CD Skripsi

Visualisasi Dan Simulasi Mikrostruktur Zno Dengan Berbagai Struktur Kristal Dan Komposisi Doping Berdasarkan Pola Xrd Menggunakan Vesta

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Crystal structure visualization and X-ray diffraction pattern simulation of various types of ZnO microstructures have been successfully carried out using the VESTA software program. The purpose of this study was to obtain the relationship between the shape of the structure, microstructure, and composition to the peak diffraction pattern. The program reveals on the shape of the crystal structure and representative X-ray diffraction patterns for ZnO microstructures. This program coordinates of each constituent atom, lattice parameters, and spatial symmetry as input. The output is a diffraction pattern and crystal structure that provides an overview of the profile and type (phase) of the ZnO microstructure. The results showed that the peak position and intensity of the diffraction pattern were influenced by the arrangement of atoms in the unit cell. As the structure and microstructure changed, the position of the diffraction peak provides a different picture for each type of structure depending on the arrangement of atoms in the unit cell, where each crystal structure has a different position and spatial symmetry, resulting in different diffraction patterns. The difference in the data of the 2θ angle value of the simulation results with the reference data is 0%, then the difference in the data of the intensity value of the simulation results with the reference is 8.87%. The addition of doping on the O side in ZnO causes a change in the structure of ZnO from hexagonal (a = b ≠ c) to monoclinic (a ≠ b ≠ c) and also to orthorhombic (a ≠ b ≠ c). The nanorod structure has a monoclinic crystal system (a ≠ b ≠ c) with a space group of C 2 / c and lattice parameters a = 15.4170 Å b = 25.3560 Å c = 14.3840 Å. The nanowire structure has a triclinic crystal system (a ≠ b ≠ c) with lattice parameters a = 12.0380 b = 2.4910 Å c = 16.8890 Å and a space group of P-1 and is the simplest form of symmetric lattice. The nanoflower structure has an orthorhombic crystal system (a≠b≠c) with lattice parameters a= 9.47310 Å b= 13.52960 Å c= 29.0220 Å and space group Pbca.

Keywords: Visualization, Simulation, X-ray Diffraction, VESTA and RIENTAN-FP.

 

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Ketersediaan

Informasi Detail

Judul Seri

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No. Panggil

1903113820

Penerbit

Pekanbaru : Universitas Riau FMIPA Fisika., 2024

Deskripsi Fisik

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Bahasa

Indonesia

ISBN/ISSN

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Klasifikasi

1903113820

Tipe Isi

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Tipe Media

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Tipe Pembawa

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Edisi

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Subjek

FISIKA

Info Detail Spesifik

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Pernyataan Tanggungjawab

Mutia

Versi lain/terkait

Lampiran Berkas

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