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COMBINED SCF AND CI CALCULATIONS FOR LOW-LYING RYDBERG AND VALENCE EXCITED STATES OF ETHYLENE
被引:110
作者
:
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
KAMMER, WE
论文数:
0
引用数:
0
h-index:
0
KAMMER, WE
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1971年
/ 55卷
/ 02期
关键词
:
D O I
:
10.1063/1.1676148
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:814 / +
页数:1
相关论文
共 55 条
[1]
INTERPRETATION OF OPEN-SHELL SCF CALCULATIONS ON T AND V STATES OF ETHYLENE
[J].
BASCH, H
论文数:
0
引用数:
0
h-index:
0
BASCH, H
;
MCKOY, V
论文数:
0
引用数:
0
h-index:
0
MCKOY, V
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(05)
:1628
-&
[2]
ANALOG OF N-] TRANSITIONS IN MONO-OLEFINS
[J].
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(08)
:1934
-&
[3]
EXCITATION OF METHANE ETHANE ETHYLENE PROPYLENE ACETYLENE PROPYNE AND 1-BUTYNE BY LOW-ENERGY ELECTRON BEAMS
[J].
BOWMAN, CR
论文数:
0
引用数:
0
h-index:
0
BOWMAN, CR
;
MILLER, WD
论文数:
0
引用数:
0
h-index:
0
MILLER, WD
.
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(02)
:681
-&
[4]
THEORETICAL STUDY OF ROTATIONAL BARRIERS OF ALLENE ETHYLENE AND RELATED SYSTEMS
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
BUENKER, RJ
.
JOURNAL OF CHEMICAL PHYSICS,
1968,
48
(03)
:1368
-&
[5]
COMBINED SCF AND CI METHOD FOR CALCULATION OF ELECTRONICALLY EXCITED STATES MOLECULES - POTENTIAL CURVES FOR LOW-LYING STATES OF FORMALDEHYDE
[J].
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
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(04)
:1368
-+
[6]
THEORETICAL ANALYSIS OF EFFECTS OF HYDROGENATION IN HYDROCARBONS - ACCURATE SCF MO WAVEFUNCTIONS FOR C2H2 C2H4 AND C2H6
[J].
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
;
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(06)
:2029
-+
[7]
COTTON FA, 1966, CHEMICAL APPLICATION
[8]
LOW-ENERGY LARGE-ANGLE ELECTRON-IMPACT SPECTRA - HELIUM NITROGEN ETHYLENE AND BENZENE
[J].
DOERING, JP
论文数:
0
引用数:
0
h-index:
0
DOERING, JP
;
WILLIAMS, AJ
论文数:
0
引用数:
0
h-index:
0
WILLIAMS, AJ
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(10)
:4180
-&
[9]
LOW-ENERGY LARGE-ANGLE ELECTRON-IMPACT SPECTRUM OF ETHYLENE
[J].
DOERING, JP
论文数:
0
引用数:
0
h-index:
0
DOERING, JP
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(03)
:1194
-&
[10]
The theoretical description of the (pi pi*) excited states of ethylene
[J].
Dunning, T. H., Jr.
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Dunning, T. H., Jr.
;
Huntt, W. J.
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Huntt, W. J.
;
Goddard, W. A., III
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Goddard, W. A., III
.
CHEMICAL PHYSICS LETTERS,
1969,
4
(03)
:147
-150
←
1
2
3
4
5
6
→
共 55 条
[1]
INTERPRETATION OF OPEN-SHELL SCF CALCULATIONS ON T AND V STATES OF ETHYLENE
[J].
BASCH, H
论文数:
0
引用数:
0
h-index:
0
BASCH, H
;
MCKOY, V
论文数:
0
引用数:
0
h-index:
0
MCKOY, V
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(05)
:1628
-&
[2]
ANALOG OF N-] TRANSITIONS IN MONO-OLEFINS
[J].
BERRY, RS
论文数:
0
引用数:
0
h-index:
0
BERRY, RS
.
JOURNAL OF CHEMICAL PHYSICS,
1963,
38
(08)
:1934
-&
[3]
EXCITATION OF METHANE ETHANE ETHYLENE PROPYLENE ACETYLENE PROPYNE AND 1-BUTYNE BY LOW-ENERGY ELECTRON BEAMS
[J].
BOWMAN, CR
论文数:
0
引用数:
0
h-index:
0
BOWMAN, CR
;
MILLER, WD
论文数:
0
引用数:
0
h-index:
0
MILLER, WD
.
JOURNAL OF CHEMICAL PHYSICS,
1965,
42
(02)
:681
-&
[4]
THEORETICAL STUDY OF ROTATIONAL BARRIERS OF ALLENE ETHYLENE AND RELATED SYSTEMS
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
BUENKER, RJ
.
JOURNAL OF CHEMICAL PHYSICS,
1968,
48
(03)
:1368
-&
[5]
COMBINED SCF AND CI METHOD FOR CALCULATION OF ELECTRONICALLY EXCITED STATES MOLECULES - POTENTIAL CURVES FOR LOW-LYING STATES OF FORMALDEHYDE
[J].
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
.
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(04)
:1368
-+
[6]
THEORETICAL ANALYSIS OF EFFECTS OF HYDROGENATION IN HYDROCARBONS - ACCURATE SCF MO WAVEFUNCTIONS FOR C2H2 C2H4 AND C2H6
[J].
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
;
WHITTEN, JL
论文数:
0
引用数:
0
h-index:
0
WHITTEN, JL
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(06)
:2029
-+
[7]
COTTON FA, 1966, CHEMICAL APPLICATION
[8]
LOW-ENERGY LARGE-ANGLE ELECTRON-IMPACT SPECTRA - HELIUM NITROGEN ETHYLENE AND BENZENE
[J].
DOERING, JP
论文数:
0
引用数:
0
h-index:
0
DOERING, JP
;
WILLIAMS, AJ
论文数:
0
引用数:
0
h-index:
0
WILLIAMS, AJ
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(10)
:4180
-&
[9]
LOW-ENERGY LARGE-ANGLE ELECTRON-IMPACT SPECTRUM OF ETHYLENE
[J].
DOERING, JP
论文数:
0
引用数:
0
h-index:
0
DOERING, JP
.
JOURNAL OF CHEMICAL PHYSICS,
1967,
46
(03)
:1194
-&
[10]
The theoretical description of the (pi pi*) excited states of ethylene
[J].
Dunning, T. H., Jr.
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Dunning, T. H., Jr.
;
Huntt, W. J.
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Huntt, W. J.
;
Goddard, W. A., III
论文数:
0
引用数:
0
h-index:
0
机构:
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
CALTECH, Arthur Amos Noyes Lab Chem Phys, Pasadena, CA 91109 USA
Goddard, W. A., III
.
CHEMICAL PHYSICS LETTERS,
1969,
4
(03)
:147
-150
←
1
2
3
4
5
6
→