Augmented double-zeta polarized basis sets for H, C, N, and O for use with GPAW
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资源简介：
For the basis set generation, GPAW's double-zeta polarized basis sets were augmented with numerical Gaussian-type orbitals using parameters from Basis Set Exchange's aug-cc-pVDZ basis sets.
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Zenodo创建时间：
2026-04-28
