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

[31] MULTIREFERENCE CONFIGURATION-INTERACTION CALCULATION OF THE POTENTIAL-ENERGY CURVES FOR O-H BOND BREAKING IN THE GROUND AND LOWEST EXCITED-STATES OF THE WATER MONOMER AND DIMER
SOSA, RM
GARDIOL, P
VENTURA, ON
JOURNAL OF MOLECULAR STRUCTURE, 1993, 297 : 337 - 345
[32] AB-INITIO STUDY OF THE PREDISSOCIATION PROCESSES OF THE GROUND AND 1ST EXCITED-STATES OF N2O+ - POTENTIAL CURVES OF THE LOWEST STATES OF N2O+
KOMIHA, N
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1994, 112 (2-3): : 313 - 320
[33] ABINITIO SCF AND CI STUDY OF HCS+-CSH+ SYSTEM - POTENTIAL SURFACES FOR HYDROGEN ABSTRACTION AND INTER-NUCLEAR BENDING FOR GROUND AND EXCITED-STATES AND VERTICAL SPECTRUM FOR HCS+
BRUNA, PJ
PEYERIMHOFF, SD
BUENKER, RJ
CHEMICAL PHYSICS, 1978, 27 (01) : 33 - 43
[34] CHARACTERIZATION OF GROUND AND ELECTRONICALLY EXCITED-STATES OF ORTHO-HYDROXYBENZALDEHYDE AND ITS NON-HYDROGEN-BONDED PHOTOROTAMER IN 12-K RARE-GAS MATRICES
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ORTON, E
PIMENTEL, GC
JOURNAL OF PHYSICAL CHEMISTRY, 1990, 94 (20): : 7927 - 7935
[35] CONFIGURATION-INTERACTION CALCULATIONS ON THE X 1-SIGMA+ GROUND-STATE AND LOW-LYING A 1-PI AND 1-DELTA EXCITED-STATES OF THE PN MOLECULE .2. POTENTIAL-ENERGY CURVES OF THE A 1-PI AND 1-DELTA EXCITED-STATES OF PN AND SPECTROSCOPIC PROPERTIES
DEBROUCKERE, G
FELLER, D
KOOT, JJA
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1993, 26 (13) : 1915 - 1934
[36] POTENTIAL-ENERGY CURVES OF M(NP(2)P)CENTER-DOT-RG((2)-UPI) EXCITED-STATES AND M+CENTER-DOT-RG GROUND-STATES (M=LI, NA - RG=HE, NE)
BILILIGN, S
GUTOWSKI, M
SIMONS, J
BRECKENRIDGE, WH
JOURNAL OF CHEMICAL PHYSICS, 1994, 100 (11): : 8212 - 8218
[37] CONFIGURATION-INTERACTION CALCULATIONS ON THE X(1)SIGMA+ GROUND-STATE AND LOW-LYING A(1)PI AND (1)DELTA EXCITED-STATES OF THE PN MOLECULE .2. POTENTIAL-ENERGY CURVES OF THE A(1)PI AND (1)DELTA EXCITED-STATES OF PN AND SPECTROSCOPIC PROPERTIES (VOL 26, PG 1915, 1993)
DEBROUCKERE, G
FELLER, D
KOOT, JJA
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1993, 26 (16) : 2741 - 2741

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