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NON-EMPIRICAL LCAO MO SCF INVESTIGATION OF ELECTRONIC RELAXATION ACCOMPANYING CORE IONIZATION IN A SERIES OF SATURATED ALKANES
被引:16
作者
:
CLARK, DT
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV DURHAM,DEPT CHEM,DURHAM DH1 3LE,ENGLAND
UNIV DURHAM,DEPT CHEM,DURHAM DH1 3LE,ENGLAND
CLARK, DT
[
1
]
CROMARTY, BJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV DURHAM,DEPT CHEM,DURHAM DH1 3LE,ENGLAND
UNIV DURHAM,DEPT CHEM,DURHAM DH1 3LE,ENGLAND
CROMARTY, BJ
[
1
]
机构
:
[1]
UNIV DURHAM,DEPT CHEM,DURHAM DH1 3LE,ENGLAND
来源
:
CHEMICAL PHYSICS LETTERS
|
1977年
/ 49卷
/ 01期
关键词
:
D O I
:
10.1016/0009-2614(77)80459-4
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:137 / 140
页数:4
相关论文
共 16 条
[11]
TRANSITION OPERATORS FOR MOLECULAR DELTA-E SCF CALCULATIONS - IONIZATION IN WATER AND FURAN
GOSCINSKI, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
GOSCINSKI, O
HEHENBERGER, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
HEHENBERGER, M
ROOS, B
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
ROOS, B
SIEGBAHN, P
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
SIEGBAHN, P
[J].
CHEMICAL PHYSICS LETTERS,
1975,
33
(03)
: 427
-
431
[12]
TRANSITION ENERGIES AND PROBABILITIES BY A TRANSITION OPERATOR METHOD
GOSCINSKI, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
GOSCINSKI, O
HOWAT, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
HOWAT, G
ABERG, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
ABERG, T
[J].
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS,
1975,
8
(01)
: 11
-
19
[13]
PIREAUX JJ, 1976, PHYS REV A, V14, P2126
[14]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .1. SUBSTITUENT EFFECTS AND DIPOLE MOMENTS
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
GORDON, M
论文数:
0
引用数:
0
h-index:
0
GORDON, M
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1967,
89
(17)
: 4253
-
&
[15]
POPLE JA, 1971, J AM CHEM SOC, V93, P5339
[16]
X-RAY PHOTOELECTRON SPECTROSCOPY OF SIMPLE HYDROCARBONS
THOMAS, TD
论文数:
0
引用数:
0
h-index:
0
THOMAS, TD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(03)
: 1373
-
&
←
1
2
→
共 16 条
[11]
TRANSITION OPERATORS FOR MOLECULAR DELTA-E SCF CALCULATIONS - IONIZATION IN WATER AND FURAN
GOSCINSKI, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
GOSCINSKI, O
HEHENBERGER, M
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
HEHENBERGER, M
ROOS, B
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
ROOS, B
SIEGBAHN, P
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA, DEPT QUANTUM CHEM, S-75120 UPPSALA, SWEDEN
SIEGBAHN, P
[J].
CHEMICAL PHYSICS LETTERS,
1975,
33
(03)
: 427
-
431
[12]
TRANSITION ENERGIES AND PROBABILITIES BY A TRANSITION OPERATOR METHOD
GOSCINSKI, O
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
GOSCINSKI, O
HOWAT, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
HOWAT, G
ABERG, T
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV UPPSALA,DEPT QUANTUM CHEM,BOX 518,S-75120 UPPSALA 1,SWEDEN
ABERG, T
[J].
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS,
1975,
8
(01)
: 11
-
19
[13]
PIREAUX JJ, 1976, PHYS REV A, V14, P2126
[14]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .1. SUBSTITUENT EFFECTS AND DIPOLE MOMENTS
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
GORDON, M
论文数:
0
引用数:
0
h-index:
0
GORDON, M
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1967,
89
(17)
: 4253
-
&
[15]
POPLE JA, 1971, J AM CHEM SOC, V93, P5339
[16]
X-RAY PHOTOELECTRON SPECTROSCOPY OF SIMPLE HYDROCARBONS
THOMAS, TD
论文数:
0
引用数:
0
h-index:
0
THOMAS, TD
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(03)
: 1373
-
&
←
1
2
→