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photo-bases. The work will focus on modeling of adiabatic and nonadiabatic photochemical processes to capture excited states dynamics using an array of ab initio molecular dynamics methods for excited
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Postdoctoral Research Associate - Energy materials synthesis and exploration with neutron scattering
scatterings including phase formation, evolution, and elemental site occupancy in crystal structure etc. will be transferred to help to develop process of fabrication of large energy storage device. This work
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, molecular dynamics simulations using ab initio and machine-learning potentials, and the development or application of machine-learning tools for feature extraction, property prediction, and inverse molecular
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this link: http://neutrons.ornl.gov As part of a team, you will explore the complicated coupling between the local structure and various degrees of freedom (orbital, spin, etc.) involved in functional