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Chemical Society Reviews|April 11, 2015
Quantifying aromaticity with electron delocalisation measuresFerran Feixas, Eduard Matito, Jordi Poater, et al.
Faraday Discussions|March 3, 2007
Electron sharing indexes at the correlated level. Application to aromaticity calculationsEduard Matito, Miquel Solà, Pedro Salvador, et al.
The Journal of Chemical Physics|July 20, 2006
Electron localization function at the correlated levelEduard Matito, Bernard Silvi, Miquel Duran, et al.
The Journal of Physical Chemistry. A|September 22, 2011
Understanding conjugation and hyperconjugation from electronic delocalization measuresFerran Feixas, Eduard Matito, Jordi Poater, et al.
Journal of Computational Chemistry|February 14, 2008
On the performance of some aromaticity indices: a critical assessment using a test setFerran Feixas, Eduard Matito, Jordi Poater, et al.
The Journal of Chemical Physics|August 6, 2020
Analytic gradients for spin multiplets in natural orbital functional theoryIon Mitxelena, Mario Piris
The Journal of Chemical Physics|February 17, 2020
An efficient method for strongly correlated electrons in two-dimensionsIon Mitxelena, Mario Piris
The Journal of Chemical Physics|June 3, 2016
Molecular electric moments calculated by using natural orbital functional theoryIon Mitxelena, Mario Piris
The Journal of Chemical Physics|May 22, 2024
Assessing the global natural orbital functional approximation on model systems with strong correlationIon Mitxelena, Mario Piris
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