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Published in 2025 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.70214
Abstract: In this study, the noncovalent interactions present in microhydrated clusters of the isoelectronic molecules viz. CO2 and N2O were investigated by evaluating the energy of individual noncovalent interactions and cooperative contributions using the molecular tailoring…
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Keywords:
microhydrated clusters;
hydrogen bonds;
water;
co2 n2o ... See more keywords