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Energy states, oscillator strengths and polarizabilities of many electron atoms confined by an impenetrable spherical cavity

International Journal of Quantum Chemistry · Temmuz 2021

Özet
We have calculated the ground and excited state energies and the orbital energies of three-electron atoms inside impenetrable spherical cavity. Energy eigenvalues and wavefunctions are calculated from the variational approximation method which is a combination of quantum genetic algorithm procedure and Hartree–Fock Roothaan method. In addition, the important parameters such as static and dynamic polarizability, oscillator strength and pressure have been investigated as perturbative. The results reveal that cavity radius and impurity charge have played an important role on the polarizability, the oscillator strength and pressure of the system. In addition, it is seen that when cavity radius is extremely large, all energies and the other physical parameters approach the values of a free space atom. As the dot radius decreases, the polarizability of system decreases due to the strong spatial confinement, but the pressure exerting on the system as the cavity radius R is shrunk increases. In addition, as the impurity charge increases, the oscillator strength decreases.
26 atıf Temmuz 2021 DOI
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YÖKSİS Kayıtları
Energy states, oscillator strengths and polarizabilities of many electron atoms confined by an impenetrable spherical cavity
International Journal of Quantum Chemistry · 2021 SCI-Expanded
Prof. Dr. BEKİR ÇAKIR →
YÖKSİS Kayıtları — ISSN Eşleşmesi
Bu dergide (ISSN eşleşmesi) kurumun 7 kaydı bulundu.
Computation of overlap integrals over Slater type orbitals usingauxiliary functions
1998 ISSN: 0020-7608 SCI
Prof. Dr. ÜLFET ATAV →
Computation of two center Coulomb integrals over Slater type orbitals using elliptical coordinates
2003 ISSN: 0020-7608 SCI-Expanded
Prof. Dr. ASLI KARAKAŞ →
Comparison of transition probabilities calculated using different parameters on WBEPM theory for somep d andd p transitions in excited atomic nitrogen
2007 ISSN: 00207608 SCI-Expanded
Prof. Dr. GÜLTEKİN ÇELİK →
Computation of ionization and various excited state energies ofhelium and helium like quantum dots
2011 ISSN: 00207608 SCI
Prof. Dr. BEKİR ÇAKIR →
Computation of two center Coulomb integrals over Slater type orbitals using elliptical coordinates
2003 ISSN: 00207608 SCI-Expanded
Prof. Dr. ÜLFET ATAV →
Energy states, oscillator strengths and polarizabilities of many electron atoms confined by an impenetrable spherical cavity
2021 ISSN: 0020-7608 SCI-Expanded Q2
Prof. Dr. BEKİR ÇAKIR →
Comparison of Transition Probabilities Calculated Using Different Parameters on WBEPM Theory for Some p-d and d-p Transitions in Excited Atomic Nitrogen
2007 ISSN: 0020-7608 SCI
Prof. Dr. ERHAN AKIN →

Makale Bilgileri

Toplam Atıf 26 atıf · Scopus
ISSN00207608
Yayın TarihiTemmuz 2021
Cilt / Sayfa121

Kurumlar

Aksaray Üniversitesi
Aksaray Turkey
Selçuk Üniversitesi
Selçuklu Turkey

Havuzumuzdaki Atıflar 0

Bu makaleye, sistemimizdeki Scopus veritabanında bulunan 0 makale atıf yapmıştır. Scopus genel atıf sayısı: 26.

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Scimago Dergi (ISSN Eşleşmesi)
International Journal of Quantum Chemistry
Q3
SJR Skoru0,402
H-Index125
YayıncıJohn Wiley & Sons Inc.
ÜlkeUnited States
Atomic and Molecular Physics, and Optics (Q3)
Condensed Matter Physics (Q3)
Physical and Theoretical Chemistry (Q3)
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26
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