Aromatic molecules on low-index coinage metal surfaces: Many-body dispersion effects
نویسندگان
چکیده
منابع مشابه
Aromatic molecules on low-index coinage metal surfaces: Many-body dispersion effects
Understanding the binding mechanism for aromatic molecules on transition-metal surfaces in atomic scale is a major challenge in designing functional interfaces for to (opto)electronic devices. Here, we employ the state-of-the-art many-body dispersion (MBD) approach, coupled with density functional theory methods, to study the interactions of benzene with low-index coinage metal surfaces. The ma...
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ژورنال
عنوان ژورنال: Scientific Reports
سال: 2016
ISSN: 2045-2322
DOI: 10.1038/srep39529