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Published in 2024 at "Advanced Functional Materials"
DOI: 10.1002/adfm.202406550
Abstract: In carbon allotropes, interfacial engineering of various sp2 nanocarbon building blocks has shown great promise in designing and fabricating creative nanocarbon assemblies with novel structural and functional properties. Here, a robust, flexible, metalālike heterostructured carbon…
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Keywords:
carbon nanocomposites;
carbon;
versatile heterostructured;
robust versatile ... See more keywords
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Published in 2021 at "Advanced materials"
DOI: 10.1002/adma.202006111
Abstract: Soft ionic conductors, such as hydrogels and ionogels, have enabled stretchable and transparent ionotronics, but they suffer from key limitations inherent to the liquid components, which may leak and evaporate. Here, novel liquid-free ionic conductive…
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Keywords:
robust versatile;
liquid free;
elastomer;
free ionic ... See more keywords
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Published in 2025 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.70053
Abstract: The integration of quantum mechanics and molecular mechanics (QM/MM) within molecular dynamics simulations is crucial to accurately model complex biochemical systems. Here, we present an enhanced implementation of the QM/MM interface in the GROMOS simulation…
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Keywords:
interface molecular;
mechanics;
molecular dynamics;
robust versatile ... See more keywords