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EVALUATION OF VIBRATIONAL ENERGIES AND FUNCTIONS OF A DIATOMIC MOLECULE BY USING CUBIC-SPLINES
被引:21
作者
:
CREMASCHI, P
论文数:
0
引用数:
0
h-index:
0
CREMASCHI, P
机构
:
来源
:
MOLECULAR PHYSICS
|
1980年
/ 40卷
/ 02期
关键词
:
D O I
:
10.1080/00268978000101571
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:401 / 412
页数:12
相关论文
共 15 条
[1]
Ahlberg J., 1967, THEORY SPLINES THEIR
[2]
Born M, 1927, ANN PHYS-BERLIN, V84, P0457
[3]
DEBOOR C, 1968, CUBIC SPLINE APPROXI, V1
[4]
DEBOOR C, 1968, CUBIC SPLINE APPROXI, V2
[5]
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
-
&
[6]
LIH PROPERTIES, ROTATION-VIBRATIONAL ANALYSIS, AND TRANSITION MOMENTS 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)
: 4936
-
&
[7]
HARTREE-FOCK POTENTIAL-ENERGY CURVES, SPECTROSCOPIC CONSTANTS, AND 1-ELECTRON PROPERTIES FOR LOWEST 2 SIGMA+G+ AND 2 PI-MU STATES OF LI2+
HENDERSON, GA
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
HENDERSON, GA
ZEMKE, WT
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ZEMKE, WT
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
WAHL, AC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(06)
: 2654
-
2656
[8]
ABINITIO CALCULATIONS OF THE ELECTRONIC-STRUCTURE AND THE VIBRATIONAL-SPECTRA OF THE X2-SIGMA-G+,SIGMA-2-U+,A2-PI-U AND PI-2-G STATES OF LI2+
KONOWALOW, DD
论文数:
0
引用数:
0
h-index:
0
机构:
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
KONOWALOW, DD
ROSENKRANTZ, ME
论文数:
0
引用数:
0
h-index:
0
机构:
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
ROSENKRANTZ, ME
[J].
CHEMICAL PHYSICS LETTERS,
1979,
61
(03)
: 489
-
494
[9]
GROUND-STATE AND LOWER EXCITED-STATE DISCRETE ABINITIO ELECTRONIC POTENTIAL-ENERGY SURFACES FOR DOUBLET HEH2+
MCLAUGHLIN, DR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
MCLAUGHLIN, DR
THOMPSON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
THOMPSON, DL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(06)
: 2748
-
2769
[10]
AB-INITIO DYNAMICS - HEH+ + H2 -] HE + H3+ (C 2NU) CLASSICAL TRAJECTORIES USING A QUANTUM-MECHANICAL POTENTIAL-ENERGY SURFACE
MCLAUGHLIN, DR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
MCLAUGHLIN, DR
THOMPSON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
THOMPSON, DL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
59
(08)
: 4393
-
4405
←
1
2
→
共 15 条
[1]
Ahlberg J., 1967, THEORY SPLINES THEIR
[2]
Born M, 1927, ANN PHYS-BERLIN, V84, P0457
[3]
DEBOOR C, 1968, CUBIC SPLINE APPROXI, V1
[4]
DEBOOR C, 1968, CUBIC SPLINE APPROXI, V2
[5]
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
-
&
[6]
LIH PROPERTIES, ROTATION-VIBRATIONAL ANALYSIS, AND TRANSITION MOMENTS 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)
: 4936
-
&
[7]
HARTREE-FOCK POTENTIAL-ENERGY CURVES, SPECTROSCOPIC CONSTANTS, AND 1-ELECTRON PROPERTIES FOR LOWEST 2 SIGMA+G+ AND 2 PI-MU STATES OF LI2+
HENDERSON, GA
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
HENDERSON, GA
ZEMKE, WT
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ZEMKE, WT
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
机构:
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
ARGONNE NATL LAB, CHEM DIV, ARGONNE, IL 60439 USA
WAHL, AC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
58
(06)
: 2654
-
2656
[8]
ABINITIO CALCULATIONS OF THE ELECTRONIC-STRUCTURE AND THE VIBRATIONAL-SPECTRA OF THE X2-SIGMA-G+,SIGMA-2-U+,A2-PI-U AND PI-2-G STATES OF LI2+
KONOWALOW, DD
论文数:
0
引用数:
0
h-index:
0
机构:
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
KONOWALOW, DD
ROSENKRANTZ, ME
论文数:
0
引用数:
0
h-index:
0
机构:
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
NBS, DIV MOLEC SPECTROSCOPY, WASHINGTON, DC 20234 USA
ROSENKRANTZ, ME
[J].
CHEMICAL PHYSICS LETTERS,
1979,
61
(03)
: 489
-
494
[9]
GROUND-STATE AND LOWER EXCITED-STATE DISCRETE ABINITIO ELECTRONIC POTENTIAL-ENERGY SURFACES FOR DOUBLET HEH2+
MCLAUGHLIN, DR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
MCLAUGHLIN, DR
THOMPSON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
UNIV NEW MEXICO,DEPT CHEM,ALBUQUERQUE,NM 87131
THOMPSON, DL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(06)
: 2748
-
2769
[10]
AB-INITIO DYNAMICS - HEH+ + H2 -] HE + H3+ (C 2NU) CLASSICAL TRAJECTORIES USING A QUANTUM-MECHANICAL POTENTIAL-ENERGY SURFACE
MCLAUGHLIN, DR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
MCLAUGHLIN, DR
THOMPSON, DL
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
UNIV CALIF, LOS ALAMOS SCI LAB, LOS ALAMOS, NM 87544 USA
THOMPSON, DL
[J].
JOURNAL OF CHEMICAL PHYSICS,
1973,
59
(08)
: 4393
-
4405
←
1
2
→