Pressure-Tunable Band Gap in AlH₃: Toward an Intrinsic Optical Pressure Sensor
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This record contains WIEN2k_19 calculation data supporting the paper “Pressure-Tunable Band Gap in AlH₃: Toward an Intrinsic Optical Pressure Sensor.” It provides the input and output files corresponding to Figs. 1 and 3, with calculation details described in each directory’s README.md.
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Zenodo创建时间：
2025-10-31
