168 citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- Universidade de São PauloBR31 papers
- Instituto Tecnológico de AeronáuticaBR21 papers
- Universidade Federal FluminenseBR13 papers
- Universidade Federal do Rio de JaneiroBR12 papers
- Center for Astrophysics Harvard & SmithsonianUS4 papers
- Harvard UniversityUS4 papers
- Universidade Estadual Paulista (Unesp)BR4 papers
- Universidade Federal da ParaíbaBR4 papers
- Universidade Federal Rural de PernambucoBR4 papers
- ETH ZurichCH3 papers
- Université Libre de BruxellesBE3 papers
- Aarhus UniversityDK2 papers
Showing 2025 · cond-mat.mtrl-sciShow all
2 papers · 2 filters
cond-mat.mtrl-sci2025★ 4 cited
Transition States Energies from Machine Learning: An Application to Reverse Water-Gas Shift on Single-Atom Alloys
Raffaele Cheula, Mie Andersen
Obtaining accurate transition state (TS) energies is a bottleneck in computational screening of complex materials and reaction networks due to the high cost of TS search methods an…
cond-mat.mtrl-sci2025★ 4 cited
Breaking scaling relations with inverse catalysts: a machine learning exploration of trends in hydrogenation energy barriers
Luuk H. E. Kempen, Marius Juul Nielsen, Mie Andersen
The conversion of into useful products such as methanol is a key strategy for abating climate change and our dependence on fossil fuels. Developing new catalysts fo…