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SCI JCR Q2 Özgün Makale Scopus
Excited state energies, orbital energies and virial coefficients in Confined multi-electron systems
Journal of Luminescence 2022 Cilt 251
Scopus Eşleşmesi Bulundu
5
Atıf
251
Cilt
Scopus Yazarları: Yusuf Yakar, Bekir Çakir, Ayhan Özmen, Celalettin Demir
Özet
In the present study, the electronic structure of neutral He and Li atoms confined at the center of an impenetrable spherical cavity of varying radius has been investigated. Average, state, orbital energies and wave functions for the ground and excited state electron configurations 1snl (1s2nl)[n = 2, 3, 4 and l = 0, 1, 2 and 3] have been calculated using the method that is a combination of quantum genetic algorithm procedure and Hartree-Fock Roothaan. The atomic orbitals built up from Slater-type orbitals are used in calculations. The average state and orbital energies have been calculated for the first time for the higher excited states with nl [n = 3,4 and l = 1,2,3 for confined He atom and n = 3,4 and l = 0, 1,2,3 for confined Li atom]. The results show that impurity charge and spatial confinement have a great impact on orbital energies, average, state energies and virial coefficients of the system, especially in strong confinement region. In addition, it is seen that when cavity radius is extremely large, all state energies and virial coefficients approach the corresponding values of free atom.
Anahtar Kelimeler (Scopus)
Average state energy Confined many-electron systems Orbital energy Virial coefficient

Anahtar Kelimeler

Average state energy Confined many-electron systems Orbital energy Virial coefficient

Makale Bilgileri

Dergi Journal of Luminescence
ISSN 0022-2313
Yıl 2022 / 10. ay
Cilt / Sayı 251
Makale Türü Özgün Makale
Hakemlik Hakemli
Endeks SCI
JCR Quartile Q2
TEŞV Puanı 648,00
Yayın Dili İngilizce
Kapsam Uluslararası
Toplam Yazar 4 kişi
Erişim Türü Basılı
Alan Fen Bilimleri ve Matematik Temel Alanı Bilim Alanı

YÖKSİS Yazar Kaydı

Yazar Adı Demir Celalettin, YAKAR YUSUF, ÇAKIR BEKİR, ÖZMEN AYHAN
YÖKSİS ID 6533186

Metrikler

Scopus Atıf 5
JCR Quartile Q2
TEŞV Puanı 648,00
Yazar Sayısı 4