NON-EMPIRICAL CI POTENTIAL CURVES FOR THE GROUND AND EXCITED-STATES OF PH AND ITS POSITIVE-ION

被引：72

作者：

BRUNA, PJ ^{[1
]}

HIRSCH, G ^{[1
]}

PEYERIMHOFF, SD ^{[1
]}

BUENKER, RJ ^{[1
]}

机构：

[1] GESAMTHSCH WUPPERTAL,LEHRSTUHL THEORET CHEM,D-5600 WUPPERTAL 1,FED REP GER

来源：

MOLECULAR PHYSICS | 1981年 / 42卷 / 04期

关键词：

D O I：

10.1080/00268978100100681

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：875 / 898

页数：24

共 37 条

[1] NON-EMPIRICAL SCF AND CI STUDY OF GROUND AND EXCITED-STATES OF THIOFORMALDEHYDE
BRUNA, PJ
PEYERIMHOFF, SD
BUENKER, RJ
CHEMICAL PHYSICS, 1974, 3 (01) : 35 - 53
[2] CI NON-EMPIRICAL PSEUDOPOTENTIAL CALCULATION OF VERTICAL VALENCE EXCITED-STATES OF IODINE MOLECULE
TEICHTEIL, C
MALRIEU, JP
CHEMICAL PHYSICS LETTERS, 1977, 49 (01) : 152 - 156
[3] A NON-EMPIRICAL STUDY OF THE INTERACTION OF NITROGEN-ATOMS IN THE GROUND AND EXCITED-STATES WITH THE HYDROGEN MOLECULE
MURAVEVA, NN
BARANOVSKII, VI
PANIN, AI
JOURNAL OF STRUCTURAL CHEMISTRY, 1980, 21 (06) : 716 - 719
[4] CONFIGURATION INTERACTION CALCULATIONS FOR GROUND AND EXCITED-STATES OF OZONE AND ITS POSITIVE-ION - ENERGY LOCATIONS AND TRANSITION-PROBABILITIES
THUNEMANN, KH
PEYERIMHOFF, SD
BUENKER, RJ
JOURNAL OF MOLECULAR SPECTROSCOPY, 1978, 70 (03) : 432 - 448
[5] ABINITIO SCF CL CALCULATIONS ON GROUND AND PI-PI-STAR EXCITED-STATES OF PYRROLE MOLECULE AND ITS POSITIVE-ION
TANAKA, K
NOMURA, T
NORO, T
TATEWAKI, H
TAKADA, T
KASHIWAGI, H
SASAKI, F
OHNO, K
JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (12): : 5738 - 5741
[6] THEORETICAL-STUDY OF THE PROPERTIES OF BC AND ITS POSITIVE-ION IN THEIR GROUND AND EXCITED ELECTRONIC STATES
HIRSCH, G
BUENKER, RJ
JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (10): : 6004 - 6011
[7] POTENTIAL CURVES FOR THE GROUND AND EXCITED-STATES OF THE NAN2 SYSTEM
HABITZ, P
CHEMICAL PHYSICS, 1980, 54 (01) : 131 - 138
[8] POTENTIAL-ENERGY CURVES FOR THE GROUND AND EXCITED-STATES OF A1H+
GUEST, MF
HIRST, DM
CHEMICAL PHYSICS LETTERS, 1981, 84 (01) : 167 - 171
[9] EMPIRICAL DETERMINATION OF THE POTENTIAL CURVES OF THE GROUND-STATE AND THE 1ST 2 EXCITED-STATES OF KR2
BARZEN, K
WOLLENWEBER, P
SCHMORANZER, H
CHEMICAL PHYSICS LETTERS, 1987, 142 (1-2) : 79 - 84
[10] POTENTIAL-ENERGY CURVES OF GROUND AND EXCITED-STATES OF TETRA HALOMETHANES AND THE NEGATIVE-IONS
ROSZAK, S
KAUFMAN, JJ
KOSKI, WS
VIJAYAKUMAR, M
BALASUBRAMANIAN, K
JOURNAL OF CHEMICAL PHYSICS, 1994, 101 (04): : 2978 - 2985

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