D spacing from X-ray diffraction data
- Context: Undergrad
- Thread starter mushdj
- Start date
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Discussion Overview
The discussion centers on how to calculate the d-spacing from X-ray diffraction (XRD) data using Bragg's law. Participants explore the necessary steps and considerations for determining lattice parameters from the data, particularly in the context of a specific material, YBCO (Yttrium Barium Copper Oxide).
Discussion Character
- Technical explanation
- Conceptual clarification
- Homework-related
Main Points Raised
- One participant seeks guidance on obtaining d-spacing values from XRD data using Bragg's law.
- Another suggests plotting the data to identify 2theta values of peaks and notes that knowing the crystal structure simplifies the calculation of d-spacing.
- A participant identifies the material as YBCO with an orthorhombic crystal structure, indicating this information may assist in determining lattice parameters.
- Another response suggests that the operation may be less complicated than perceived and recommends consulting a specific textbook for detailed steps and formulas related to Bragg's law and lattice parameters.
- This participant emphasizes that the textbook will provide a formula for the Bragg angle as a function of the Miller indices and lattice parameters, which could facilitate the calculation of a, b, and c lattice parameters.
Areas of Agreement / Disagreement
Participants express varying levels of complexity regarding the calculation process. While some suggest it can be straightforward with the right information, others indicate that the lack of knowledge about the crystal structure complicates the task. No consensus is reached on the best approach.
Contextual Notes
Participants note the dependence on knowing the crystal structure and the specific planes involved in the calculations, which may affect the determination of d-spacing and lattice parameters.
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