DOUBLE-IONIZATION TO SINGLET AND TRIPLET ELECTRONIC STATES OF CCL42+

被引：16

作者：

GRANT, RP

HARRIS, FM

ANDREWS, SR

PARRY, DE

机构：

[1] UNIV COLL SWANSEA,MASS SPECTROMETRY RES UNIT,SWANSEA SA2 8PP,W GLAM,WALES

[2] UNIV COLL SWANSEA,DEPT CHEM,SWANSEA SA2 8PP,W GLAM,WALES

来源：

INTERNATIONAL JOURNAL OF MASS SPECTROMETRY AND ION PROCESSES | 1995年 / 142卷 / 1-2期

关键词：

DOUBLE-CHARGE-TRANSFER SPECTROSCOPY; DOUBLE-IONIZATION ENERGY; SEMIEMPIRICAL CALCULATIONS;

D O I：

10.1016/0168-1176(94)04139-X

中图分类号：

O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];

学科分类号：

070203 ; 070304 ; 081704 ; 1406 ;

摘要：

The semiempirical MSX alpha computational method has been applied to calculate the double-ionization energies to singlet and triplet electronic states of CCl42+. In addition, a high resolution double-charge-transfer spectroscopy study of CCl4 was undertaken in which the double-ionization energies to singlet and triplet states of the dication were measured. These are in good agreement with the calculated values, thus giving confidence in the overall predictions of the computational study.

引用

页码：117 / 124

页数：8

共 24 条

[1] A COMBINED EXPERIMENTAL AND THEORETICAL INVESTIGATION OF C2H2(2+) ELECTRONIC-STATE ENERGIES [J].