Jevgenijs Kotomins

Institute for Solid State Physics, The University of Latvia

Projects

Non-empirical simulations of nuclear fuel materials

Lead Institution

European Commission Joint Research Centre

Principal Investigator

Paul Van Uffelen

Project type

Large-Scale EMSL Research

Using DFT computer simulation methods implemented in VASP4.6 and NWChem codes we will study the atomic, electronic and magnetic structure of nuclear fuel materials (UO2 and UN) investigating what…

First Principles Modeling Of Oxygen Reduction at Complex Perovskite Surfaces for Fuel Cell and Gas Separation Applications

Lead Institution

Institute for Solid State Physics, The University of Latvia

Principal Investigator

Jevgenijs Kotomins

Project type

Exploratory Research

Using DFT first principles method implemented in VASP 5.0 computer code for large scale parallel calculations, we will study the atomic, electronic structure and physico-chemical properties of oxygen…