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...
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| Main Author: | |
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| Format: | Article |
| Language: | English |
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Tikrit University
2024-02-01
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| Series: | Tikrit Journal of Pure Science |
| Subjects: | |
| Online Access: | https://tjpsj.org/index.php/tjps/article/view/1441 |
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| Summary: | 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.
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| ISSN: | 1813-1662 2415-1726 |