ROLE OF NONBONDING ORBITALS, S MIXING, AND D-ORBITAL PARTICIPATION IN HYPERVALENT MOLECULES

被引：71

作者：

MUSHER, JI

机构：

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1972年 / 94卷 / 04期

关键词：

D O I：

10.1021/ja00759a063

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1370 / &

共 15 条

[1] NATURE OF CONFIGURATION-INTERACTION METHOD IN AB-INITIO CALCULATIONS .1. NE GROUND STATE [J].

BARR, TL ;

DAVIDSON, ER .

PHYSICAL REVIEW A, 1970, 1 (03) :644-&

[2] VESCF-MO STUDIES OF MOLECULES CONTAINING ATOMS FROM SECOND ROW OF PERIODIC TABLE .I. GENERAL PROBLEM [J].

BROWN, RD ;

PEEL, JB .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1968, 21 (11) :2589-&

[3] VESCF-MO STUDIES OF MOLECULES CONTAINING ATOMS FROM SECOND ROW OF PERIODIC TABLE .3. PROPERTIES OF TRIGONAL-BIPYRAMIDAL MOLECULES PHOSPHORUS PENTAFLUORIDE SULPHUR TETRAFLUORIDE AND CHLORINE TRIFLUORIDE FOR A MINIMAL BASIS SET INCLUDING 3D-ORBITALS [J].

BROWN, RD ;

PEEL, JB .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1968, 21 (11) :2617-&

[4] VESCF-MO STUDIES OF MOLECULES CONTAINING ATOMS FROM SECOND ROW OF PERIODIC TABLE .2. PROPERTIES OF FLUORIDES OF SILICON PHOSPHORUS SULPHUR AND CHLORINE FOR A MINIMAL BASIS SET EXCLUDING 3D-ORBITALS [J].

BROWN, RD ;

PEEL, JB .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1968, 21 (11) :2605-&

[5]

FLOREY JB, TO BE PUBLISHED

[6] ELECTRONIC PROPERTIES OF SF6 MOLECULE - AB-INITIO CALCULATION FOR GROUND-STATE [J].

GIANTURCO, FA ;

GUIDOTTI, C ;

LAMANNA, U ;

MOCCIA, R .

CHEMICAL PHYSICS LETTERS, 1971, 10 (03) :269-+

[7]

HOFFMANN R, TO BE PUBLISHED

[8]

JOHANSON G, 1971, CHEM PHYS LETTERS, V11, P466

[9] CHEMISTRY OF HYPERVALENT MOLECULES [J].

MUSHER, JI .

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 1969, 8 (01) :54-&

[10] A SPECULATION ON NEW MOLECULES [J].

MUSHER, JI .

SCIENCE, 1963, 141 (358) :736-&

← 1 2 →