The Paraquinone + H2 → Hydroquinone Reaction: A Challenge for Diffusion Monte Carlo Calculations
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https://www.materialsdatafacility.org/detail/quinone_qmc_v1.2
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资源简介：
This data set contains input and outfiles for the simulations associated with the paper: "The Paraquinone + H2 → Hydroquinone Reaction: A Challenge for Diffusion Monte Carlo Calculations." N, Mauger A. Benali and K. D. Jordan
提供机构：
Materials Data Facility
创建时间：
2024-01-19
