ADJIE SATRYO PAMUNGKAS, ADJIE SATRYO PAMUNGKAS (2018) PENERAPANMETODE FINITE DIFFERENCE TIME DOMAIN (FDTD) PADA DENSITY FUNCTIONAL THEORY (DFT) DENGAN PENDEKATAN DENSITAS LOKAL. S1 thesis, Universitas Mataram.
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Abstract
Abstract. Density functional theory (DFT) has been used very successful to obtain electronic structures of atoms and molecules. One method to obtain ground state densities and energies using the DFT method is by solving the time-dependent Kohn Sham (TDKS) equation. In this paper we apply the finite difference time domain (FDTD) method to solve the TDKS equation in imaginary time. The FDTD-DFT method is given in this paper and its numerical results for ground states and energies for various atoms and molecules
| Item Type: | Thesis (S1) |
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| Keywords (Kata Kunci): | are compared with results from other DFT program. |
| Subjects: | Q Science > QC Physics |
| Divisions: | Fakultas Matematika dan ilmu Pengetahuan Alam |
| Depositing User: | M Jafar Jafar |
| Date Deposited: | 17 Jul 2018 05:08 |
| Last Modified: | 17 Jul 2018 05:08 |
| URI: | http://eprints.unram.ac.id/id/eprint/6088 |
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