CO3(II)(H2O)10 minima obtained at HF and MP2 levels
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CO3(II)(H2O)10 optimized structures, obtained at the HF/6-31G* and MP2/6-311++G** levels. Electronic energy and ZPE included in each file.
本数据集包含CO3(II)(H2O)10的优化构型,所有构型均在HF/6-31G*与MP2/6-311++G**理论级别下获得。每个文件均包含电子能量与零点能(Zero Point Energy, ZPE)。
创建时间:
2019-02-13



