Compton Profile Investigation for Aluminum (Al)

This paper presents a study on the Compton Profile (CP) for aluminum in the face-centered cubic (fcc) crystal structure. Renormalized -Free Atom (RFA) model has been used to calculate the CP for the (3s-3p) subset of configurations. It is found that the RFA calculation for the (3s2-3p1) configurati...

Full description

Saved in:
Bibliographic Details
Main Author: Mohammed N. Mohammed
Format: Article
Language:English
Published: Tikrit University 2024-02-01
Series:Tikrit Journal of Pure Science
Subjects:
Online Access:https://tjpsj.org/index.php/tjps/article/view/1441
Tags: Add Tag
No Tags, Be the first to tag this record!
_version_ 1850115475115081728
author Mohammed N. Mohammed
author_facet Mohammed N. Mohammed
author_sort Mohammed N. Mohammed
collection DOAJ
description This paper presents a study on the Compton Profile (CP) for aluminum in the face-centered cubic (fcc) crystal structure. Renormalized -Free Atom (RFA) model has been used to calculate the CP for the (3s-3p) subset of configurations. It is found that the RFA calculation for the (3s2-3p1) configuration provides a better agreement with experimental values and the Plane Wave Generalized Gradient Approximation (PW-GGA) than the free atom model. CP was chosen for all values within the momentum region (PZ= 0 7a.u) and compared the theoretical results with the available experimental values. The results were in good agreement with the available experimental values.
format Article
id doaj-art-1130aff6a77c49ff827ee012b613181e
institution OA Journals
issn 1813-1662
2415-1726
language English
publishDate 2024-02-01
publisher Tikrit University
record_format Article
series Tikrit Journal of Pure Science
spelling doaj-art-1130aff6a77c49ff827ee012b613181e2025-08-20T02:36:34ZengTikrit UniversityTikrit Journal of Pure Science1813-16622415-17262024-02-0129110.25130/tjps.v29i1.1441Compton Profile Investigation for Aluminum (Al)Mohammed N. Mohammed 0Ministary of Education /Salahdeen Education Diractorate/ Department of Alduluiya Education -IRAQ This paper presents a study on the Compton Profile (CP) for aluminum in the face-centered cubic (fcc) crystal structure. Renormalized -Free Atom (RFA) model has been used to calculate the CP for the (3s-3p) subset of configurations. It is found that the RFA calculation for the (3s2-3p1) configuration provides a better agreement with experimental values and the Plane Wave Generalized Gradient Approximation (PW-GGA) than the free atom model. CP was chosen for all values within the momentum region (PZ= 0 7a.u) and compared the theoretical results with the available experimental values. The results were in good agreement with the available experimental values. https://tjpsj.org/index.php/tjps/article/view/1441Compton profileModel of the Renormalized -Free Atom (RFA)Compton scattering
spellingShingle Mohammed N. Mohammed
Compton Profile Investigation for Aluminum (Al)
Tikrit Journal of Pure Science
Compton profile
Model of the Renormalized -Free Atom (RFA)
Compton scattering
title Compton Profile Investigation for Aluminum (Al)
title_full Compton Profile Investigation for Aluminum (Al)
title_fullStr Compton Profile Investigation for Aluminum (Al)
title_full_unstemmed Compton Profile Investigation for Aluminum (Al)
title_short Compton Profile Investigation for Aluminum (Al)
title_sort compton profile investigation for aluminum al
topic Compton profile
Model of the Renormalized -Free Atom (RFA)
Compton scattering
url https://tjpsj.org/index.php/tjps/article/view/1441
work_keys_str_mv AT mohammednmohammed comptonprofileinvestigationforaluminumal