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The Journal of Physical Chemistry. A|August 11, 2006
Dissolution of oxygen reduction electrocatalysts in an acidic environment: density functional theory studyZhihui Gu, Perla B BalbuenaThe Journal of Physical Chemistry. A|February 17, 2006
Does the decomposition of peroxydicarbonates and diacyl peroxides proceed in a stepwise or concerted pathway?Zhihui Gu, Yixuan Wang, Perla B BalbuenaThe Journal of Chemical Physics|March 16, 2021
Localized high concentration electrolytes decomposition under electron-rich environmentsYu Zheng, Perla B BalbuenaJournal of Chemical Theory and Computation|December 2, 2015
Kinetic Model of Surface Segregation in Pt-Based AlloysYuguang Ma, Perla B BalbuenaPhysical Chemistry Chemical Physics : PCCP|July 3, 2018
First-principles calculations of oxidation potentials of electrolytes in lithium-sulfur batteries and their variations with changes in environmentJaebeom Han, Perla B BalbuenaThe Journal of Physical Chemistry. B|July 21, 2006
Ab initio molecular dynamics simulations of the oxygen reduction reaction on a Pt(111) surface in the presence of hydrated hydronium (H3O)(+)(H2O)2: direct or series pathway?Yixuan Wang, Perla B BalbuenaThe Journal of Physical Chemistry. B|July 21, 2006
Design of oxygen reduction bimetallic catalysts: ab-initio-derived thermodynamic guidelinesYixuan Wang, Perla B BalbuenaThe Journal of Physical Chemistry. B|February 24, 2007
Catalytic activity tuning of a biomimetic HO-FeV=O oxidant for methane hydroxylation by substituents on aromatic rings: theoretical studyYuguang Ma, Perla B BalbuenaThe Journal of Physical Chemistry. A|February 24, 2006
Structural and reactivity properties of finite length cap-ended single-wall carbon nanotubesJin Zhao, Perla B BalbuenaThe Journal of Physical Chemistry. C, Nanomaterials and Interfaces|February 9, 2024
Inorganic Solid Electrolyte Interphase Engineering Rationales Inspired by Hexafluorophosphate Decomposition MechanismsDacheng Kuai, Perla B BalbuenaPageof 15