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Royal Society of Chemistry, Physical Chemistry Chemical Physics, 18(20), p. 12368-12372, 2018

DOI: 10.1039/c8cp01519h

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Decoding real space bonding descriptors in valence bond language

Journal article published in 2018 by A. Martín Pendás ORCID, E. Francisco
This paper was not found in any repository, but could be made available legally by the author.
This paper was not found in any repository, but could be made available legally by the author.

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Abstract

Real space bonding descriptors are orbital invariant indices that can be obtained independently of the theoretical framework used to compute a given wavefunction.