{"title":"哈特里福克能量泛函的临界值的有限个数小于一个常数,小于第一个能量阈值","authors":"Sohei Ashida","doi":"10.2206/kyushujm.75.277","DOIUrl":null,"url":null,"abstract":"We study the Hartree-Fock equation and the Hartree-Fock energy functional universally used in many-electron problems. We prove that the set of all critical values of the Hartree-Fock energy functional less than a constant smaller than the first energy threshold is finite. Since the Hartree-Fock equation which is the corresponding Euler-Lagrange equation is a system of nonlinear eigenvalue problems, the spectral theory for linear operators is not applicable. The present result is obtained establishing the finiteness of the critical values associated with orbital energies less than a negative constant and combining the result with the Koopmans' well-known theorem. The main ingredients are the proof of convergence of the solutions and the analysis of the Fr\\'echet second derivative of the functional at the limit point.","PeriodicalId":49929,"journal":{"name":"Kyushu Journal of Mathematics","volume":" ","pages":""},"PeriodicalIF":0.6000,"publicationDate":"2020-02-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"3","resultStr":"{\"title\":\"FINITENESS OF THE NUMBER OF CRITICAL VALUES OF THE HARTREE-FOCK ENERGY FUNCTIONAL LESS THAN A CONSTANT SMALLER THAN THE FIRST ENERGY THRESHOLD\",\"authors\":\"Sohei Ashida\",\"doi\":\"10.2206/kyushujm.75.277\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"We study the Hartree-Fock equation and the Hartree-Fock energy functional universally used in many-electron problems. We prove that the set of all critical values of the Hartree-Fock energy functional less than a constant smaller than the first energy threshold is finite. Since the Hartree-Fock equation which is the corresponding Euler-Lagrange equation is a system of nonlinear eigenvalue problems, the spectral theory for linear operators is not applicable. The present result is obtained establishing the finiteness of the critical values associated with orbital energies less than a negative constant and combining the result with the Koopmans' well-known theorem. The main ingredients are the proof of convergence of the solutions and the analysis of the Fr\\\\'echet second derivative of the functional at the limit point.\",\"PeriodicalId\":49929,\"journal\":{\"name\":\"Kyushu Journal of Mathematics\",\"volume\":\" \",\"pages\":\"\"},\"PeriodicalIF\":0.6000,\"publicationDate\":\"2020-02-18\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"3\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Kyushu Journal of Mathematics\",\"FirstCategoryId\":\"100\",\"ListUrlMain\":\"https://doi.org/10.2206/kyushujm.75.277\",\"RegionNum\":4,\"RegionCategory\":\"数学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"MATHEMATICS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Kyushu Journal of Mathematics","FirstCategoryId":"100","ListUrlMain":"https://doi.org/10.2206/kyushujm.75.277","RegionNum":4,"RegionCategory":"数学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"MATHEMATICS","Score":null,"Total":0}
FINITENESS OF THE NUMBER OF CRITICAL VALUES OF THE HARTREE-FOCK ENERGY FUNCTIONAL LESS THAN A CONSTANT SMALLER THAN THE FIRST ENERGY THRESHOLD
We study the Hartree-Fock equation and the Hartree-Fock energy functional universally used in many-electron problems. We prove that the set of all critical values of the Hartree-Fock energy functional less than a constant smaller than the first energy threshold is finite. Since the Hartree-Fock equation which is the corresponding Euler-Lagrange equation is a system of nonlinear eigenvalue problems, the spectral theory for linear operators is not applicable. The present result is obtained establishing the finiteness of the critical values associated with orbital energies less than a negative constant and combining the result with the Koopmans' well-known theorem. The main ingredients are the proof of convergence of the solutions and the analysis of the Fr\'echet second derivative of the functional at the limit point.
期刊介绍:
The Kyushu Journal of Mathematics is an academic journal in mathematics, published by the Faculty of Mathematics at Kyushu University since 1941. It publishes selected research papers in pure and applied mathematics. One volume, published each year, consists of two issues, approximately 20 articles and 400 pages in total.
More than 500 copies of the journal are distributed through exchange contracts between mathematical journals, and available at many universities, institutes and libraries around the world. The on-line version of the journal is published at "Jstage" (an aggregator for e-journals), where all the articles published by the journal since 1995 are accessible freely through the Internet.