Recent developments in the ABINIT software package
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چکیده
منابع مشابه
Recent developments in the ABINIT software package
ABINIT is a package whose main program allows one to find the total energy, charge density, electronic structure and many other properties of systems made of electrons and nuclei, (molecules and periodic solids) within Density Functional Theory (DFT), Many-Body Perturbation Theory (GW approximation and Bethe-Salpeter equation) and Dynmical Mean Field Theory (DMFT). ABINIT also allows to optimiz...
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ژورنال
عنوان ژورنال: Computer Physics Communications
سال: 2016
ISSN: 0010-4655
DOI: 10.1016/j.cpc.2016.04.003