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Taming the fixed-node error in diffusion Monte Carlo via range separation

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Zenodo2020-11-30 更新2026-05-25 收录
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Suplementary information. Contains the org-mode computational notebook with all the input data (geometries, basis sets, pseudo-potentials) and output data (computed energies, densities, number of determinants) related to the article. A csv file is created by the notebook and an HTML export of the notebook is also provided.

提供机构:
Zenodo
创建时间:
2020-08-23
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