遇见数据集

Supplement Number 1

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DataCite Commons2024-07-10 更新2024-07-13 收录
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Optimized structure, energy levels and bond lengths of (CdS)6-CdAc2 by spin-polarized calculations and interatomic distances at time = 0, time = 500 fs and after relaxation, optical absorption, bond orders, atomic net charges and Fukui functions of (CdS)6-XAc2, as well as optimized structure, atomic net charges and DOS of (CdS)13-CdAc2.

提供机构:
AIP Publishing
创建时间:
2024-06-25
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