Dr. Lulu Li

Prof. Núria López

Analysis of Dynamics and Amorphization of Metal oxides (MOx)

Dr. Lulu Li obtained her Ph.D. in the School of Chemical Technology from Tianjin University, China, in 2023, under the joint guidance of Prof. Jinlong Gong and Prof. Zhi-Jian Zhao. She is currently engaged in postdoctoral research under the guidance of Prof. Núria López since October 2023. Her research is centered on the exploration of the dynamic evolution of metal oxide catalysts during catalytic reactions, utilizing advanced techniques such as machine learning and first-principles calculations to advance the understanding of structure-performance relations inherent in these processes.

ICIQ profile

From 01/08/2024 to

31/07/2026

ADAMoX

The ADAMox project, “Analysis of Dynamics and Amorphization of Metal Oxides (MOx),” addresses a critical need in catalysis, particularly for the shift from traditional fossil fuels to clean and renewable energy sources, aligning with the European Green Deal’s sustainability goals.
MOx catalysts play a central role in these chemical transformations, but their structural complexity poses challenges in designing efficient catalysts. Therefore, ADAMox leverages advanced computational methods to explore the structural dynamics of MOx catalysts during operando conditions. This project aims to uncover vital structure-activity relationships, offering theoretical guidance to advance high-performance catalysts. Key objectives include understanding the formation of disordered/amorphous ensembles on MOx surfaces, exploring structure-activity relationships in catalytic reactions, and developing a universal operando simulation workflow for thermos/electro-chemical catalytic systems. The interdisciplinary approach integrates computational chemistry, machine learning, and experimental techniques, enhancing the
fundamental understanding of heterogenous catalysis. Furthermore, this project adheres to open science practices, ensuring transparency and collaboration within the scientific community. For the researcher, Dr. Li, under the guidance of Prof. Núria López at ICIQ, this project offers her a unique scientific career development opportunity to excel in a traditionally male-dominated area. It provides a platform to contribute to groundbreaking research while championing openness and diversity in science. In summary, ADAMox advances catalysis for clean energy and sustainable processes, offering exciting career prospects for the researcher while promoting open science and gender diversity in research.

This project has received funding from the European Union’s Horizon Europe research and innovation program under grant agreement 101149049

EU Research Corner

ERN 2024: Dr. Lulu Li at the EU Corner

September 5, 2024

We are pleased to announce that Dr. Li, an ICIQ MSCA fellow, will be featured in the #NitRecerCat 2024-2025 EU Corner and the ERN-ApuliaMED EU Corner. This initiative is part