Oak Ridge National Laboratory
Oak Ridge, TN
Requisition Id 16540 Overview: We are seeking a Postdoctoral Research Associate who will develop and apply computational methods based on electronic structure theory and artificial intelligence approaches with emphasis on electronic properties of a range of quantum materials important to the DOE mission, including the materials classes described below. Research efforts will include application of Quantum Monte Carlo (QMCPACK, PYQMC) density functional theory (e.g. QE, VASP, PYSCF) and associated models to describe various properties of DOE-relevant quantum materials. The Materials Theory Group has a background in using the most advanced ab-initio methods to examine electronic, topological and magnetic properties of advanced materials, their defects and their interphases. The incumbent will have opportunities to develop research methodologies as well as collaborate with experimental groups at Oak Ridge National Laboratory (ORNL). This position resides in the Materials Theory...