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The Journal of Physical Chemistry. A
|
May 30, 2020
On Electronegativity, Hardness, and Reactivity Descriptors: A New Property-Oriented Basis Set
Jesús Sánchez-Márquez, Victor García, David Zorrilla, et al.
Journal of Computational Chemistry
|
August 26, 2021
Property-oriented basis sets for computation of atomization energies
Victor García, David Zorrilla, Manuel Fernández, et al.
Journal of Computer-Aided Molecular Design
|
January 4, 2020
Software to obtain spatially localized functions from different radial functions
Jesús Sánchez-Márquez, Victor García, David Zorrilla, et al.
Journal of Molecular Modeling
|
December 24, 2017
Introducing a new bond reactivity index: Philicities for natural bond orbitals
Jesús Sánchez-Márquez, David Zorrilla, Víctor García, et al.
The Journal of Physical Chemistry. A
|
September 29, 2009
Ibuprofen loading in surfactant-templated silica: role of the solvent according to the polarizable continuum model
Manuel Fernández-Núñez, David Zorrilla, Antonio Montes, et al.
Data in Brief
|
January 31, 2024
Dataset of phase-resolved images of internal, corona, and surface partial discharges in electrical generators
Juan David Zorrilla Henao, Alejandro Segura, Alejandro Tenorio, et al.
Applied Spectroscopy
|
June 10, 2016
Micro-Raman Spectroscopy for the Determination of Local Temperature Increases in TiO2 Thin Films due to the Effect of Radiation
Juan Jesús Gallardo, Javier Navas, David Zorrilla, et al.
Journal of Computational Chemistry
|
October 28, 2015
DAMQT 2.1.0: A new version of the DAMQT package enabled with the topographical analysis of electron density and electrostatic potential in molecules
Anmol Kumar, Sachin D Yeole, Shridhar R Gadre, et al.
Nanoscale
|
April 9, 2025
N-/Si-co-doped nanocrystalline diamonds as highly sensitive luminescent thermometers
Mabel Rodríguez-Fernández, María Gragera, Iván Carrillo-Berdugo, et al.
Journal of Molecular Modeling
|
October 24, 2014
Introducing "UCA-FUKUI" software: reactivity-index calculations
Jesús Sánchez-Márquez, David Zorrilla, Antonio Sánchez-Coronilla, et al.
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of 2
Search research articles
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Showing results (1-10 of 19) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry. A
|
May 30, 2020
On Electronegativity, Hardness, and Reactivity Descriptors: A New Property-Oriented Basis Set
Jesús Sánchez-Márquez, Victor García, David Zorrilla, et al.
Journal of Computational Chemistry
|
August 26, 2021
Property-oriented basis sets for computation of atomization energies
Victor García, David Zorrilla, Manuel Fernández, et al.
Journal of Computer-Aided Molecular Design
|
January 4, 2020
Software to obtain spatially localized functions from different radial functions
Jesús Sánchez-Márquez, Victor García, David Zorrilla, et al.
Journal of Molecular Modeling
|
December 24, 2017
Introducing a new bond reactivity index: Philicities for natural bond orbitals
Jesús Sánchez-Márquez, David Zorrilla, Víctor García, et al.
The Journal of Physical Chemistry. A
|
September 29, 2009
Ibuprofen loading in surfactant-templated silica: role of the solvent according to the polarizable continuum model
Manuel Fernández-Núñez, David Zorrilla, Antonio Montes, et al.
Data in Brief
|
January 31, 2024
Dataset of phase-resolved images of internal, corona, and surface partial discharges in electrical generators
Juan David Zorrilla Henao, Alejandro Segura, Alejandro Tenorio, et al.
Applied Spectroscopy
|
June 10, 2016
Micro-Raman Spectroscopy for the Determination of Local Temperature Increases in TiO2 Thin Films due to the Effect of Radiation
Juan Jesús Gallardo, Javier Navas, David Zorrilla, et al.
Journal of Computational Chemistry
|
October 28, 2015
DAMQT 2.1.0: A new version of the DAMQT package enabled with the topographical analysis of electron density and electrostatic potential in molecules
Anmol Kumar, Sachin D Yeole, Shridhar R Gadre, et al.
Nanoscale
|
April 9, 2025
N-/Si-co-doped nanocrystalline diamonds as highly sensitive luminescent thermometers
Mabel Rodríguez-Fernández, María Gragera, Iván Carrillo-Berdugo, et al.
Journal of Molecular Modeling
|
October 24, 2014
Introducing "UCA-FUKUI" software: reactivity-index calculations
Jesús Sánchez-Márquez, David Zorrilla, Antonio Sánchez-Coronilla, et al.
Page
of 2