ABINITIO TREATMENT OF THE RENNER-TELLER EFFECT FOR THE X2B1 AND A2A1 ELECTRONIC STATES OF NH-2

被引：66

作者：

BUENKER, RJ ^{[1
]}

PERIC, M ^{[1
]}

PEYERIMHOFF, SD ^{[1
]}

MARIAN, R ^{[1
]}

机构：

[1] UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER

来源：

MOLECULAR PHYSICS | 1981年 / 43卷 / 05期

关键词：

D O I：

10.1080/00268978100101821

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：987 / 1014

页数：28

共 39 条

[31] CALCULATION OF WAVEFUNCTIONS AND FREQUENCIES FOR NON-INFINITESIMAL VIBRATIONS - COMPARISON OF VARIOUS METHODS USING ABINITIO CL POTENTIAL CURVES [J].

PERIC, M ;

RUNAU, R ;

ROMELT, J ;

PEYERIMHOFF, SD ;

BUENKER, RJ .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1979, 78 (02) :309-332

[32]

PERIC M, UNPUBLISHED

[33] THEORETICAL-STUDY OF THE X2B1, A2A1, 2B2 VALENCE-SHELL AND THE 1ST PI-U23S-TYPE DOUBLET AND QUARTET RYDBERG STATES OF NH2 [J].

PEYERIMHOFF, SD ;

BUENKER, RJ .

CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 1979, 57 (24) :3182-3189

[34] GEOMETRY OF MOLECULES .I. WAVEFUNCTIONS FOR SOME SIX-AND EIGHT-ELECTRON POLYHYDRIDES [J].

PEYERIMHOFF, SD ;

BUENKER, RJ ;

ALLEN, LC .

JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (02) :734-+

[35]

POPLE, 1958, MOL PHYSICS, V1, P372

[36] THE RENNER EFFECT AND SPIN-ORBIT COUPLING [J].

POPLE, JA .

MOLECULAR PHYSICS, 1960, 3 (01) :16-22

[37] ELECTRONIC ABSORPTION-SPECTRUM OF NHD [J].

RAMSAY, DA ;

WAYNE, FD .

CANADIAN JOURNAL OF PHYSICS, 1979, 57 (05) :761-766

[38] ELECTRONIC SPECTRUM AND STRUCTURE OF THE FREE NH2 RADICAL [J].

RAMSAY, DA .

JOURNAL OF CHEMICAL PHYSICS, 1956, 25 (01) :188-189

[39]

RENNER, 1934, Z PHYS, V92, P172

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