Classifying superheavy elements by machine learning

Among the 118 elements listed in the periodic table, there are nine superheavy elements (Mt, Ds, Mc, Rg, Nh, Fl, Lv, Ts, and Og) that have not yet been well studied experimentally because of their limited half-lives and production rates. How to classify these elements for further study remains an op...

Full description

Bibliographic Details
Main Authors: Gong, Sheng, Wu, Wei, Wang, Fancy Qian, Liu, Jie, Zhao, Yu, Shen, Yiheng, Wang, Shuo, Sun, Qiang, Wang, Qian
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering
Format: Article
Language:English
Published: American Physical Society 2019
Online Access:http://hdl.handle.net/1721.1/120709
https://orcid.org/0000-0002-7457-7959
_version_ 1826192030606295040
author Gong, Sheng
Wu, Wei
Wang, Fancy Qian
Liu, Jie
Zhao, Yu
Shen, Yiheng
Wang, Shuo
Sun, Qiang
Wang, Qian
author2 Massachusetts Institute of Technology. Department of Materials Science and Engineering
author_facet Massachusetts Institute of Technology. Department of Materials Science and Engineering
Gong, Sheng
Wu, Wei
Wang, Fancy Qian
Liu, Jie
Zhao, Yu
Shen, Yiheng
Wang, Shuo
Sun, Qiang
Wang, Qian
author_sort Gong, Sheng
collection MIT
description Among the 118 elements listed in the periodic table, there are nine superheavy elements (Mt, Ds, Mc, Rg, Nh, Fl, Lv, Ts, and Og) that have not yet been well studied experimentally because of their limited half-lives and production rates. How to classify these elements for further study remains an open question. For superheavy elements, although relativistic quantum-mechanical calculations for the single atoms are more accurate and reliable than those for their molecules and crystals, there is no study reported to classify elements solely based on atomic properties. By using cutting-edge machine learning techniques, we find the relationship between atomic data and classification of elements, and further identify that Mt, Ds, Mc, Rg, Lv, Ts, and Og should be metals, while Nh and Fl should be metalloids. These findings not only highlight the significance of machine learning for superheavy atoms but also challenge the conventional belief that one can determine the characteristics of an element only by looking at its position in the table.
first_indexed 2024-09-23T09:05:14Z
format Article
id mit-1721.1/120709
institution Massachusetts Institute of Technology
language English
last_indexed 2024-09-23T09:05:14Z
publishDate 2019
publisher American Physical Society
record_format dspace
spelling mit-1721.1/1207092022-09-30T13:20:59Z Classifying superheavy elements by machine learning Gong, Sheng Wu, Wei Wang, Fancy Qian Liu, Jie Zhao, Yu Shen, Yiheng Wang, Shuo Sun, Qiang Wang, Qian Massachusetts Institute of Technology. Department of Materials Science and Engineering Gong, Sheng Among the 118 elements listed in the periodic table, there are nine superheavy elements (Mt, Ds, Mc, Rg, Nh, Fl, Lv, Ts, and Og) that have not yet been well studied experimentally because of their limited half-lives and production rates. How to classify these elements for further study remains an open question. For superheavy elements, although relativistic quantum-mechanical calculations for the single atoms are more accurate and reliable than those for their molecules and crystals, there is no study reported to classify elements solely based on atomic properties. By using cutting-edge machine learning techniques, we find the relationship between atomic data and classification of elements, and further identify that Mt, Ds, Mc, Rg, Lv, Ts, and Og should be metals, while Nh and Fl should be metalloids. These findings not only highlight the significance of machine learning for superheavy atoms but also challenge the conventional belief that one can determine the characteristics of an element only by looking at its position in the table. 2019-03-04T19:59:32Z 2019-03-04T19:59:32Z 2019-02 2018-12 2019-02-08T18:00:30Z Article http://purl.org/eprint/type/JournalArticle 2469-9926 2469-9934 http://hdl.handle.net/1721.1/120709 Gong, Sheng et al. "Classifying superheavy elements by machine learning." Physical Review A 99, 2 (February 2019): 022110 © 2019 American Physical Society https://orcid.org/0000-0002-7457-7959 en http://dx.doi.org/10.1103/PhysRevA.99.022110 Physical Review A Article is made available in accordance with the publisher's policy and may be subject to US copyright law. Please refer to the publisher's site for terms of use. American Physical Society application/pdf American Physical Society American Physical Society
spellingShingle Gong, Sheng
Wu, Wei
Wang, Fancy Qian
Liu, Jie
Zhao, Yu
Shen, Yiheng
Wang, Shuo
Sun, Qiang
Wang, Qian
Classifying superheavy elements by machine learning
title Classifying superheavy elements by machine learning
title_full Classifying superheavy elements by machine learning
title_fullStr Classifying superheavy elements by machine learning
title_full_unstemmed Classifying superheavy elements by machine learning
title_short Classifying superheavy elements by machine learning
title_sort classifying superheavy elements by machine learning
url http://hdl.handle.net/1721.1/120709
https://orcid.org/0000-0002-7457-7959
work_keys_str_mv AT gongsheng classifyingsuperheavyelementsbymachinelearning
AT wuwei classifyingsuperheavyelementsbymachinelearning
AT wangfancyqian classifyingsuperheavyelementsbymachinelearning
AT liujie classifyingsuperheavyelementsbymachinelearning
AT zhaoyu classifyingsuperheavyelementsbymachinelearning
AT shenyiheng classifyingsuperheavyelementsbymachinelearning
AT wangshuo classifyingsuperheavyelementsbymachinelearning
AT sunqiang classifyingsuperheavyelementsbymachinelearning
AT wangqian classifyingsuperheavyelementsbymachinelearning