UPSILON-REPRESENTABILITY FOR SYSTEMS WITH LOW DEGENERACY

被引:31
作者
CHEN, JQ [1 ]
STOTT, MJ [1 ]
机构
[1] UNIV SCI & TECHNOL CHINA, CTR FUNDAMENTAL PHYS, HEFEI, PEOPLES R CHINA
来源
PHYSICAL REVIEW A | 1991年 / 44卷 / 05期
关键词
D O I
10.1103/PhysRevA.44.2816
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
We consider the upsilon-representability of the particle density for a noninteracting system of spinless fermions by introducing the idea of proper order of a set of energy levels. It is shown that if E1(lambda), E2(lambda), and E3(lambda) are three energy levels associated with some local potential V-lambda (r) that is a continuous function of lambda = (lambda-1,lambda-2,lambda-3) over all possible points lambda, where lambda-i is the occupation number of the ith state and M = lambda-1 + lambda-2 + lambda-3 is the total number of particles distributed over the three levels, then there must be at least one lambda for which the three levels are in so-called proper order, in which the levels below the highest occupied level are filled. This result provides a basis for the proof of ensemble upsilon-representability of some N-particle density for which the ground-state degeneracy of the system is no more than three. As examples, three- and two-dimensional central systems are examined, and an N-particle central density is shown to be ensemble upsilon-representable for small N (N less-than-or-equal-to 14 and N less-than-or-equal-to 9 for three- and two-dimensional cases, respectively). The implications for density-functional theory are discussed.
引用
收藏
页码:2816 / 2822
页数:7
相关论文
共 14 条
[1]  
Armstrong M.A., 1983, BASIC TOPOLOGY
[2]   DENSITY-FUNCTIONAL THEORY FOR 2 NONINTERACTING SPINLESS FERMIONS [J].
ARYASETIAWAN, F ;
STOTT, MJ .
PHYSICAL REVIEW B, 1986, 34 (06) :4401-4404
[3]   EFFECTIVE POTENTIALS IN DENSITY-FUNCTIONAL THEORY [J].
ARYASETIAWAN, F ;
STOTT, MJ .
PHYSICAL REVIEW B, 1988, 38 (05) :2974-2987
[4]   UPSILON-REPRESENTABILITY FOR SYSTEMS OF A FEW FERMIONS [J].
CHEN, JQ ;
STOTT, MJ .
PHYSICAL REVIEW A, 1991, 44 (05) :2809-2815
[5]   HOHENBERG-KOHN THEOREM AND NON-V-REPRESENTABLE DENSITIES [J].
ENGLISCH, H ;
ENGLISCH, R .
PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS, 1983, 121 (1-2) :253-268
[6]   INHOMOGENEOUS ELECTRON-GAS [J].
RAJAGOPAL, AK ;
CALLAWAY, J .
PHYSICAL REVIEW B, 1973, 7 (05) :1912-1919
[7]   UPSILON-REPRESENTABILITY AND DENSITY FUNCTIONAL THEORY [J].
KOHN, W .
PHYSICAL REVIEW LETTERS, 1983, 51 (17) :1596-1598
[8]   SELF-CONSISTENT EQUATIONS INCLUDING EXCHANGE AND CORRELATION EFFECTS [J].
KOHN, W ;
SHAM, LJ .
PHYSICAL REVIEW, 1965, 140 (4A) :1133-&
[9]  
KOHN W, 1985, DENSITY FUNCTIONAL M
[10]   ELECTRON-DENSITIES IN SEARCH OF HAMILTONIANS [J].
LEVY, M .
PHYSICAL REVIEW A, 1982, 26 (03) :1200-1208