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001020533 0247_ $$2datacite_doi$$a10.34734/FZJ-2024-00246
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001020533 041__ $$aEnglish
001020533 1001_ $$0P:(DE-Juel1)187560$$aHemmati, Mohammad$$b0$$eCorresponding author$$ufzj
001020533 1112_ $$a3rd ML4Q Students & Postdocs Retreat$$cEitorf$$d2023-07-04 - 2023-07-05$$wGermany
001020533 245__ $$aAb initio study of the Van der Waals Superconductor NbSe2
001020533 260__ $$c2023
001020533 3367_ $$033$$2EndNote$$aConference Paper
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001020533 502__ $$cRWTH Aachen
001020533 520__ $$aBy applying the Coherent-Potential Approximation (CPA) within the  Korringa-Kohn-Rostoker (KKR) method, electronic properties such as the electronic density of states, band structure, and transport properties can be calculated for disordered materials. The CPA in KKR has been successfully used to study a wide range of disordered systems, including alloys, amorphous solids, and materials with impurities or defects.We utilize the Coherent-Potential Approximation (CPA) within the BdG-KKR algorithm to investigate the impact of impurities on the superconducting properties of a crystal system. The incorporation of the CPA in the context of superconductivity closely resembles its application in the normal state scenario, albeit with the doubling of matrix dimensions due to the presence of quasiparticles' particle-hole symmetry.
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001020533 65027 $$0V:(DE-MLZ)SciArea-170$$2V:(DE-HGF)$$aMagnetism$$x1
001020533 7001_ $$0P:(DE-Juel1)157882$$aRüssmann, Philipp$$b1$$ufzj
001020533 7001_ $$0P:(DE-Juel1)130548$$aBlügel, Stefan$$b2$$ufzj
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001020533 9141_ $$y2023
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001020533 9201_ $$0I:(DE-Juel1)IAS-1-20090406$$kIAS-1$$lQuanten-Theorie der Materialien$$x0
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