Hubbard U through polaronic defect states
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Since the preliminary work of Anisimov and co-workers, the Hubbard corrected DFT+U functional has been used for predicting properties of correlated materials by applying on-site...
自阿尼西莫夫(Anisimov)及其合作者的前期奠基性研究以来,哈伯德修正的DFT+U泛函(Hubbard corrected DFT+U functional)已被用于通过施加在位……来预测关联电子材料的物性



