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Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4

Elmustafa Ouaaka et al · Vasyl Stefanyk Carpathian National University · 2021

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Author / responsible party
Elmustafa Ouaaka et al
Publisher
Vasyl Stefanyk Carpathian National University
Year
2021
ISSN
1729-4428
ISSN
1729-4428
Language
English

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In this work, we conducted the first principle calculation of electronic structure and transport properties of [NH3-(CH2)3-COOH]2CdCl4 (Acid-Cd). The generalized gradient approximation is used in structural optimization and electronic structure. The theoretical band gap value found is in good agreement with experimental. Electronic thermal conductivity, electrical conductivity, Seebeck coefficient (S) and figure of merit (ZT) have been calculated using semi-local Boltzmann theory to predict the thermoelectric characteristic of the studied materials.

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APA 7

al, E. O. E. (2021). Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4. https://doi.org/10.15330/pcss.22.4.750-755

MLA

al, Elmustafa Ouaaka et. "Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4." 2021. https://doi.org/10.15330/pcss.22.4.750-755.

Chicago

al, Elmustafa Ouaaka et. 2021. "Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4.". https://doi.org/10.15330/pcss.22.4.750-755.

Harvard

al, E. O. E. 2021, Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4, Vasyl Stefanyk Carpathian National University, available at: https://doi.org/10.15330/pcss.22.4.750-755 [Accessed 9 Aug. 2026].

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Title
Electronic structure and Thermoelectric Properties of Hybrid Organic-Inorganic Perovskites [NH3-(CH2)3-COOH]2CdCl4
Author / contributors
Elmustafa Ouaaka et al
Publisher
Vasyl Stefanyk Carpathian National University
Publication year
2021
ISSN
1729-4428
ISSN
1729-4428
Language
English

Subjects

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hybrid organic inorganic; band structure; density of states; gap energy; electrical conductivity; seebeck coefficient; figure of merit
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