Rubicelia Vargas

Affiliations: 
Chemistry Pacific Northwest National Laboratory, USA 
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"Rubicelia Vargas"
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Cruz JCES, Hernandez-Esparza R, Vazquez-Mayagoitia A, et al. (2019) Implementation of the Molecular Electrostatic Potential Over GPUs. Journal of Chemical Information and Modeling
Avelar J, Bruix A, Garza J, et al. (2019) van der Waals exchange-correlation functionals over bulk and surface properties of transition metals. Journal of Physics. Condensed Matter : An Institute of Physics Journal
Monjaraz-Rodríguez A, Rodriguez-Bautista M, Garza J, et al. (2018) Coordination numbers in hydrated Cu(II) ions. Journal of Molecular Modeling. 24: 187
Zaragoza IP, Soriano-Agueda LA, Hernández-Esparza R, et al. (2018) Analyzing ZnO clusters through the density-functional theory. Journal of Molecular Modeling. 24: 164
Salazar-Cano JR, Guevara-García A, Vargas R, et al. (2016) Hydrogen bonds in methane-water clusters. Physical Chemistry Chemical Physics : Pccp
Rodriguez-Bautista M, Díaz-García C, Navarrete-López AM, et al. (2015) Roothaan's approach to solve the Hartree-Fock equations for atoms confined by soft walls: Basis set with correct asymptotic behavior. The Journal of Chemical Physics. 143: 034103
Hernández-Esparza R, Mejía-Chica SM, Zapata-Escobar AD, et al. (2014) Grid-based algorithm to search critical points, in the electron density, accelerated by graphics processing units. Journal of Computational Chemistry. 35: 2272-8
Ramírez JZ, Vargas R, Garza J. (2012) The role of conformational changes in the signal enhancement of a selective chemosensor of Pb2+. Physical Chemistry Chemical Physics : Pccp. 14: 495-501
Ramírez-Ramírez JZ, Vargas R, Garza J, et al. (2010) Simple charge-transfer model for metallic complexes. The Journal of Physical Chemistry. A. 114: 7945-51
Navarrete-López AM, Garza J, Vargas R. (2008) The Kohn-Sham kinetic energy density as indicator of the electron localization: atomic shell structure. The Journal of Chemical Physics. 128: 104110
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