PHOTOABSORPTION IN H2O - STIELTJES-TCHEBYCHEFF CALCULATIONS IN THE TIME-DEPENDENT HARTREE-FOCK APPROXIMATION

被引：41

作者：

WILLIAMS, GRJ

LANGHOFF, PW

机构：

[1] INDIANA UNIV,DEPT CHEM,BLOOMINGTON,IN 47401

[2] NASA,AMES RES CTR,COMPUTAT CHEM GRP,MOFFETT FIELD,CA 94035

[3] STANFORD UNIV,DEPT AERONAUT & ASTRONAUT,STANFORD,CA 94305

来源：

CHEMICAL PHYSICS LETTERS | 1979年 / 60卷 / 02期

关键词：

D O I：

10.1016/0009-2614(79)80015-9

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：

Total and partial-channel photoabsorption cross-section calculations in H2O are reported employing the time-dependent Hartree-Fock approximation and Stieltjes-Tchebycheff imaging procedures, and comparisons are made with the corresponding results of recent (e, 2e), (e, e + ion), and synchrotron-radiation dipole oscillator-strength studies. © 1979.

引用

页码：201 / 207

页数：7

共 46 条

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BENDER C, UNPUBLISHED

[2] RYDBERG STATES OF DIATOMIC AND POLYATOMIC MOLECULES USING MODEL POTENTIALS [J].