2019 AIChE Annual Meeting

Session: Forum Plenary: Computational Molecular Science and Engineering Forum (Invited Talks)

Session celebrating the winner of the CoMSEF Impact Award and CoMSEF Young Investigator Award. [Invited talks only]

Chair

Pfaendtner, J., University of Washington

Co-Chair

Sarupria, S., University of Minnesota, Twin Cities

Presentations

03:30 PM

(584a) Modeling the Preparation and Reactivity of Amorphous Catalysts
Peters, B., Vandervelden, C., Khan, S., Scott, S. L.

04:10 PM

(584b) Molecular Recognition of Ice By Proteins: From Ice Nucleation to Antifreeze
Molinero, V.

04:30 PM

(584c) Too Small Is Never Too Small: Utilizing Advanced Path Sampling to Probe the Kinetics and Mechanism of Rare Events, from Atmospheric Ice Nucleation to Membrane Transport
Haji-Akbari, A.

05:10 PM

(584d) Combining Density Functional Theory Calculations with Machine Learning for Studying Complex Chemistries on Surfaces
Heyden, A.

05:30 PM

(584e) Modeling Nucleation of Organic Molecules with the String Method
Santiso, E.