@misc{indiciaeb8a6c80627ec, title = {Non-Empirical and Self-Interaction Corrections for DFTB: Towards Accurate Quantum Simulations for Large Mesoscale Systems (Final Report)}, author = {Wong, Bryan M.}, year = {2023}, doi = {10.2172/1842676}, url = {https://www.osti.gov/biblio/1842676}, note = {Source identifier: 1842676} }