[DATASET] LIgand dipole effect induced by water
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https://zenodo.org/record/15189814
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资源简介：
Article: Tuning electronic levels in photoactive hydroxylated titania nanosystems: combining the ligand dipole effect and quantum confinement
Cite: Nanoscale, 2024,16, 8975-8985
DOI: 10.1039/D3NR06189B
DATASET
outputs of hydrated titania nanoparticles with different degree of hydroxylation
Calculations performed by FHI-aims code
创建时间：
2025-04-10
