Angela Violi

University of Naples Federico II

• PhD ChE ’99
• BS ChE ’94

Our lab is committed to interdisciplinary research at the leading edge of nanoscience, utilizing molecular simulations and machine learning. We have a dual mission to conduct foundational research while also tackling real-world challenges for the greatest societal benefit.

• Bernard Lewis Fellowship, for “High Quality Research in Combustion”,
• International Combustion Institute, Edinburgh, Scotland, 2000
• John Zink Award, Salt Lake City, Utah, 2000
• Enichem Prize for Distinguished Thesis, 1994
• Erasmus Fellowship at the Department of Chemical and Biochemical
• Engineering at the University College of London, England, 1992-92
• Enichem Award of Merit for Best Curriculum Studiorum, Naples, Italy, 1991

Recent Publications

• S. Izvekov, A. Violi “A Coarse-Grained Molecular Dynamics Study of Carbon Nanoparticle Aggregation”, J. Chem. Theory Comput. 2(3), 504-512 (2006).
• R. Chang, A. Violi “Insights into the effect of combustion-generated carbon nanoparticles on biological membranes: a computer simulation” Journal of Physical Chemistry B, 110(10). 5073-5083 (2006).
• D. Wang, A. Violi, D.H. Kim, J.A. Mullholland “Formation of Naphthalene, Indene and Benzene from Cyclopentadiene Pyrolysis: A DFT Study” Journal of Physical Chemistry A, 110(14), 4719-4725 (2006).
• S. Izvekov, A. Violi “Systematic Coarse-Graining of Nanoparticle Interactions in Molecular Dynamics Simulation” Journal of Physical Chemistry B 109(36): 17019-17024 (2005).
• A. Violi, G.A. Voth “A multi-scale computational approach for nanoparticle growth in combustion environments” High Performance Computing and Communications, Proceedings Lecture Notes in Computer Science 3726: 938-947 (2005).
• A. Violi “Cyclodehydrogenation Reactions to Cyclopentafused Polycyclic Aromatic Hydrocarbons” Journal of Physical Chemistry A 109(34): 7781-7787 (2005).
• A. Violi, G.A. Voth, A.F. Sarofim “The relative roles of acetylene and aromatic precursors during soot particle inception” Proc. Combust. Inst. 30: 1343-1351 (2005).
• Cooke J.A., Bellucci M., Smooke M.D., Gomez A., Violi A., Faravelli T., Ranzi E. “Computational and Experimental Study of JP-8, a Surrogate, and its Components in Counterflow Diffusion Flames” Proc. Combust. Inst. 30: 2343-2351 (2005).
• A. D’Anna A. Violi “Detailed Modeling of the Molecular Growth Process in Aromatic and Aliphatic Premixed Flames” Energy & Fuels 19(1): 79-86 (2005).

A complete list of publications can be found at the Violi Research Group.