Search research articles
Contact Us
Filters
Showing results (11-20 of 27) with videos related to
Page
of 3
Sort By:
The Journal of Physical Chemistry. A
|
April 8, 2006
QTAIM charge-charge flux-dipole flux models for the infrared fundamental intensities of the fluorochloromethanes
João Viçozo da Silva, Roberto L A Haiduke, Roy E Bruns
The Journal of Physical Chemistry. A
|
April 1, 2010
Investigating the nature of noble gas-copper bonds by the quantum theory of atoms in molecules
Eduardo F F Rodrigues, Eduardo L de Sá, Roberto L A Haiduke
Journal of Computational Chemistry
|
July 21, 2025
Atomization Energy Calculations in 13-Atom Alkali Metal Clusters: Is There an Appropriate Exchange-Correlation Functional?
Wagner F D Angelotti, Lucila C Z Angelotti, Roberto L A Haiduke
The Journal of Physical Chemistry. A
|
September 12, 2013
Systematic theoretical study of non-nuclear electron density maxima in some diatomic molecules
Luiz A Terrabuio, Tiago Q Teodoro, Marina G Rachid, et al.
The Journal of Chemical Physics
|
February 6, 2026
Does correlated orbital theory improve PBE-like functionals?
Rodrigo A Mendes, Zachary W Windom, Roberto L A Haiduke, et al.
The Journal of Chemical Physics
|
July 9, 2021
The relativistic effects on the methane activation by gold(I) cations
Régis T Santiago, Rafael M Vichietti, Francisco B C Machado, et al.
Journal of Computational Chemistry
|
April 21, 2005
An accurate relativistic universal Gaussian basis set for hydrogen through Nobelium without variational prolapse and to be used with both uniform sphere and Gaussian nucleus models
Roberto L A Haiduke, Luiz G M De Macedo, Albérico B F Da Silva
Journal of Molecular Modeling
|
July 23, 2022
Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H<sub>2</sub> rich environment
Rafael M Vichietti, Rene F K Spada, Francisco B C Machado, et al.
Acta Crystallographica. Section E, Structure Reports Online
|
April 28, 2011
2-Bromo-2-methyl-N-(4-nitro-phen-yl)propanamide
Rodolfo Moreno-Fuquen, David E Quintero, Fabio Zuluaga, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2014
An atom in molecules study of infrared intensity enhancements in fundamental donor stretching bands in hydrogen bond formation
Luiz A Terrabuio, Wagner E Richter, Arnaldo F Silva, et al.
Page
of 3
Search research articles
Search
Showing results (11-20 of 27) with videos related to
Sort By:
Page
of 3
The Journal of Physical Chemistry. A
|
April 8, 2006
QTAIM charge-charge flux-dipole flux models for the infrared fundamental intensities of the fluorochloromethanes
João Viçozo da Silva, Roberto L A Haiduke, Roy E Bruns
The Journal of Physical Chemistry. A
|
April 1, 2010
Investigating the nature of noble gas-copper bonds by the quantum theory of atoms in molecules
Eduardo F F Rodrigues, Eduardo L de Sá, Roberto L A Haiduke
Journal of Computational Chemistry
|
July 21, 2025
Atomization Energy Calculations in 13-Atom Alkali Metal Clusters: Is There an Appropriate Exchange-Correlation Functional?
Wagner F D Angelotti, Lucila C Z Angelotti, Roberto L A Haiduke
The Journal of Physical Chemistry. A
|
September 12, 2013
Systematic theoretical study of non-nuclear electron density maxima in some diatomic molecules
Luiz A Terrabuio, Tiago Q Teodoro, Marina G Rachid, et al.
The Journal of Chemical Physics
|
February 6, 2026
Does correlated orbital theory improve PBE-like functionals?
Rodrigo A Mendes, Zachary W Windom, Roberto L A Haiduke, et al.
The Journal of Chemical Physics
|
July 9, 2021
The relativistic effects on the methane activation by gold(I) cations
Régis T Santiago, Rafael M Vichietti, Francisco B C Machado, et al.
Journal of Computational Chemistry
|
April 21, 2005
An accurate relativistic universal Gaussian basis set for hydrogen through Nobelium without variational prolapse and to be used with both uniform sphere and Gaussian nucleus models
Roberto L A Haiduke, Luiz G M De Macedo, Albérico B F Da Silva
Journal of Molecular Modeling
|
July 23, 2022
Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H<sub>2</sub> rich environment
Rafael M Vichietti, Rene F K Spada, Francisco B C Machado, et al.
Acta Crystallographica. Section E, Structure Reports Online
|
April 28, 2011
2-Bromo-2-methyl-N-(4-nitro-phen-yl)propanamide
Rodolfo Moreno-Fuquen, David E Quintero, Fabio Zuluaga, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 18, 2014
An atom in molecules study of infrared intensity enhancements in fundamental donor stretching bands in hydrogen bond formation
Luiz A Terrabuio, Wagner E Richter, Arnaldo F Silva, et al.
Page
of 3