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Biografia

I am a chemist, and I studied at the University Federico II of Naples where I obtained my Ph.D. in Chemical Sciences.  I joined IIT after an exciting post doc in the Martínez group at the Stanford University.  

Currently, I am a Postdoctoral Researcher in the  Atomistic Simulations group led by Prof. Parrinello. 

My research interests lie at the intersection of chemistry, and computer science. I develop and apply theoretical methods to explore photoinduced processes, and discover new chemical reactions in complex environments using enhanced sampling techniques. Alongside these research topics, I'm also interested in combining cutting-edge technologies in machine learning, cloud computing and augmented reality to develop interactive applications to make computational chemistry readily accessible for the wider community.




Experience External

Title: Post Doc
Institute: Stanford University
Location: Stanford
Country: USA
From: 2019 To: 2021

Title: Post Doc
Institute: Chimie ParisTech
Location: Paris
Country: France
From: 2018 To: 2018

Title: Post Doc
Institute: University of Naples Federico II
Location: Napoli
Country: Italy
From: 2016 To: 2018

All Publications
2023
Das S., Raucci U., Neves R.P.P., Ramos M.J., Parrinello M.
How and When Does an Enzyme React? Unraveling α-Amylase Catalytic Activity with Enhanced Sampling Techniques
ACS Catalysis, vol. 13, (no. 12), pp. 8092-8098
Article Journal
2023
Raucci U., Weir H., Sakshuwong S., Seritan S., Hicks C.B., Vannucci F., Rea F., Martinez T.J.
Interactive Quantum Chemistry Enabled by Machine Learning, Graphical Processing Units, and Cloud Computing
Annual review of physical chemistry, vol. 74, pp. 313-336
Review Journal
2023
Xu W., Sanchez D.M., Raucci U., Zhou H., Dong X., Hu M., Bardeen C.J., Martinez T.J., Hayward R.C.
Photo-actuators via epitaxial growth of microcrystal arrays in polymer membranes
Nature Materials, vol. 22, (no. 9), pp. 1152-1159
Article Journal
2023
Yang M., Raucci U., Parrinello M.
Reactant-induced dynamics of lithium imide surfaces during the ammonia decomposition process
Nature Catalysis
Article Journal
2022
Stricker F., Sanchez D.M., Raucci U., Dolinski N.D., Zayas M.S., Meisner J., Hawker C.J., Martinez T.J., Read de Alaniz J.
A multi-stage single photochrome system for controlled photoswitching responses
Nature Chemistry, vol. 14, (no. 8), pp. 942-948
Article Journal