Investigation of the high-pressure behaviors of helvine by single-crystal X-ray diffraction, Raman spectroscopy, and DFT calculations
收藏DataCite Commons2025-04-27 更新2025-04-16 收录
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At room temperature, the pressure interval for collecting single crystal XRD data of natural sunlight garnet is about 3 GPa, with a maximum pressure of about 22.6 GPa. The experimental data obtained were normalized using GSE-ADA software for single crystal diffraction data, and the unit cell parameters of garnet were analyzed using Unitcell software. In order to verify the XRD experimental results, we used DFT method for theoretical calculations and obtained the E-V data of garnet.
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Science Data Bank
创建时间：
2025-03-26
