Dataset for "Accurate atomic total energies for correlation consistent effective core potentials"
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下载链接：
https://www.materialsdatafacility.org/detail/annaberdiyev_accurate_atomic_potentials_v1.1
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资源简介：
Dataset for "Accurate atomic total energies for correlation consistent effective core potentials"
Included are input and output files for various codes. For each code, outputs are organized per atom.
Funding: U.S. Department of Energy
Contact: Abdulgani Annaberdiyev <aannabe@ncsu.edu>
提供机构：
Materials Data Facility
创建时间：
2019-07-30
