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Understanding non-covalent interactions in larger molecular complexes from first principles

Non-covalent interactions pervade all matter and play a fundamental role in layered materials, biological systems, and large molecular complexes. Despite this, our accumulated understanding of non-covalent interactions to date has been mainly developed in the tens-of-atoms molecular regime. This fal...

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Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:J Chem Phys
Egile Nagusiak: Al-Hamdani, Yasmine S., Tkatchenko, Alexandre
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: AIP Publishing LLC 2019
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC6910608/
https://ncbi.nlm.nih.gov/pubmed/30621423
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.5075487
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