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THEORETICAL RADIATIVE LIFETIMES IN NO+(X1-SIGMA+)
被引:27
作者
:
CHAMBAUD, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
CHAMBAUD, G
[
1
]
ROSMUS, P
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
ROSMUS, P
[
1
]
机构
:
[1]
UNIV FRANKFURT,FACHBEREICH CHEM,W-6000 FRANKFURT,GERMANY
来源
:
CHEMICAL PHYSICS LETTERS
|
1990年
/ 165卷
/ 05期
关键词
:
D O I
:
10.1016/0009-2614(90)85454-K
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
:
Potential energy and dipole moment functions for the electronic ground state of the NO+ ion have been calculated from highly correlated CASSCF-CI electronic wavefunctions. The radiative lifetimes of the vibrational states are compared with two different experimental measurements and previous theoretical data. The CASSCF-CI lifetimes are: 88, 45, 31, 24, 20 and 17 (for v=1 to 6; all values in ms). © 1990.
引用
收藏
页码:429 / 431
页数:3
相关论文
共 9 条
[1]
POTENTIAL-ENERGY CURVES FOR NO+
ALBRITTON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
ALBRITTON, DL
SCHMELTEKOPF, AL
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
SCHMELTEKOPF, AL
ZARE, RN
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
ZARE, RN
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(08)
: 3271
-
3279
[2]
CALCULATION OF ABSOLUTE INFRARED INTENSITIES FOR 0-1, 0-2 AND 1-2 VIBRATION-ROTATION TRANSITIONS IN GROUND-STATE OF NO+
BILLINGS.FP
论文数:
0
引用数:
0
h-index:
0
机构:
NBS,WASHINGTON,DC 20234
NBS,WASHINGTON,DC 20234
BILLINGS.FP
[J].
CHEMICAL PHYSICS LETTERS,
1973,
23
(02)
: 160
-
166
[3]
GAUSSIAN-BASIS SETS FOR USE IN CORRELATED MOLECULAR CALCULATIONS .1. THE ATOMS BORON THROUGH NEON AND HYDROGEN
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1989,
90
(02)
: 1007
-
1023
[4]
HENNIGER M, 1986, CHEM PHYS LETT, V131, P439
[5]
AN EFFICIENT METHOD FOR THE EVALUATION OF COUPLING-COEFFICIENTS IN CONFIGURATION-INTERACTION CALCULATIONS
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
KNOWLES, PJ
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
WERNER, HJ
[J].
CHEMICAL PHYSICS LETTERS,
1988,
145
(06)
: 514
-
522
[6]
EXPERIMENTAL-MEASUREMENT OF THE RADIATIVE LIFETIME OF NO+(X1-SIGMA+, V=1, 2 AND 3)
KUO, CH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
KUO, CH
BEGGS, CG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
BEGGS, CG
KEMPER, PR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
KEMPER, PR
BOWERS, MT
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
BOWERS, MT
LEAHY, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
LEAHY, DJ
ZARE, RN
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
ZARE, RN
[J].
CHEMICAL PHYSICS LETTERS,
1989,
163
(4-5)
: 291
-
296
[7]
VANDUIJNEVELDT FB, 1971, IBM RJ945 RES REP
[8]
AN EFFICIENT INTERNALLY CONTRACTED MULTICONFIGURATION REFERENCE CONFIGURATION-INTERACTION METHOD
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
WERNER, HJ
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
KNOWLES, PJ
[J].
JOURNAL OF CHEMICAL PHYSICS,
1988,
89
(09)
: 5803
-
5814
[9]
WERNER HJ, 1982, J MOL SPECTROSC, V96, P362, DOI 10.1016/0022-2852(82)90201-6
←
1
→
共 9 条
[1]
POTENTIAL-ENERGY CURVES FOR NO+
ALBRITTON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
ALBRITTON, DL
SCHMELTEKOPF, AL
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
SCHMELTEKOPF, AL
ZARE, RN
论文数:
0
引用数:
0
h-index:
0
机构:
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
ZARE, RN
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
71
(08)
: 3271
-
3279
[2]
CALCULATION OF ABSOLUTE INFRARED INTENSITIES FOR 0-1, 0-2 AND 1-2 VIBRATION-ROTATION TRANSITIONS IN GROUND-STATE OF NO+
BILLINGS.FP
论文数:
0
引用数:
0
h-index:
0
机构:
NBS,WASHINGTON,DC 20234
NBS,WASHINGTON,DC 20234
BILLINGS.FP
[J].
CHEMICAL PHYSICS LETTERS,
1973,
23
(02)
: 160
-
166
[3]
GAUSSIAN-BASIS SETS FOR USE IN CORRELATED MOLECULAR CALCULATIONS .1. THE ATOMS BORON THROUGH NEON AND HYDROGEN
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1989,
90
(02)
: 1007
-
1023
[4]
HENNIGER M, 1986, CHEM PHYS LETT, V131, P439
[5]
AN EFFICIENT METHOD FOR THE EVALUATION OF COUPLING-COEFFICIENTS IN CONFIGURATION-INTERACTION CALCULATIONS
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
KNOWLES, PJ
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
UNIV BIELEFELD, FAK CHEM, D-4800 BIELEFELD, GERMANY
WERNER, HJ
[J].
CHEMICAL PHYSICS LETTERS,
1988,
145
(06)
: 514
-
522
[6]
EXPERIMENTAL-MEASUREMENT OF THE RADIATIVE LIFETIME OF NO+(X1-SIGMA+, V=1, 2 AND 3)
KUO, CH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
KUO, CH
BEGGS, CG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
BEGGS, CG
KEMPER, PR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
KEMPER, PR
BOWERS, MT
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
BOWERS, MT
LEAHY, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
LEAHY, DJ
ZARE, RN
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF SANTA BARBARA,DEPT CHEM,SANTA BARBARA,CA 93106
ZARE, RN
[J].
CHEMICAL PHYSICS LETTERS,
1989,
163
(4-5)
: 291
-
296
[7]
VANDUIJNEVELDT FB, 1971, IBM RJ945 RES REP
[8]
AN EFFICIENT INTERNALLY CONTRACTED MULTICONFIGURATION REFERENCE CONFIGURATION-INTERACTION METHOD
WERNER, HJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
WERNER, HJ
KNOWLES, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
UNIV CAMBRIDGE, CHEM LAB, CAMBRIDGE CB2 1EW, ENGLAND
KNOWLES, PJ
[J].
JOURNAL OF CHEMICAL PHYSICS,
1988,
89
(09)
: 5803
-
5814
[9]
WERNER HJ, 1982, J MOL SPECTROSC, V96, P362, DOI 10.1016/0022-2852(82)90201-6
←
1
→