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CONFIGURATION INTERACTION CALCULATION OF POTENTIAL CURVES FOR C3 MOLECULE IN ITS GROUND AND LOWEST-LYING PI-U STATES
被引:55
作者
:
PERICRADIC, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER
PERICRADIC, J
ROMELT, J
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER
ROMELT, J
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER
PEYERIMHOFF, SD
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER
BUENKER, RJ
机构
:
[1]
UNIV BONN,LEHRSTUHL THEORET CHEM,D-5300 BONN 1,FED REP GER
[2]
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
[3]
GESAMTHSCH WUPPERTAL,LEHRSTUHL THEORET,D-5600 WUPPERTAL,FED REP GER
来源
:
CHEMICAL PHYSICS LETTERS
|
1977年
/ 50卷
/ 02期
关键词
:
D O I
:
10.1016/0009-2614(77)80197-8
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:344 / 350
页数:7
相关论文
共 36 条
[1]
Spectra of C-3 in Solidified Gases at 4 degrees and 20 degrees K
[J].
Barger, R. L.
论文数:
0
引用数:
0
h-index:
0
机构:
US Natl Bur Stand, Boulder, CO USA
US Natl Bur Stand, Boulder, CO USA
Barger, R. L.
;
Broida, H. P.
论文数:
0
引用数:
0
h-index:
0
机构:
US Natl Bur Stand, Boulder, CO USA
US Natl Bur Stand, Boulder, CO USA
Broida, H. P.
.
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(07)
:2364
-2370
[2]
ABSORPTION SPECTRUM OF CARBON VAPOR IN SOLID ARGON AT 4 DEGREES AND 20 DEGREES K
[J].
BARGER, RL
论文数:
0
引用数:
0
h-index:
0
BARGER, RL
;
BROIDA, HP
论文数:
0
引用数:
0
h-index:
0
BROIDA, HP
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
37
(05)
:1152
-&
[3]
SPECTRUM OF C-3
[J].
BREWER, L
论文数:
0
引用数:
0
h-index:
0
BREWER, L
;
ENGELKE, JL
论文数:
0
引用数:
0
h-index:
0
ENGELKE, JL
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(04)
:992
-&
[4]
ENERGY EXTRAPOLATION IN CI CALCULATIONS
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
BUENKER, RJ
;
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
PEYERIMHOFF, SD
.
THEORETICA CHIMICA ACTA,
1975,
39
(03)
:217
-228
[5]
AB-INITIO VIBRATIONAL ANALYSIS OF SCHUMANN-RUNGE BANDS AND NEIGHBORING ABSORPTION REGION OF MOLECULAR-OXYGEN
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
BUENKER, RJ
;
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
PEYERIMHOFF, SD
;
PERIC, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
PERIC, M
.
CHEMICAL PHYSICS LETTERS,
1976,
42
(02)
:383
-389
[6]
MOLECULAR GEOMETRY AND MULLIKEN-WALSH MOLECULAR-ORBITAL MODEL - AB-INITIO STUDY
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEBRASKA,DEPT CHEM,LINCOLN,NB 68508
BUENKER, RJ
;
PEYERIMH.SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEBRASKA,DEPT CHEM,LINCOLN,NB 68508
PEYERIMH.SD
.
CHEMICAL REVIEWS,
1974,
74
(02)
:127
-188
[7]
BUENKER RJ, TO BE PUBLISHED
[8]
SCF-LCAO-MO WAVE FUNCTION FOR SIGMAG/+ GROUND STATE OF C3
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
MCLEAN, AD
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(01)
:45
-&
[9]
ELECTRON DISTRIBUTIONS IN SMALL MOLECULES
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
CLEMENTI, H
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, H
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(11)
:2824
-&
[10]
THE LAMBDA-4050 BANDS OF THE C-3(13) MOLECULE
[J].
CLUSIUS, K
论文数:
0
引用数:
0
h-index:
0
CLUSIUS, K
;
DOUGLAS, AE
论文数:
0
引用数:
0
h-index:
0
DOUGLAS, AE
.
