AB-INITIO CALCULATIONS OF SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .12. IONS CH+5 AND CH-5

被引：106

作者：

DYCZMONS, V

KUTZELNIGG, W

机构：

[1] UNIV GOTTINGEN, LEHRSTUHL THEORET CHEM, GOTTINGEN, WEST GERMANY

[2] RUHR UNIV BOCHUM, LEHRSTUHL THEORET CHEM, GEBAUDE NC-03 OG NORD, UNIVERSITATS STR 150, D-4630 BOCHUM, WEST GERMANY

来源：

THEORETICA CHIMICA ACTA | 1974年 / 33卷 / 03期

关键词：

D O I：

10.1007/BF00551258

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：239 / 247

页数：9

共 50 条

[1] AB-INITIO CALCULATIONS ON SMALL HYDRIDES INCLUDING ELECTRON CORRELATION
DRIESSLER, F
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[J]. THEORETICA CHIMICA ACTA, 1973, 30 (04): : 315 - 326
[2] Ab-initio calculations of small hydrides including electron correlation
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[J]. CHEMICAL PHYSICS LETTERS, 1970, 5 (04) : 241 - 242
[3] Ab-initio calculations of small hydrides including electron correlation : II. Preliminary results for the CH4 ground state
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[J]. CHEMICAL PHYSICS LETTERS, 1968, 1 (13) : 651 - 654
[4] AB-INITIO CALCULATIONS ON SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .10. TRIPLET-SINGLET ENERGY SEPARATION AND OTHER PROPERTIES OF CH2 RADICAL
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[J]. THEORETICA CHIMICA ACTA, 1973, 31 (01): : 49 - 61
[5] AB-INITIO CALCULATIONS OF SMALL HYDRIDES INCLUDING ELECTRON CORRELATION - 2 LOWEST STATES OF BH2 RADICAL
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[J]. CHEMICAL PHYSICS LETTERS, 1972, 16 (01) : 187 - +
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[J]. THEORETICA CHIMICA ACTA, 1970, 17 (05): : 339 - &
[7] AB-INITIO CALCULATIONS OF SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .8. EQUILIBRIUM GEOMETRY AND HARMONIC FORCE CONSTANTS OF BH3
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[J]. THEORETICA CHIMICA ACTA, 1973, 28 (02): : 103 - 110
[8] AB-INITIO CALCULATIONS OF SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .4. STUDY OF CORRELATION ENERGY OF BH GROUND STATE AND ITS DEPENDENCE ON INTERNUCLEAR DISTANCE
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[J]. THEORETICA CHIMICA ACTA, 1971, 21 (01): : 63 - +
[9] AB INITIO CALCULATIONS ON SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .I. BEH2 MOLECULE IN ITS GROUND STATE
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[J]. THEORETICA CHIMICA ACTA, 1968, 10 (05): : 377 - &
[10] AB-INITIO CALCULATIONS ON SMALL HYDRIDES INCLUDING ELECTRON CORRELATION .4. A STUDY OF MOLECULES BEH2, BE2H4 AND BE3H6
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