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<strong>Electronic, mechanical, thermodynamic and optical properties of CdS under pressure</strong>

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Authentication Code dc
 
Title Statement <strong>Electronic, mechanical, thermodynamic and optical properties of CdS under pressure</strong>
 
Added Entry - Uncontrolled Name Saini, pawan Kumar; CDLU Sirsa
Ahlawat, D S
Daoud, S ; Laboratoire Matériaux et Systèmes Electroniques (LMSE), Université Mohamed Elbachir El Ibrahimi de Bordj Bou Arreridj, Bordj Bou Arreridj 34000, Algérie
Singh, D ; M M University, Ambala 133 207, India
 
Uncontrolled Index Term Electronic band structure; elastic constant; Debye temperature; optical constants; WIEN2k
 
Summary, etc. We report high pressure study of CdS using the full-potential linear augmented plane wave (FP-LAPW) method based on density functional theory approach. In this approach, generalized gradient approximation (GGA) and Engel- Vosko generalized gradient approximation (EV-GGA) have been used for the exchange correlation potential in the calculations. The equilibrium lattice constant, electronic band structure, elastic constants, Debye temperature and melting temperature of binary solid CdS have been calculated under ambient and high pressure. Furthermore, the linear optical properties such as dielectric function, absorption, optical conductivity reflectivity, refractive index and energy loss are computed and analyzed in detail within the energy range up to 14 eV. The obtained results are in good agreement with earlier reported experimental and other theoretical results.
 
Publication, Distribution, Etc. Indian Journal of Pure & Applied Physics (IJPAP)
2019-11-26 12:54:51
 
Electronic Location and Access application/pdf
http://op.niscair.res.in/index.php/IJPAP/article/view/21860
 
Data Source Entry Indian Journal of Pure & Applied Physics (IJPAP); ##issue.vol## 57, ##issue.no## 11 (2019): Indian Journal of Pure & Applied Physics
 
Language Note en
 
Nonspecific Relationship Entry http://op.niscair.res.in/index.php/IJPAP/article/download/21860/465468438
 
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