Accurate estimation of enthalpies of formation for C-, H-, O-, and N-containing compounds using DLPNO-CCSD(T1)/CBS method
Author:
Publisher
Springer Science and Business Media LLC
Subject
Physical and Theoretical Chemistry,Condensed Matter Physics
Link
http://link.springer.com/content/pdf/10.1007/s11224-020-01681-y.pdf
Reference63 articles.
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5. Marochkin II, Dorofeeva OV (2012) Amide bond dissociation enthalpies: effect of substitution on N–C bond strength. Comput Theor Chem 991:182–191
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