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Microsoft Research· Sebastian Ehlert, Stefano Battaglia, Thijs Vogels, Jan Hermann, Jens Wehner, Giulia Luise, Klaas Giesbertz, Chin-Wei Huang, Aaron Kaplan, Kate Milton, Stephanie Marisa Lanius, Derk Kooi, P. Bernát Szabó, Gregor Simm, Rianne van den Berg, Paola Gori Giorgi·· 2026-08-21AI 评分43

拓展 Skala 可用性:加速迈向预测性 DFT

Broadening access to Skala creates a faster path to predictive DFT

AI 导读

Microsoft Research 发布深度学习交换相关泛函 Skala 1.1,训练数据量提升至前代的 2.5 倍,在保持 meta-GGA 计算成本的同时显著提升模拟精度。

来源:Microsoft Research · microsoft.com