ABINITIO STUDY OF STRUCTURE AND VIBRATIONAL-SPECTRA OF SN+, SN, AND S2N2

被引：41

作者：

KARPFEN, A

SCHUSTER, P

PETKOV, J

LISCHKA, H

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1978年 / 68卷 / 08期

关键词：

D O I：

10.1063/1.436196

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：

引用

页码：3884 / 3890

页数：7

共 38 条

[1] STRUCTURE OF DISULFUR DINITRIDE [J].

ADKINS, R ;

DELL, R ;

TURNER, AG .

JOURNAL OF MOLECULAR STRUCTURE, 1976, 31 (02) :403-406

[2] PNO-CI (PAIR NATURAL ORBITAL CONFIGURATION INTERACTION) AND CEPA-PNO (COUPLED ELECTRON PAIR APPROXIMATION WITH PAIR NATURAL ORBITALS) CALCULATIONS OF MOLECULAR SYSTEMS .1. OUTLINE OF METHOD FOR CLOSED-SHELL STATES [J].

AHLRICHS, R ;

LISCHKA, H ;

STAEMMLER, V ;

KUTZELNIGG, W .

JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (04) :1225-1234

[3]

AHLRICHS R, 1975, J CHEM PHYS, V63, P4685, DOI 10.1063/1.431254

[4]

AHLRICHS R, 1973, CHEM PHYS LETT, V23, P571

[5]

BOYS SF, 1967, QUANTUM THEORY ATOMS, P253

[6] VIBRATIONAL SPECTRA AND STRUCTURE OF S4N4 AND S2N2 [J].

BRAGIN, J ;

EVANS, MV .

JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (01) :268-&

[7] FREE-ELECTRON MOLECULAR-ORBITAL CALCULATIONS FOR INORGANIC SYSTEMS .1. AN ELECTRON ON A SPHERE MODEL FOR TETRASULPHUR TETRANITRIDE AND FTR TETRA-ARSENIC TETRASULPHIDE [J].

CHAPMAN, D ;

WADDINGTON, TC .

TRANSACTIONS OF THE FARADAY SOCIETY, 1962, 58 (477) :1679-&

[8]

COLLINS MPS, 1976, CHEM COMMUN, P701

[9]

Decius J. C., 1955, MOLECULAR VIBRATIONS

[10] MOLECULAR-ORBITAL STUDIES OF S2N2, (SN)2, AND (SN)3 USING A MINIMAL BASIS SET [J].

DEUTSCH, PW ;

CURTISS, LA .

CHEMICAL PHYSICS LETTERS, 1977, 51 (01) :125-131

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