SELF-ENERGY

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Towards fully automated GW band structure calculations:What we can learn from 60.000 self-energy evaluationsTowards fully automated GW band structure calculations:What we can learn from 60.000 self-energy evaluations被引量：2
《npj Computational Materials》2021年第1期189-197,共9页Asbjørn Rasmussen Thorsten Deilmann Kristian SThygesen 
We acknowledge funding from the European Research Council(ERC)under the European Union’s Horizon 2020 research and innovation program(Grant No.773122,LIMA);The Center for Nanostructured Graphene is sponsored by the Danish National Research Foundation,Project DNRF103;This project has received funding in the European Union’s Horizon 2020 research and innovation program under the European Union’s Grant Agreement No.951786(NOMAD CoE);T.D.acknowledges financial support from the German Research Foundation(DFG Project No.DE 2749/2-1).
We analyze a data set comprising 370 GW band structures of two-dimensional(2D)materials covering 14 different crystal structures and 52 chemical elements.The band structures contain a total of 61716 quasiparticle(QP)e...
关键词：structure approximation weights 
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