Search

Your search keyword '"condensed MO indices"' showing total 1 results
Start Over Descriptor "condensed MO indices" Language english
1 results on '"condensed MO indices"'

1. Quantum polyhedra in LCAO MO theory.

Author

Carbó-Dorca, Ramon

Subjects
*POLYHEDRA, *QUANTUM theory, *MOLECULAR orbitals, *DENSITY functionals, *PARAMETER estimation
Abstract

This paper presents the definition and characterisation of quantum molecular polyhedra. They are taken here within the description of a single molecule, using quantum molecular orbital (MO) density functions as vertices. The formalism and parameters associated to these mathematical structures are analysed. Picture Drawn by Pep Camps, Girona (2015). [ABSTRACT FROM PUBLISHER]

Published
2016
Full Text
View/download PDF

Catalog

Books, media, physical & digital resources
See catalog results