ABINITIO CALCULATIONS ON THE SULFITE ION, SO32-, AND HYDROGEN SULFITE ION, HSO3- OR SO2OH-

被引：48

作者：

STROMBERG, A

GROPEN, O

WAHLGREN, U

LINDQVIST, O

机构：

[1] UNIV TROMSO,INST MATH & PHYS SCI,N-9001 TROMSO,NORWAY

[2] CHALMERS UNIV TECHNOL,S-41296 GOTHENBURG,SWEDEN

[3] GOTHENBURG UNIV,DEPT INORGAN CHEM,S-41124 GOTHENBURG,SWEDEN

来源：

INORGANIC CHEMISTRY | 1983年 / 22卷 / 07期

关键词：

D O I：

10.1021/ic00149a025

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

引用

页码：1129 / 1133

页数：5

共 21 条

[1] HYDROGEN-BOND STUDIES .66. AB-INITIO STUDIES OF CONFORMATION OF OXONIUM ION IN SOLIDS [J].

ALMLOF, J ;

WAHLGREN, U .

THEORETICA CHIMICA ACTA, 1973, 28 (02) :161-168

[2]

ANDERSEN LK, UNPUB

[3] ABINITIO SCF AND LIMITED CI CALCULATIONS ON D-D TRANSITIONS IN NIO [J].

BAGUS, PS ;

WAHLGREN, U .

MOLECULAR PHYSICS, 1977, 33 (03) :641-650

[4] ABINITIO MO CALCULATIONS FOR THE OXIDES, OXYACIDS, AND OXYANIONS OF S(IV) AND S(VI) [J].

BAIRD, NC ;

TAYLOR, KF .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1981, 2 (03) :225-230

[5] GEOMETRY OPTIMIZATION CALCULATIONS IN MOLECULES CONTAINING 2ND ROW ATOMS WITH VARIOUS POLARIZATION FUNCTION BASIS SETS [J].

CARLSEN, NR .

CHEMICAL PHYSICS LETTERS, 1977, 47 (02) :203-208

[6]

CRUIKSHANK DWJ, 1968, INORGANIC SULPHUR CH, pCH2

[7] ULTRAVIOLET ABSORPTION STUDIES OF THE BISULPHITE-PYROSULPHITE EQUILIBRIUM [J].

GOLDING, RM .

JOURNAL OF THE CHEMICAL SOCIETY, 1960, (OCT) :3711-3716

[8] CRYSTAL-STRUCTURE OF NAHSO4H2O [J].

GRIMVALL, S .

ACTA CHEMICA SCANDINAVICA, 1971, 25 (09) :3213-&

[9]

HAYNON E, 1972, J AM CHEM SOC, V94, P47

[10] ABINITIO SCF AND LIMITED CI CALCULATIONS OF D-D TRANSITIONS IN COBALT OXIDE [J].

JOHANSEN, H ;

WAHLGREN, U .

MOLECULAR PHYSICS, 1977, 33 (03) :651-661

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