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Published in 2021 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2020.114951
Abstract: Abstract Quantum-mechanics calculations were carried out within the density functional theory (DFT) scheme, to analyze the sorbate-sorbent interaction between DNA nucleobases (purines: guanine and adenine; pyrimidines: cytosine and thymine) and hexagonal boron nitride nanosheets (pristine…
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Keywords:
nitride nanosheets;
boron;
boron nitride;
homonuclear boron ... See more keywords