๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Calculation of Auger spectra in j-j coupling

โœ Scribed by W.N. Asaad


Publisher
Elsevier Science
Year
1963
Weight
639 KB
Volume
44
Category
Article
ISSN
0029-5582

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


The calculation of molecular and cluster
โœ Dwight R. Jennison ๐Ÿ“‚ Article ๐Ÿ“… 1980 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 549 KB

The work of Asaad and Burhop and of Shirley on atoms is shown to form the basis of a useful theory for the xE?.!Yds of molecular core-valence-valence Auger spectra. if the static relaxation term of Shirley is neglected, the theory requires O~IY a single SCF calculation on the neutral molecule. Smce

Comments on the calculation of auger ele
โœ A.V. Kondratenko ๐Ÿ“‚ Article ๐Ÿ“… 1982 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 179 KB

The paper prcscnts formulae for calculating Auger electron spectra within the framework of the sudden perturbatton theory.

Ab initio calculation of Auger spectra f
โœ B. Schimmelpfennig; S.D. Peyerimhoff ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 471 KB

We present theoretical Auger spectra for the CO molecule and use configuration interaction to describe electron correlation and relaxation effects in the core-excited ion states as well as in the final dicationic states. From the results of various calculations which take into account different amou

The calculation of 2J(HH) couplings in b
โœ R. J. Abraham; J. M. Bakke ๐Ÿ“‚ Article ๐Ÿ“… 1978 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 186 KB

## Abstract The results of FPT/INDO theory together with the observed ^2^J(HH) coupling in benzyl groups (Ph ยท CH~2~X) leads to a simple equation ^2^J(HH) = A+B cos ฮธ+C cos 2ฮธ where ฮธ is the C.C.C.X dihedral angle, and X = C,H. The extension to other X substituents can be obtained from additivity r