Coordinator | Atodiresei, Nicolae |
Grant period | 2019-05-01 - 2021-04-30 |
Funding body | VSR/JARA |
Identifier | G:(DE-Juel1)jias1e_20190501 |
⇦ Hybrid 2D-based interfaces from first principles
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Journal Article
Local dimerization and dedimerization of C60 molecules under a tip of scanning tunneling microscope: A first-principles study
Carbon 159, 638 - 647 (2020) [10.1016/j.carbon.2019.12.046]
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Spin-polarized electron transmission through B-doped graphene nanoribbons with Fe functionalization: a first-principles study
New journal of physics 22(6), 063022 (2020) [10.1088/1367-2630/ab8cac]
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Corrugated graphene exposes the limits of a widely used ab initio van der Waals DFT functional
Physical review materials 3(12), 124001 (2019) [10.1103/PhysRevMaterials.3.124001]
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