SUPPLEMENTARING MATERIAL
收藏DataCite Commons2024-10-10 更新2025-01-04 收录
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https://aip.figshare.com/articles/dataset/SUPPLEMENTARING_MATERIAL/27098281/1
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资源简介:
MCDHO2 force-field model, Ion-Water model, Distribution of the O-H distances in the Ce3+ aqua ions, Example of ORCA input file, Effect of CPCM in the theoretical UV-vis spectra, Comparison of absolute intensities, Test of convergence of the reconstructed spectrum
MCDHO2力场模型,离子-水模型,Ce³+水合离子中O-H键距离的分布,ORCA输入文件示例,CPCM对理论紫外-可见光谱的影响,绝对强度比较,重建光谱的收敛性测试
提供机构:
AIP Publishing
创建时间:
2024-10-10



