LABORATORIES

Virtual laboratory. This laboratory is coordinated by Professor Dr. Karla Furtado Andriani.

Computational Resources:

1. Approved Project at LNCC HPC SDumont (No. 245587 Computational Chemistry Applied to the Study of Catalysts for Greenhouse Gas Recycling)

2. Collaboration with Prof. Maria Del Pilar Sotomayor from UNESP Araquara - Unlimited Access to HPC GridUnesp.

3. Approved SEI Project for Resources (No. 073.6786.2024.0009668-86 Investigation of Superatoms for Catalysis Applications - A Computational Approach Combining Quantum Chemistry and Data Science)

 

Equipment - Acquired Licenses:FHI-aims (Fritz-Harber Institute - Ab initio materials simulations package)

 

Team:

• Prof. Karla Furtado Andriani

• Leonardo Silva dos Reis (Undergraduate student)

 

Internal Collaborators:

• Prof. Marcelo Franco (UESC-PPGQuim)

• Prof. Julieta Rangel (UESC-PPGQuim)

• Prof. Vera Rosa Capelossi (UESC-PROCIMM)

• Prof. Brunela Pereira (UESC-PROCIMM)

 

External Collaborators:

• Prof. Juarez L. F. Da Silva (USP)

• Prof. Maria Del Pilar Sotomayor (UNESP)

• Prof. Giovanni Finoto Caramori (UFSC)

 

Website: https://www.researchgate.net/lab/Quantum-Catalysis-and-BioInorganic-Systems-Group-QCatBioS-Karla-Furtado-Andriani