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Published in 2018 at "International Journal of Quantum Chemistry"
DOI: 10.1002/qua.25562
Abstract: We theoretically characterize a series of substituted cycloparaphenylene nanohoops to study the effect of incorporating an electron-withdrawing group into their cyclic structure. We systematically vary the nature, position, and number of nitrogen-containing acceptor groups in…
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Keywords:
tuning electronic;
properties applications;
doped cycloparaphenylenes;
applications thermally ... See more keywords