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Marat Valiev

Institution
Environmental Molecular Sciences Laboratory

Projects

Cluster Model Studies of Condensed Phase Phenomena

Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Xuebin Wang
This program is focused on obtaining a microscopic understanding of solution chemistry and solvation of negatively charged ions using cluster models in the gas phase via combined low temperature…

Computational Chemical Dynamics of Complex Systems

Lead Institution
University of Minnesota
Principal Investigator
Donald Truhlar
Project type
Capability Research
The goal of this project is to apply powerful new simulation techniques to tackle computationally challenging problems in chemical dynamics, with special emphasis on electrochemistry, heterogeneous…

Study of Depolymerization and Valorization of Lignin

Lead Institution
Joint BioEnergy Institute
Principal Investigator
Seema Singh
Project type
Large-Scale EMSL Research
The primary goal of the proposed work is to study and understand using both experimental and computational approaches, the depolymerization of lignin generated during the ionic liquid (IL)…

Cluster Model Studies of Condensed Phase Chemical Physics

Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Xuebin Wang
This program is focused on obtaining a microscopic understanding of solution chemistry and solvation of negatively charged ions using cluster models in the gas phase via combined low temperature…

(gc3564)Nanostructure Formation, Aggregation, and Reactivity

Lead Institution
Argonne National Laboratory
Principal Investigator
Larry Curtiss
Project type
Capability Research
This project is the outgrowth of several projects currently funded by DOE-BES at PNNL and ANL or new proposals co-authored by the participants and submitted to DOE?s Computational Nanoscience…