AN ABINITIO INVESTIGATION OF THE POTENTIAL FUNCTION AND ROTATION VIBRATION ENERGIES OF NH3

被引：32

作者：

BUNKER, PR

KRAEMER, WP

SPIRKO, V

机构：

[1] MAX PLANCK INST ASTROPHYS, D-8046 GARCHING, GERMANY

[2] CZECHOSLOVAK ACAD SCI, J HEYROVSKY INST PHYS CHEM & ELECTROCHEM, CS-16610 PRAGUE 6, CZECHOSLOVAKIA

来源：

CANADIAN JOURNAL OF PHYSICS | 1984年 / 62卷 / 12期

关键词：

D O I：

10.1139/p84-225

中图分类号：

O4 [物理学];

学科分类号：

0702 ;

摘要：

引用

收藏

页码：1801 / 1805

页数：5

相关论文

共 15 条

[1] ABINITIO ROTATION-VIBRATION ENERGIES OF H3O+
BUNKER, PR
KRAEMER, WP
SPIRKO, V
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1983, 101 (01) : 180 - 185
[2] TRIPLE AND QUADRUPLE EXCITATIONS AND THE VALENCE CORRELATION ENERGIES OF SMALL MOLECULES
GUEST, MF
WILSON, S
[J]. CHEMICAL PHYSICS LETTERS, 1980, 72 (01) : 49 - 52
[3] VIBRATION-ROTATION PROBLEM IN TRIATOMIC MOLECULES ALLOWING FOR A LARGE-AMPLITUDE BENDING VIBRATION
HOUGEN, JT
BUNKER, PR
JOHNS, JWC
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1970, 34 (01) : 136 - &
[4] EFFECTIVE ROTATION-BENDING HAMILTONIAN OF A TRIATOMIC MOLECULE, AND ITS APPLICATION TO EXTREME CENTRIFUGAL-DISTORTION IN WATER MOLECULE
HOY, AR
BUNKER, PR
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1974, 52 (03) : 439 - 456
[5] THE NONRIGID BENDER HAMILTONIAN FOR CALCULATING THE ROTATION VIBRATION ENERGY-LEVELS OF A TRIATOMIC MOLECULE
JENSEN, P
[J]. COMPUTER PHYSICS REPORTS, 1983, 1 (01): : 1 - 55
[6] AN EXTENDED ABINITIO STUDY OF THE ROTATION VIBRATION SPECTRUM OF HOC+
KRAEMER, WP
BUNKER, PR
[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1983, 101 (02) : 379 - 394
[7] ELECTRONIC STRUCTURE AND INVERSION BARRIER OF AMMONIA
RAUK, A
ALLEN, LC
CLEMENTI, E
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (08) : 4133 - &
[8] HARTREE-FOCK GEOMETRY OF AMMONIA
RODWELL, WR
RADOM, L
[J]. JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (03) : 2205 - 2206
[9] NEW METHOD FOR LARGE-SCALE CI CALCULATIONS
ROOS, B
[J]. CHEMICAL PHYSICS LETTERS, 1972, 15 (02) : 153 - &
[10] ROOS BO, 1977, MODERN THEORETICAL C, V3