Self-consistent Hubbard parameters from density-functional perturbation theor...
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The self-consistent evaluation of Hubbard parameters using linear-response theory is crucial for quantitatively predictive calculations based on Hubbard-corrected...
采用线性响应理论(linear-response theory)对哈伯德参数(Hubbard parameters)开展自洽评估,对于基于哈伯德修正(Hubbard-corrected)方法的定量预测性计算而言至关重要……



