FINITENESS OF THE NUMBER OF CRITICAL VALUES OF THE HARTREE-FOCK ENERGY FUNCTIONAL LESS THAN A CONSTANT SMALLER THAN THE FIRST ENERGY THRESHOLD

被引:1
作者
Ashida, Sohei [1 ]
机构
[1] Gakushuin Univ, Dept Math, Toshima Ku, Tokyo 1718588, Japan
关键词
nonlinear eigenvalue problem; Hartree Fock equations; critical values; EXISTENCE; EQUATIONS;
D O I
10.2206/kyushujm.75.277
中图分类号
O1 [数学];
学科分类号
0701 ; 070101 ;
摘要
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 by establishing the finiteness of the critical values associated with orbital energies less than a negative constant and combining the result with Koopmans' well-known theorem. The main ingredients are the proof of convergence of the solutions and the analysis of the Frechet second derivative of the functional at the limit point.
引用
收藏
页码:277 / 294
页数:18
相关论文
共 15 条
[1]  
Agmon S, 1982, LECT EXPONENTIAL DEC
[2]   On the convergence of SCF algorithms for the Hartree-Fock equations [J].
Cancès, E ;
Le Bris, C .
ESAIM-MATHEMATICAL MODELLING AND NUMERICAL ANALYSIS-MODELISATION MATHEMATIQUE ET ANALYSE NUMERIQUE, 2000, 34 (04) :749-774
[3]   Approximation method for the solution of the quantum mechanical multibody problems [J].
Fock, V. .
ZEITSCHRIFT FUR PHYSIK, 1930, 61 (1-2) :126-148
[4]  
Fuelk S., 1972, J. Funct. Anal., V11, P314
[5]   The wave mechanics of an atom with a non-Coulomb central field Part I theory and methods [J].
Hartree, DR .
PROCEEDINGS OF THE CAMBRIDGE PHILOSOPHICAL SOCIETY, 1928, 24 :89-110
[6]  
Kato T., 1985, PERTURBATION THEORY
[7]   Existence of Hartree-Fock excited states for atoms and molecules [J].
Lewin, Mathieu .
LETTERS IN MATHEMATICAL PHYSICS, 2018, 108 (04) :985-1006
[8]   HARTREE-FOCK THEORY FOR COULOMB SYSTEMS [J].
LIEB, EH ;
SIMON, B .
COMMUNICATIONS IN MATHEMATICAL PHYSICS, 1977, 53 (03) :185-194
[9]   SOLUTIONS OF HARTREE-FOCK EQUATIONS FOR COULOMB-SYSTEMS [J].
LIONS, PL .
COMMUNICATIONS IN MATHEMATICAL PHYSICS, 1987, 109 (01) :33-97