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Mostrando registros 1-10 de 157

Artículo

How reliable is the hard-soft acid-base principle? An assessment from numerical simulations of electron transfer energies

Cárdenas, Carlos; Ayers, Paul W. (2013)

Artículo

Theoretical study of the protonation of [Pt3(μ-L) 3(L′)3] (L = CO, SO2, CNH; L′ = PH3, CNH)

Mendizabal, Fernando; Donoso, Daniela; Burgos, Darwin (2011)

Artículo

The Fukui potential is a measure of the chemical hardness

Cárdenas, Carlos (2011)

Artículo

A model for the charge capacity of 1T–TiS2 intercalated with Li

Mendizabal, Fernando; Contreras, Renato; Aizman, Arie (1995)

Artículo

Theoretical study of the interaction of molecular oxygen with copper clusters

Florez, Elizabeth; Tiznado, William; Mondragón, Fanor; Fuentealba, Patricio (2005)

Artículo

Sulphurating and coordinating properties of N,N′-thiobismorpholine towards iron carbonyls

Diaz, Carlos (1990)

Artículo

An information-theoretic resolution of the ambiguity in the local hardness

Heidar Zadeh, Farnaz; Fuentealba, Patricio; Cárdenas, Carlos; Ayers, Paul W. (2014)

Artículo

Theoretical study of the d10-s2 interaction between Au(I) and Tl(I) in the [AuCl(PH3)2]Tl+ hypothetical complex

Mera, Raúl; Mendizabal, Fernando (2009)

Artículo

Polarizability change in the excited electronic states of nonpolar aromatic hydrocarbons

Morales, Raúl G. E. (1982)

Artículo

An aromaticity scale based on the topological analysis of the electron localization function including σ and π contributions

Santos, Juan C.; Andres, Juan; Aizman, Arie; Fuentealba, Patricio (2005)

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