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Theoretical and Computational Chemistry

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EDF

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2 results in Keywords: EDF

Theoretical and Computational Chemistry

Decoding the Chemical Bond—On the Connection between Probability Density Analysis, QTAIM, and VB Theory

Leonard Reuter, Arne Lüchow

Version 2 posted 24 April 2020

1,015

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Theoretical and Computational Chemistry

How Many Electrons Holds a Molecular Electride?

Sebastian Sitkiewicz, Eloy Ramos-Cordoba, Josep M. Luis, Eduard Matito

Version 1 posted 29 March 2021

386

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