O.R. Smits , P. Indelicato , W. Nazarewicz , M. Piibeleht , P. Schwerdtfeger
{"title":"突破元素周期表的极限——原子相对论电子结构理论与超重元素计算综述","authors":"O.R. Smits , P. Indelicato , W. Nazarewicz , M. Piibeleht , P. Schwerdtfeger","doi":"10.1016/j.physrep.2023.09.004","DOIUrl":null,"url":null,"abstract":"<div><p>We review the progress in atomic structure theory with a focus on superheavy elements and their predicted ground state configurations important for an element’s placement in the periodic table. To understand the electronic structure and correlations in the regime of large atomic numbers, it is essential to correctly solve the Dirac equation in strong Coulomb fields, and to take into account quantum electrodynamic effects. We specifically focus on the fundamental difficulties encountered when dealing with the many-particle Dirac equation. We further discuss the possibility for future many-electron atomic structure calculations going beyond the critical nuclear charge <span><math><mrow><msub><mrow><mi>Z</mi></mrow><mrow><mi>crit</mi></mrow></msub><mo>≈</mo><mn>170</mn></mrow></math></span>, where levels such as the <span><math><mrow><mn>1</mn><mi>s</mi></mrow></math></span> shell dive into the negative energy continuum (<span><math><mrow><msub><mrow><mi>E</mi></mrow><mrow><mi>n</mi><mi>κ</mi></mrow></msub><mo><</mo><mo>−</mo><msub><mrow><mi>m</mi></mrow><mrow><mi>e</mi></mrow></msub><msup><mrow><mi>c</mi></mrow><mrow><mn>2</mn></mrow></msup></mrow></math></span>). The nature of the resulting Gamow states within a rigged Hilbert space formalism is highlighted.</p></div>","PeriodicalId":404,"journal":{"name":"Physics Reports","volume":"1035 ","pages":"Pages 1-57"},"PeriodicalIF":23.9000,"publicationDate":"2023-09-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Pushing the limits of the periodic table — A review on atomic relativistic electronic structure theory and calculations for the superheavy elements\",\"authors\":\"O.R. Smits , P. Indelicato , W. Nazarewicz , M. Piibeleht , P. Schwerdtfeger\",\"doi\":\"10.1016/j.physrep.2023.09.004\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>We review the progress in atomic structure theory with a focus on superheavy elements and their predicted ground state configurations important for an element’s placement in the periodic table. To understand the electronic structure and correlations in the regime of large atomic numbers, it is essential to correctly solve the Dirac equation in strong Coulomb fields, and to take into account quantum electrodynamic effects. We specifically focus on the fundamental difficulties encountered when dealing with the many-particle Dirac equation. We further discuss the possibility for future many-electron atomic structure calculations going beyond the critical nuclear charge <span><math><mrow><msub><mrow><mi>Z</mi></mrow><mrow><mi>crit</mi></mrow></msub><mo>≈</mo><mn>170</mn></mrow></math></span>, where levels such as the <span><math><mrow><mn>1</mn><mi>s</mi></mrow></math></span> shell dive into the negative energy continuum (<span><math><mrow><msub><mrow><mi>E</mi></mrow><mrow><mi>n</mi><mi>κ</mi></mrow></msub><mo><</mo><mo>−</mo><msub><mrow><mi>m</mi></mrow><mrow><mi>e</mi></mrow></msub><msup><mrow><mi>c</mi></mrow><mrow><mn>2</mn></mrow></msup></mrow></math></span>). The nature of the resulting Gamow states within a rigged Hilbert space formalism is highlighted.</p></div>\",\"PeriodicalId\":404,\"journal\":{\"name\":\"Physics Reports\",\"volume\":\"1035 \",\"pages\":\"Pages 1-57\"},\"PeriodicalIF\":23.9000,\"publicationDate\":\"2023-09-25\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Physics Reports\",\"FirstCategoryId\":\"4\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S0370157323003009\",\"RegionNum\":1,\"RegionCategory\":\"物理与天体物理\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"PHYSICS, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Physics Reports","FirstCategoryId":"4","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0370157323003009","RegionNum":1,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"PHYSICS, MULTIDISCIPLINARY","Score":null,"Total":0}
Pushing the limits of the periodic table — A review on atomic relativistic electronic structure theory and calculations for the superheavy elements
We review the progress in atomic structure theory with a focus on superheavy elements and their predicted ground state configurations important for an element’s placement in the periodic table. To understand the electronic structure and correlations in the regime of large atomic numbers, it is essential to correctly solve the Dirac equation in strong Coulomb fields, and to take into account quantum electrodynamic effects. We specifically focus on the fundamental difficulties encountered when dealing with the many-particle Dirac equation. We further discuss the possibility for future many-electron atomic structure calculations going beyond the critical nuclear charge , where levels such as the shell dive into the negative energy continuum (). The nature of the resulting Gamow states within a rigged Hilbert space formalism is highlighted.
期刊介绍:
Physics Reports keeps the active physicist up-to-date on developments in a wide range of topics by publishing timely reviews which are more extensive than just literature surveys but normally less than a full monograph. Each report deals with one specific subject and is generally published in a separate volume. These reviews are specialist in nature but contain enough introductory material to make the main points intelligible to a non-specialist. The reader will not only be able to distinguish important developments and trends in physics but will also find a sufficient number of references to the original literature.