Linear-response TDDFT and supercell core-hole calculations of electron energy-loss spectra in polymorphic HfO<sub>2</sub>

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2025年10月,党的二十届四中全会擘画了中国未来五年的发展蓝图。一周后,外事出访期间,习近平总书记这样向世界阐释中国成功的密码:“70多年来,我们坚持一张蓝图绘到底,一茬接着一茬干”。

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As a data scientist, I’ve been frustrated that there haven’t been any impactful new Python data science tools released in the past few years other than polars. Unsurprisingly, research into AI and LLMs has subsumed traditional DS research, where developments such as text embeddings have had extremely valuable gains for typical data science natural language processing tasks. The traditional machine learning algorithms are still valuable, but no one has invented Gradient Boosted Decision Trees 2: Electric Boogaloo. Additionally, as a data scientist in San Francisco I am legally required to use a MacBook, but there haven’t been data science utilities that actually use the GPU in an Apple Silicon MacBook as they don’t support its Metal API; data science tooling is exclusively in CUDA for NVIDIA GPUs. What if agents could now port these algorithms to a) run on Rust with Python bindings for its speed benefits and b) run on GPUs without complex dependencies?

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