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Large-Scale and Accurate Density Functional Theory (DFT) Simulations with QuantumATK
June 16, 2022 @ 9:00 am - 10:00 am PDT
Join this Synopsys webinar to learn how to perform large-scale, accurate and reliable Density Functional Theory (DFT) simulations with the QuantumATK platform:
- Discover how to perform accurate and reliable large scale DFT simulations even at the hybrid functional level – with Linear Combination of Atomic Orbital basis set using modest computational resources.
- Learn how to benefit from being able to seamlessly combine DFT (LCAO or Plane-Wave) to or from Classical or Machine-Learning Force Fields within one simulation workflow, allowing for multilevel modeling.
- See in action how easy it is to perform DFT simulations using NanoLab GUI in QuantumATK: access materials databases, build structures, set up calculations, submit and run jobs, visualize and analyze results using advanced post-processing capabilities, and prepare high quality figures for your publications.
- Extended QA session with interactive live-demo.
Dr. Umberto Martinez