Carlos Cardenas
Carlos Cardenas
Associate Professor, Universidad de Chile
No verified email - Homepage
Title
Cited by
Cited by
Year
Chemical reactivity descriptors for ambiphilic reagents: dual descriptor, local hypersoftness, and electrostatic potential
C Cárdenas, N Rabi, PW Ayers, C Morell, P Jaramillo, P Fuentealba
The Journal of Physical Chemistry A 113 (30), 8660-8667, 2009
1532009
Reactivity indicators for degenerate states in the density-functional theoretic chemical reactivity theory
C Cárdenas, PW Ayers, A Cedillo
The Journal of chemical physics 134 (17), 174103, 2011
562011
Should negative electron affinities be used for evaluating the chemical hardness?
C Cárdenas, P Ayers, F De Proft, DJ Tozer, P Geerlings
Physical Chemistry Chemical Physics 13 (6), 2285-2293, 2011
562011
The Fukui potential and the capacity of charge and the global hardness of atoms
C Cárdenas, W Tiznado, PW Ayers, P Fuentealba
The Journal of Physical Chemistry A 115 (11), 2325-2331, 2011
472011
How to compute the Fukui matrix and function for systems with (quasi-) degenerate states
P Bultinck, C Cardenas, P Fuentealba, PA Johnson, PW Ayers
Journal of chemical theory and computation 10 (1), 202-210, 2014
372014
Atomic charges and the electrostatic potential are ill-defined in degenerate ground states
P Bultinck, C Cardenas, P Fuentealba, PA Johnson, PW Ayers
Journal of chemical theory and computation 9 (11), 4779-4788, 2013
352013
Further exploration of the Fukui function, hardness, and other reactivity indices and its relationships within the Kohn–Sham scheme
P Fuentealba, E Chamorro, C Cardenas
International Journal of Quantum Chemistry 107 (1), 37-45, 2007
322007
Symmetric nonlocal weighted density approximations from the exchange-correlation hole of the uniform electron gas
R Cuevas-Saavedra, D Chakraborty, S Rabi, C Cárdenas, PW Ayers
Journal of chemical theory and computation 8 (11), 4081-4093, 2012
302012
Relationships between the third-order reactivity indicators in chemical density-functional theory
C Cárdenas, E Echegaray, D Chakraborty, JSM Anderson, PW Ayers
The Journal of chemical physics 130 (24), 244105, 2009
302009
How reliable is the hard–soft acid–base principle? An assessment from numerical simulations of electron transfer energies
C Cárdenas, PW Ayers
Physical Chemistry Chemical Physics 15 (33), 13959-13968, 2013
282013
Theoretical study of the surface reactivity of alkaline earth oxides: Local density of states evaluation of the local softness
C Cárdenas, F De Proft, E Chamorro, P Fuentealba, P Geerlings
The Journal of chemical physics 128 (3), 034708, 2008
282008
Benchmark values of chemical potential and chemical hardness for atoms and atomic ions (including unstable anions) from the energies of isoelectronic series
C Cárdenas, F Heidar-Zadeh, PW Ayers
Physical Chemistry Chemical Physics 18 (36), 25721-25734, 2016
272016
On the exponential model for energy with respect to number of electrons
P Fuentealba, C Cárdenas
Journal of molecular modeling 19 (7), 2849-2853, 2013
272013
The Fukui potential is a measure of the chemical hardness
C Cárdenas
Chemical Physics Letters 513 (1-3), 127-129, 2011
272011
An explicit approach to conceptual density functional theory descriptors of arbitrary order
F Heidar-Zadeh, M Richer, S Fias, RA Miranda-Quintana, M Chan, ...
Chemical Physics Letters 660, 307-312, 2016
262016
Nature of Bonding in the Cyclization Reactions of (2-Ethynylphenyl) triazene and 2-Ethynylstyrene
C Cárdenas, E Chamorro, R Notario
The Journal of Physical Chemistry A 109 (19), 4352-4358, 2005
262005
In pursuit of negative Fukui functions: examples where the highest occupied molecular orbital fails to dominate the chemical reactivity
E Echegaray, C Cárdenas, S Rabi, N Rabi, S Lee, FH Zadeh, ...
Journal of molecular modeling 19 (7), 2779-2783, 2013
242013
Density functional theory of chemical reactivity
P Fuentealba, C Cárdenas
212015
Communication: a case where the hard/soft acid/base principle holds regardless of acid/base strength
PW Ayers, C Cárdenas
The Journal of Chemical Physics 138 (18), 181106, 2013
202013
An information-theoretic resolution of the ambiguity in the local hardness
FH Zadeh, P Fuentealba, C Cárdenas, PW Ayers
Physical Chemistry Chemical Physics 16 (13), 6019-6026, 2014
182014
The system can't perform the operation now. Try again later.
Articles 1–20