Self-consistent G W calculations for semiconductors and insulators
By M. Shishkin, Georg Kresse. 2007
585 citations recorded by the source corpus.
Subfields: Atomic and Molecular Physics, and Optics, Electronic, Optical and Magnetic Materials, Materials Chemistry
View Paper: https://www.semanticscholar.org/paper/511ed04c7e8c2015cbe4294c39ac0062b94ad5c9
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In Atomic and Molecular Physics, and Optics
In Electronic, Optical and Magnetic Materials
In Materials Chemistry
Citations in the corpus
- The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals (2018, methodology): “For both bulk and 2D materials, the fully self-consistent GW self-energy systematically overestimates the band gap [121, 122] due to the neglect of vertex corrections [122, 123].”