Research data for "Quantum Monte Carlo calculations of energy gaps from first principles"
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https://research.lancaster-university.uk/en/datasets/9fee7d9c-e41f-4925-b1ae-ec5f21c1c612
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资源简介：
Tarball holding CASINO and CASTEP input and principal output files for the
quantum Monte Carlo and density functional theory calculations reported in
the paper "Quantum Monte Carlo calculations of energy gaps from first
principles". The names of the directories holding the files are
self-explanatory.
提供机构：
Lancaster University
创建时间：
2018-08-03
