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You Will Do: Design & advance digital twins: Integrate electronic structure (e.g., DFT, ab initio MD, tight‑binding) with multiscale simulations to predict experimental observables at interfaces. Bridge
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templates for distributed AI training, agentic AI with modeling and simulation, and end-to-end workflow monitoring, profiling, and optimization. Working with quantum simulation tools, including NVIDIA CUDA-Q
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software. Collaborate with computational and domain scientists to integrate state-of-the-art AI with simulation and data analysis, including modern agentic approaches. Publish and present results in peer
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