论文标题
从回归不确定性中学习阶段过渡:一种新的基于回归的机器学习方法,用于自动检测物质的阶段
Learning phase transitions from regression uncertainty: A new regression-based machine learning approach for automated detection of phases of matter
论文作者
论文摘要
为了执行涉及各种物理问题的回归任务,可以提高精确度或等效地降低回归结果的不确定性,这无疑是中心目标之一。在这里,有些令人惊讶的是,我们发现执行反向统计问题的回归任务的不利回归不确定性实际上包含有关正在考虑的系统的相变的隐藏信息。通过利用这些隐藏的信息,我们开发了一种新的无监督的机器学习方法来自动检测物质阶段,并从回归不确定性中说出了学习。这是通过揭示系统的回归不确定性和响应属性之间的固有联系来实现的,从而使该机器学习方法的输出可以直接通过传统的物理学概念来解释。我们通过识别铁磁ising模型和三态时钟模型的临界点,并揭示了六态和七态时钟模型中中间阶段的存在来证明该方法。与迄今为止开发的广泛基于分类的方法相比,尽管成功,但它们公认的类别类别本质上是抽象的,这阻碍了它们与常规物理学概念的直接关系。即使人们采用了在分类任务上表现出色的最先进的深层神经网络,这些挑战仍然存在。相比之下,由于核心工作马是执行回归任务的神经网络,我们的新方法不仅实际上更有效,而且还为通过以物理方式解释的方式通过机器学习揭示新物理学的可能性铺平了道路。
For performing regression tasks involved in various physics problems, enhancing the precision or equivalently reducing the uncertainty of regression results is undoubtedly one of the central goals. Here, somewhat surprisingly, we find that the unfavorable regression uncertainty in performing the regression tasks of inverse statistical problems actually contains hidden information concerning the phase transitions of the system under consideration. By utilizing this hidden information, we develop a new unsupervised machine learning approach for automated detection of phases of matter, dubbed learning from regression uncertainty. This is achieved by revealing an intrinsic connection between regression uncertainty and response properties of the system, thus making the outputs of this machine learning approach directly interpretable via conventional notions of physics. We demonstrate the approach by identifying the critical points of the ferromagnetic Ising model and the three-state clock model, and revealing the existence of the intermediate phase in the six-state and seven-state clock models. Comparing to the widely-used classification-based approaches developed so far, although successful, their recognized classes of patterns are essentially abstract, which hinders their straightforward relation to conventional notions of physics. These challenges persist even when one employs the state-of-the-art deep neural networks that excel at classification tasks. In contrast, with the core working horse being a neural network performing regression tasks, our new approach is not only practically more efficient, but also paves the way towards intriguing possibilities for unveiling new physics via machine learning in a physically interpretable manner.