Automated Multireference Vertical Excitations for Transition Metal Compounds
收藏Zenodo2024-12-24 更新2026-05-26 收录
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https://zenodo.org/doi/10.5281/zenodo.14343116
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资源简介：
Data needed to reproduce the work in "Automated Multireference Vertical Excitations for Transition Metals." This includes converged orbitals, CI vectors, and energies.
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Zenodo
创建时间：
2024-12-24
