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Speeding up GW Calculations to Meet the Challenge of Large Scale Quasiparticle Predictions
Although the GW approximation is recognized as one of the most accurate theories for predicting materials excited states properties, scaling up conventional GW calculations for large systems remains a major challenge. We present a powerful and simple-to-implement method that can drastically accelera...
Autores principales: | Gao, Weiwei, Xia, Weiyi, Gao, Xiang, Zhang, Peihong |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group
2016
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5104980/ https://www.ncbi.nlm.nih.gov/pubmed/27833140 http://dx.doi.org/10.1038/srep36849 |
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