论文标题
SCGAN:一种生成的对抗网络,可预测假设的超导体
ScGAN: A Generative Adversarial Network to Predict Hypothetical Superconductors
论文作者
论文摘要
尽管已经被发现了三十多年前,但高温超导体(HTSS)既缺乏对其机制的解释,也缺乏一种搜索它们的系统方式。为了帮助这一搜索,该项目提出了Scgan,Scgan是一种生成的对抗网络(GAN),以有效预测新的超导体。 SCGAN接受了OQMD的化合物的培训,然后将其传输到SuperCon数据库或其中的一个子集中。一旦受过训练,GAN被用来预测超导候选者,并且大约70%的人被分类模型确定为超导 - 与手动搜索方法相比,发现率增加了23倍。此外,超过99%的预测是新型材料,表明Scgan能够预测全新的超导体,包括几个有希望的HTS候选者。该项目提出了一种新的,有效的方法来寻找新的超导体,该导体可用于技术应用,也可以洞悉未解决的高温超导性问题。
Despite having been discovered more than three decades ago, High Temperature Superconductors (HTSs) lack both an explanation for their mechanisms and a systematic way to search for them. To aid this search, this project proposes ScGAN, a Generative Adversarial Network (GAN) to efficiently predict new superconductors. ScGAN was trained on compounds in OQMD and then transfer learned onto the SuperCon database or a subset of it. Once trained, the GAN was used to predict superconducting candidates, and approximately 70\% of them were determined to be superconducting by a classification model--a 23-fold increase in discovery rate compared to manual search methods. Furthermore, more than 99\% of predictions were novel materials, demonstrating that ScGAN was able to potentially predict completely new superconductors, including several promising HTS candidates. This project presents a novel, efficient way to search for new superconductors, which may be used in technological applications or provide insight into the unsolved problem of high temperature superconductivity.