MODIFIED MORSE FUNCTION FITTING PROCEDURE FOR DIATOMIC POTENTIALS

被引:5
作者
KAFRI, O
机构
[1] Nuclear Research Center-Negev, Beer-Sheva
关键词
D O I
10.1016/0009-2614(79)87167-5
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
We propose a semi-empirical extension of the Morse potential which is capable of accurately describing diatomic potential curves. A detailed example for H2(X 1Σ+g) is presented. © 1979.
引用
收藏
页码:538 / 541
页数:4
相关论文
共 21 条
[1]   A Relation Between Internuclear Distances and Bond Force Constants [J].
Badger, Richard M. .
JOURNAL OF CHEMICAL PHYSICS, 1934, 2 (03)
[2]   Between the internuclear distances and force constants of molecules and its application to polyatomic molecules [J].
Badger, RM .
JOURNAL OF CHEMICAL PHYSICS, 1935, 3 (11) :710-714
[3]  
BAKER GA, 1970, PADE APPROXIMATION T, P44312
[4]   SPF-DUNHAM EXPANSION FOR POTENTIAL WELL - REGRESSION-MODEL FOR SYSTEMATIC ANALYSIS OF DIFFERENTIAL ELASTIC BEAM SCATTERING CROSS-SECTIONS [J].
BICKES, RW ;
BERNSTEIN, RB .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (06) :2408-2420
[5]   SIMONS-PARR-FINLAN MODIFIED DUNHAM EXPANSION - GENERALIZED POTENTIAL MODEL FOR ANALYSIS OF DIFFERENTIAL ELASTIC MOLECULAR-BEAM SCATTERING CROSS-SECTIONS [J].
BICKES, RW ;
BERNSTEIN, RB .
CHEMICAL PHYSICS LETTERS, 1974, 26 (04) :457-462
[6]   INVERSION OF MOLECULAR SCATTERING DATA [J].
BUCK, U .
REVIEWS OF MODERN PHYSICS, 1974, 46 (02) :369-389
[7]   The Wentzel-Brillouin-Kramers method of solving the wave equation [J].
Dunham, JL .
PHYSICAL REVIEW, 1932, 41 (06) :713-720
[8]   A METHOD OF DIATOMICS IN MOLECULES .2. H3 AND H3+1 [J].
ELLISON, FO ;
PATEL, JC ;
HUFF, NT .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1963, 85 (22) :3544-&
[9]   STATISTICAL MECHANICS - A STUDY OF INTERMOLECULAR FORCES [J].
FITTS, DD .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1966, 17 :59-&
[10]   USE OF PADE APPROXIMANTS IN CONSTRUCTION OF DIABATIC POTENTIAL-ENERGY CURVES FOR IONIC MOLECULES [J].
JORDAN, KD ;
KINSEY, JL ;
SILBEY, R .
JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (03) :911-917