学术探索
学术期刊
新闻热点
数据分析
智能评审
立即登录
THEORETICAL STUDY OF CURVE CROSSING - AB-INITIO CALCULATIONS ON 4 LOWEST 1SIGMA+ STATES OF LIF
被引:117
作者
:
KAHN, LR
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST,COLUMBUS,OH 43201
KAHN, LR
HAY, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST,COLUMBUS,OH 43201
HAY, PJ
机构
:
[1]
BATTELLE MEM INST,COLUMBUS,OH 43201
[2]
OHIO STATE UNIV,DEPT CHEM,COLUMBUS,OH 43210
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1974年
/ 61卷
/ 09期
关键词
:
D O I
:
10.1063/1.1682533
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
收藏
页码:3530 / 3546
页数:17
相关论文
共 54 条
[1]
MULTISTRUCTURE VALENCE-BOND AND ATOMS-IN-MOLECULES CALCULATIONS FOR LIF F2 AND F2-
BALINTKURTI, GG
论文数:
0
引用数:
0
h-index:
0
BALINTKURTI, GG
KARPLUS, M
论文数:
0
引用数:
0
h-index:
0
KARPLUS, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
50
(01)
: 478
-
+
[2]
ABSORPTION SPECTRUM OF GASEOUS F- AND ELECTRON AFFINITIES OF HALOGEN ATOMS
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
REIMANN, CW
论文数:
0
引用数:
0
h-index:
0
REIMANN, CW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(07)
: 1540
-
&
[3]
INTERACTION OF VIBRATIONAL AND ELECTRONIC MOTION IN ALKALI HALIDE MOLECULES
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
27
(06)
: 1288
-
1295
[4]
PERTURBATION-THEORY AND IONIC MODELS FOR ALKALI-HALIDE SYSTEMS .1. DIATOMICS
BRUMER, P
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
BRUMER, P
KARPLUS, M
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
KARPLUS, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(09)
: 3903
-
3918
[5]
COMBINED SCF AND CI METHOD FOR CALCULATION OF ELECTRONICALLY EXCITED STATES MOLECULES - POTENTIAL CURVES FOR LOW-LYING STATES OF FORMALDEHYDE
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
BUENKER, RJ
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
PEYERIMHOFF, SD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(04)
: 1368
-
+
[6]
THERMAL ENERGY SCATTERING OF ALKALI ATOMS FROM HALOGEN ATOMS AND MOLECULES - EFFECT OF CURVE CROSSING
CHILD, MS
论文数:
0
引用数:
0
h-index:
0
机构:
Physical Chemistry Laboratory, Oxford, South Parks Road
CHILD, MS
[J].
MOLECULAR PHYSICS,
1969,
16
(04)
: 313
-
&
[7]
CLEMENTI E, 1964, PHYS REV A, V133, P419
[8]
ATOMIC POLARIZABILITIES AND SHIELDING FACTORS
DALGARNO, A
论文数:
0
引用数:
0
h-index:
0
DALGARNO, A
[J].
ADVANCES IN PHYSICS,
1962,
11
(44)
: 281
-
315
[9]
MULTICONFIGURATION SELF-CONSISTENT FIELD (MCSCF) THEORY FOR EXCITED-STATES
DAS, G
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB,CHEM DIV,ARGONNE,IL 60439
ARGONNE NATL LAB,CHEM DIV,ARGONNE,IL 60439
DAS, G
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(11)
: 5104
-
5110
[10]
LIH POTENTIAL CURVES AND WAVEFUNCTIONS FOR X1SIGMA+, A1SIGMA+, B1PI,3SIGMA+, AND 3PI
DOCKEN, KK
论文数:
0
引用数:
0
h-index:
0
DOCKEN, KK
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
[J].
JOURNAL OF CHEMICAL PHYSICS,
1972,
57
(11)
: 4928
-
&
←
1
2
3
4
5
6
→
共 54 条
[1]
MULTISTRUCTURE VALENCE-BOND AND ATOMS-IN-MOLECULES CALCULATIONS FOR LIF F2 AND F2-
BALINTKURTI, GG
论文数:
0
引用数:
0
h-index:
0
BALINTKURTI, GG
KARPLUS, M
论文数:
0
引用数:
0
h-index:
0
KARPLUS, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
50
(01)
: 478
-
+
[2]
ABSORPTION SPECTRUM OF GASEOUS F- AND ELECTRON AFFINITIES OF HALOGEN ATOMS
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
REIMANN, CW
论文数:
0
引用数:
0
h-index:
0
REIMANN, CW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(07)
: 1540
-
&
[3]
INTERACTION OF VIBRATIONAL AND ELECTRONIC MOTION IN ALKALI HALIDE MOLECULES
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
[J].
JOURNAL OF CHEMICAL PHYSICS,
1957,
27
(06)
: 1288
-
1295
[4]
PERTURBATION-THEORY AND IONIC MODELS FOR ALKALI-HALIDE SYSTEMS .1. DIATOMICS
BRUMER, P
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
BRUMER, P
KARPLUS, M
论文数:
0
引用数:
0
h-index:
0
机构:
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138
KARPLUS, M
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(09)
: 3903
-
3918
[5]
COMBINED SCF AND CI METHOD FOR CALCULATION OF ELECTRONICALLY EXCITED STATES MOLECULES - POTENTIAL CURVES FOR LOW-LYING STATES OF FORMALDEHYDE
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
BUENKER, RJ
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
PEYERIMHOFF, SD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(04)
: 1368
-
+
[6]
THERMAL ENERGY SCATTERING OF ALKALI ATOMS FROM HALOGEN ATOMS AND MOLECULES - EFFECT OF CURVE CROSSING
CHILD, MS
论文数:
0
引用数:
0
h-index:
0
机构:
Physical Chemistry Laboratory, Oxford, South Parks Road
CHILD, MS
[J].
MOLECULAR PHYSICS,
1969,
16
(04)
: 313
-
&
[7]
CLEMENTI E, 1964, PHYS REV A, V133, P419
[8]
ATOMIC POLARIZABILITIES AND SHIELDING FACTORS
DALGARNO, A
论文数:
0
引用数:
0
h-index:
0
DALGARNO, A
[J].
ADVANCES IN PHYSICS,
1962,
11
(44)
: 281
-
315
[9]
MULTICONFIGURATION SELF-CONSISTENT FIELD (MCSCF) THEORY FOR EXCITED-STATES
DAS, G
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB,CHEM DIV,ARGONNE,IL 60439
ARGONNE NATL LAB,CHEM DIV,ARGONNE,IL 60439
DAS, G
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(11)
: 5104
-
5110
[10]
LIH POTENTIAL CURVES AND WAVEFUNCTIONS FOR X1SIGMA+, A1SIGMA+, B1PI,3SIGMA+, AND 3PI
DOCKEN, KK
论文数:
0
引用数:
0
h-index:
0
DOCKEN, KK
HINZE, J
论文数:
0
引用数:
0
h-index:
0
HINZE, J
[J].
JOURNAL OF CHEMICAL PHYSICS,
1972,
57
(11)
: 4928
-
&
←
1
2
3
4
5
6
→