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2022-05 NITheCS Mini-School: Kingsely Obodo and Cecil Ouma: Quantum Espresso
In this mini-school, we will teach Quantum ESPRESSO (QE), an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modelling at the nanoscale. It is based on density-functional theory, plane waves and pseudopotentials. QE is a free-to-use code that can be modified for various purposes. This suite of code can be applied to problems in areas including energy storage, drug design, catalysis, materials design and prediction. It is also relevant for researchers in the physical sciences, natural sciences, biological sciences, pharmacology, engineering and other fields.
May 25, 2022 02:00 PM
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