| Grant number: | 22/08883-8 |
| Support Opportunities: | Scholarships in Brazil - Scientific Initiation |
| Effective date (Start): | August 01, 2022 |
| Effective date (End): | July 31, 2023 |
| Field of knowledge: | Physical Sciences and Mathematics - Physics - Condensed Matter Physics |
| Acordo de Cooperação: | Max Planck Society for the Advancement of Science |
| Principal Investigator: | Luana Sucupira Pedroza |
| Grantee: | Thiago Hideki Tsutiya Guenka |
| Host Institution: | Centro de Ciências Naturais e Humanas (CCNH). Universidade Federal do ABC (UFABC). Ministério da Educação (Brasil). Santo André , SP, Brazil |
| Associated research grant: | 17/10292-0 - Atomistic simulations of electrochemistry, AP.JP |
Abstract Heterogeneous interfaces, such as metal/water, are a fundamental part of electrochemical devices. The processes that occur in these materials are determined by the composition and structure of the interface. Thus, an atomistic understanding of the water/metal interface is fundamental to advance in electrochemistry. However, it is also important to access larger systems and simulate them for longer time. One possibility to perform it is to use a multi scale Quantum Mechanics/Molecular Mechanics (QM/MM) simulation method. In this work, we will useQM/MM to study water/metal interfaces. (AU) | |
| News published in Agência FAPESP Newsletter about the scholarship: | |
| More itemsLess items | |
| TITULO | |
| Articles published in other media outlets ( ): | |
| More itemsLess items | |
| VEICULO: TITULO (DATA) | |
| VEICULO: TITULO (DATA) | |