CANADIAN JOURNAL OF PHYSICS,
1954,
32
(05)
:319
-&
←
1
2
3
4
→
共 36 条
[1]
Spectra of C-3 in Solidified Gases at 4 degrees and 20 degrees K
[J].
Barger, R. L.
论文数:
0
引用数:
0
h-index:
0
机构:
US Natl Bur Stand, Boulder, CO USA
US Natl Bur Stand, Boulder, CO USA
Barger, R. L.
;
Broida, H. P.
论文数:
0
引用数:
0
h-index:
0
机构:
US Natl Bur Stand, Boulder, CO USA
US Natl Bur Stand, Boulder, CO USA
Broida, H. P.
.
JOURNAL OF CHEMICAL PHYSICS,
1965,
43
(07)
:2364
-2370
[2]
ABSORPTION SPECTRUM OF CARBON VAPOR IN SOLID ARGON AT 4 DEGREES AND 20 DEGREES K
[J].
BARGER, RL
论文数:
0
引用数:
0
h-index:
0
BARGER, RL
;
BROIDA, HP
论文数:
0
引用数:
0
h-index:
0
BROIDA, HP
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
37
(05)
:1152
-&
[3]
SPECTRUM OF C-3
[J].
BREWER, L
论文数:
0
引用数:
0
h-index:
0
BREWER, L
;
ENGELKE, JL
论文数:
0
引用数:
0
h-index:
0
ENGELKE, JL
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(04)
:992
-&
[4]
ENERGY EXTRAPOLATION IN CI CALCULATIONS
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
BUENKER, RJ
;
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
UNIV BONN,LEHRSTUHL THEORET CHEM,WEGELER STR 12,D-5300 BONN,FED REP GER
PEYERIMHOFF, SD
.
THEORETICA CHIMICA ACTA,
1975,
39
(03)
:217
-228
[5]
AB-INITIO VIBRATIONAL ANALYSIS OF SCHUMANN-RUNGE BANDS AND NEIGHBORING ABSORPTION REGION OF MOLECULAR-OXYGEN
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
BUENKER, RJ
;
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
PEYERIMHOFF, SD
;
PERIC, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,INST PHYS CHEM,D-5300 BONN 1,FED REP GER
PERIC, M
.
CHEMICAL PHYSICS LETTERS,
1976,
42
(02)
:383
-389
[6]
MOLECULAR GEOMETRY AND MULLIKEN-WALSH MOLECULAR-ORBITAL MODEL - AB-INITIO STUDY
[J].
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEBRASKA,DEPT CHEM,LINCOLN,NB 68508
BUENKER, RJ
;
PEYERIMH.SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEBRASKA,DEPT CHEM,LINCOLN,NB 68508
PEYERIMH.SD
.
CHEMICAL REVIEWS,
1974,
74
(02)
:127
-188
[7]
BUENKER RJ, TO BE PUBLISHED
[8]
SCF-LCAO-MO WAVE FUNCTION FOR SIGMAG/+ GROUND STATE OF C3
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
MCLEAN, AD
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(01)
:45
-&
[9]
ELECTRON DISTRIBUTIONS IN SMALL MOLECULES
[J].
CLEMENTI, E
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, E
;
CLEMENTI, H
论文数:
0
引用数:
0
h-index:
0
CLEMENTI, H
.
JOURNAL OF CHEMICAL PHYSICS,
1962,
36
(11)
:2824
-&
[10]
THE LAMBDA-4050 BANDS OF THE C-3(13) MOLECULE
[J].
CLUSIUS, K
论文数:
0
引用数:
0
h-index:
0
CLUSIUS, K
;
DOUGLAS, AE
论文数:
0
引用数:
0
h-index:
0
DOUGLAS, AE
.
CANADIAN JOURNAL OF PHYSICS,
1954,
32
(05)
:319
-&
←
1
2
3
4
→