| Alloying–Realloying Enabled High Durability for Pt–Pd–3d-Transition Metal Nanoparticle Fuel Cell Catalysts Z Wu, Y Maswadeh, J Wen, Z Kong, S Shan, J Vargas, S Yan, E Hopkins, ... Nature Communications, 2020 | 210 | 2020 |
| Origin of high activity and durability of twisty nanowire alloy catalysts under oxygen reduction and fuel cell operating conditions Z Kong, Y Maswadeh, JA Vargas, S Shan, ZP Wu, H Kareem, AC Leff, ... Journal of the American Chemical Society 142 (3), 1287-1299, 2019 | 129 | 2019 |
| Adsorption of melphalan anticancer drug on C24, B12N12, B12C6N6, B6C12N12 and B6C6N12 nanocages: a comparative DFT study CA Celaya, LF Hernández-Ayala, FB Zamudio, JA Vargas, M Reina Journal of Molecular Liquids 329, 115528, 2021 | 60 | 2021 |
| New AuN (N = 27–30) Lowest Energy Clusters Obtained by Means of an Improved DFT–Genetic Algorithm Methodology JA Vargas, F Buendía, MR Beltrán The Journal of Physical Chemistry C 121 (20), 10982-10991, 2017 | 49 | 2017 |
| Deviations from Vegard's law and evolution of the electrocatalytic activity and stability of Pt-based nanoalloys inside fuel cells by in operando X-ray spectroscopy and total … V Petkov, Y Maswadeh, JA Vargas, S Shan, H Kareem, ZP Wu, J Luo, ... Nanoscale 11 (12), 5512-5525, 2019 | 46 | 2019 |
| Importance of self-interaction-error removal in density functional calculations on water cluster anions J Vargas, P Ufondu, T Baruah, Y Yamamoto, KA Jackson, RR Zope Physical Chemistry Chemical Physics 22 (7), 3789-3799, 2020 | 44 | 2020 |
| The role of pre-nucleation clusters in the crystallization of gold nanoparticles RK Ramamoorthy, E Yildirim, E Barba, P Roblin, JA Vargas, LM Lacroix, ... Nanoscale 12 (30), 16173-16188, 2020 | 39 | 2020 |
| High pressure nitrogen-infused ultrastable fuel cell catalyst for oxygen reduction reaction E Lee, KA Kuttiyiel, KH Kim, J Jang, HJ Lee, JM Lee, MH Seo, TH Yang, ... ACS Catalysis 11 (9), 5525-5531, 2021 | 29 | 2021 |
| Ultrathin gold nanowires with the polytetrahedral structure of bulk manganese JA Vargas, V Petkov, ESA Nouh, RK Ramamoorthy, LM Lacroix, R Poteau, ... ACS nano 12 (9), 9521-9531, 2018 | 28 | 2018 |
| Study of the stability of small AuRh clusters found by a Genetic Algorithm methodology F Buendía, JA Vargas, RL Johnston, MR Beltrán Computational and Theoretical Chemistry 1119, 51-58, 2017 | 22 | 2017 |
| 4, 4′-methylene diphenyl diisocyanate–Conformational space, normal vibrations and infrared spectra F Fug, K Rohe, J Vargas, C Nies, M Springborg, W Possart Polymer 99, 671-683, 2016 | 18 | 2016 |
| How well do self-interaction corrections repair the overestimation of static polarizabilities in density functional calculations? S Akter, JA Vargas, K Sharkas, JE Peralta, KA Jackson, T Baruah, ... Physical Chemistry Chemical Physics 23 (34), 18678-18685, 2021 | 17 | 2021 |
| A comparative study of Au m Rh n (4≤ m+ n≤ 6) clusters in the gas phase versus those deposited on (100) MgO F Buendía, JA Vargas, MR Beltrán, JBA Davis, RL Johnston Physical Chemistry Chemical Physics 18 (32), 22122-22128, 2016 | 15 | 2016 |
| Electronic responses of long chains to electrostatic fields: Hartree-Fock vs. density-functional theory: A model study J Vargas, M Springborg, B Kirtman The Journal of Chemical Physics 140 (5), 2014 | 11 | 2014 |
| Simple Synthesis of Monodisperse Ultrasmall Au Icosahedral Nanoparticles E Yildirim, RK Ramamoorthy, R Parmar, P Roblin, JA Vargas, V Petkov, ... The Journal of Physical Chemistry C 127 (6), 3047-3058, 2023 | 8 | 2023 |
| Energetic, structural, and vibrational properties of 4, 4′-methylenediphenyl diisocyanate with relevance for adhesion M Ramírez, J Vargas, M Springborg The Journal of Physical Chemistry A 120 (24), 4256-4266, 2016 | 6 | 2016 |
| Stability of Au m Ag n (m+ n= 1–6) clusters supported on a F-center MgO (100) surface F Buendía, JA Vargas, MR Beltrán Physical Chemistry Chemical Physics 20 (48), 30466-30474, 2018 | 4 | 2018 |
| Building band structures for long finite chains in presence of an electric field J Vargas, M Springborg The Journal of Chemical Physics 137 (14), 2012 | 4 | 2012 |
| Self-Sustainable Lattice Strains of Morphology-Tuned Nanowires in Electrocatalysis Z Kong, ZP Wu, Y Maswadeh, G Yu, JA Vargas, D Caracciolo, V Petkov, ... ACS Catalysis 14 (7), 4709-4718, 2024 | 2 | 2024 |
| Interfacial Reactivity-Triggered Oscillatory Lattice Strains of Nanoalloys ZP Wu, D Dinh, Y Maswadeh, DT Caracciolo, H Zhang, T Li, JA Vargas, ... Journal of the American Chemical Society 146 (51), 35264-35274, 2024 | | 2024 |
Valeri PetkovProfessor of Physics, Central Michigan UniversityVerified email at cmich.edu