Nisfu Baina Rochman, - and Lilik Hasanah, - and Endi Suhendi, - (2025) SIMULASI PENGARUH SPIN-ORBIT COUPLING PADA PEMISAHAN SUB-BAND PITA VALENSI MATERIAL BERBASIS FILM TIPIS EMAS DAN IMPLIKASINYA UNTUK SENSOR DETEKTOR TERMAL. S1 thesis, Universitas Pendidikan Indonesia.
Abstract
Penelitian ini menganalisis pengaruh spin-orbit coupling (SOC) pada pemisahan sub-band pita valensi film tipis emas menggunakan Density Functional Theory (DFT) melalui perangkat lunak Quantum ESPRESSO dan JDFTx. Tujuan dari simulasi ini menentukan analisis struktur pita (band structure), density of states (DOS), dan dampak SOC terhadap sifat optik material. Simulasi dilakukan dengan membandingkan perhitungan scalar-relativistic (tanpa SOC) dan fully relativistic (dengan SOC) menggunakan pseudopotensial relativistik. Hasil yang didapatkan dalam simulasi ini menunjukan bahwa spin-orbit coupling (SOC) menyebabkan pemisahan energi sub-band pita valensi yang mencapai -0,4~1,4 eV yang berkontribusi dalam pergerseran puncak absorpsi dan modifikasi celah optik. Fenomena ini berkontribusi terhadap pergeseran puncak absorpsi optik dan perubahan celah optik material. Implikasi dari modifikasi ini sangat signifikan dalam meningkatkan sensitivitas dan efisiensi deteksi pada aplikasi sensor detektor termal berbasis respons optoelektronik film tipis emas. Dengan demikian, peran SOC perlu diperhitungkan dalam perancangan material sensor termal presisi tinggi. This study analyzes the effect of spin-orbit coupling (SOC) on the valence band sub-band discount of gold thin films using Density Functional Theory (DFT) through Quantum ESPRESSO and JDFTx software. The purpose of this analysis simulation is to determine the band structure (band structure), density of states (DOS), and the impact of SOC on the optical properties of the material. The simulation was carried out by calculating scalar-relativistic (without SOC) and fully relativistic (with SOC) calculations using relativistic pseudopotentials. The results obtained in this simulation indicate that spin-orbit coupling (SOC) causes a valence band sub-band energy frigival reaching -0.4~1.4 eV which contributes to the shift of the absorption peak and modification of the optical gap. This phenomenon contributes to the shift of the optical absorption peak and changes in the optical gap of the material. The implications of this modification are very significant in improving the sensitivity and detection efficiency in thermal detector sensor applications based on the optoelectronic response of gold thin films. Therefore, the role of SOC needs to be taken into account in the design of high-precision thermal sensor materials.
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Item Type: | Thesis (S1) |
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Additional Information: | https://scholar.google.com/citations?view_op=list_works&user=x4BqGq8AAAAJ ID SINTA Dosen Pembimbing : Lilik Hasanah : 5994035 Endi Suhendi : 5976806 |
Uncontrolled Keywords: | Spin-orbit coupling, film tipis emas, DFT, Quantum ESPRESSO, JDFTx, sifat optik. Spin-orbit coupling, gold thin films, DFT, Quantum ESPRESSO, JDFTx, optical properties. |
Subjects: | Q Science > Q Science (General) Q Science > QC Physics |
Divisions: | Fakultas Pendidikan Matematika dan Ilmu Pengetahuan Alam > Program Studi Fisika - S1 > Program Studi Fisika (non kependidikan) |
Depositing User: | Nisfu Baina Rochman |
Date Deposited: | 10 Sep 2025 04:18 |
Last Modified: | 10 Sep 2025 04:18 |
URI: | http://repository.upi.edu/id/eprint/138415 |
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