, 38 (01) : 83 - +
[3] PHOTOABSORPTION SPECTRA OF CARBANIONS .4. SEMI-EMPIRICAL LCAO-SCF-MO CALCULATIONS ACCORDING TO PARISER, PARR AND POPLE
HAFELINGER, G
STREITWI.A
WRIGHT, JS
BERICHTE DER BUNSEN-GESELLSCHAFT FUR PHYSIKALISCHE CHEMIE, 1969, 73 (05): : 456 - +
[4] ATOMIC PARAMETERS FOR SEMI-EMPIRICAL SCF-LCAO-MO CALCULATIONS
SICHEL, JM
WHITEHEA.MA
THEORETICA CHIMICA ACTA, 1967, 7 (01): : 32 - &
[5] SEMI-EMPIRICAL SCF LCAO MO STUDY OF HINDERED INTERNAL ROTATION IN FORMAMIDE
SHAW, KN
REEVES, LW
CHEMICAL PHYSICS LETTERS, 1971, 10 (02) : 89 - &
[6] THE SEMI-EMPIRICAL LCAO-MO METHOD OF ENERGY-SPECTRUM AND ELECTRONIC-STRUCTURE CALCULATION FOR OPEN-SHELL CLUSTERS
SHASHKIN, SY
NIKIFOROV, AE
CHEREPANOV, VI
PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1980, 97 (02): : 421 - 430
[7] SEMI-EMPIRICAL SCF-LCAO THEORY WITH OVERLAP
GLADNEY, HM
THEORETICA CHIMICA ACTA, 1963, 1 (03): : 245 - 256
[8] AN APPLICATION OF THE SEMI-EMPIRICAL MO-LCAO METHOD TO INDOXAZENE AND ANTHRANIL
DELRE, G
TETRAHEDRON, 1960, 10 (1-2) : 81 - 95
[9] SEMI-EMPIRICAL AND ABINITIO-LCAO-MO-SCF CALCULATIONS FOR THE STRUCTURE AND STABILITY OF HALOGENHYDRIDE-OLEFIN MOLECULE COMPLEXES
VOLKMANN, D
HEIDRICH, D
ZEITSCHRIFT FUR CHEMIE, 1982, 22 (02): : 69 - 69
[10] ELECTRONIC STRUCTURE OF CHLORINE TRIFLUORIDE - AN APPROXIMATE MO-LCAO-SCF CALCULATION
MANNE, R
THEORETICA CHIMICA ACTA, 1966, 6 (04): : 312 - &

← 1 2 3 4 5 →