EFFECTIVE CORRELATION-ENERGY OF A SI DANGLING BOND CALCULATED WITH THE LOCAL-SPIN-DENSITY APPROXIMATION

被引：31

作者：

NORTHRUP, JE

机构：

来源：

PHYSICAL REVIEW B | 1989年 / 40卷 / 08期

关键词：

D O I：

10.1103/PhysRevB.40.5875

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

引用

页码：5875 / 5878

页数：4

共 22 条

[1] DANGLING BOND IN A SI-H [J].

BARYAM, Y ;

JOANNOPOULOS, JD .

PHYSICAL REVIEW LETTERS, 1986, 56 (20) :2203-2206

[2]

BERNHOLC J, 1985, J ELECTRON MATER A, V14, P781

[3] HYPERFINE STUDIES OF DANGLING BONDS IN AMORPHOUS-SILICON [J].

BIEGELSEN, DK ;

STUTZMANN, M .

PHYSICAL REVIEW B, 1986, 33 (05) :3006-3011

[4] SI-29 HYPERFINE-STRUCTURE OF UNPAIRED SPINS AT THE SI/SIO2 INTERFACE [J].

BROWER, KL .

APPLIED PHYSICS LETTERS, 1983, 43 (12) :1111-1113

[5] HYPERFINE INTERACTIONS OF THE PB CENTER AT THE SIO2 SI(111) INTERFACE [J].

COOK, M ;

WHITE, CT .

PHYSICAL REVIEW LETTERS, 1987, 59 (15) :1741-1744

[6] THEORY OF THE PB CENTER AT THE [111] SI/SIO2 INTERFACE [J].

EDWARDS, AH .

PHYSICAL REVIEW B, 1987, 36 (18) :9638-9648

[7] NORM-CONSERVING PSEUDOPOTENTIALS [J].

HAMANN, DR ;

SCHLUTER, M ;

CHIANG, C .

PHYSICAL REVIEW LETTERS, 1979, 43 (20) :1494-1497

[8] MOMENTUM-SPACE FORMALISM FOR THE TOTAL ENERGY OF SOLIDS [J].

IHM, J ;

ZUNGER, A ;

COHEN, ML .

JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1979, 12 (21) :4409-4422

[9] SELF-CONSISTENT EQUATIONS INCLUDING EXCHANGE AND CORRELATION EFFECTS [J].

KOHN, W ;

SHAM, LJ .

PHYSICAL REVIEW, 1965, 140 (4A) :1133-&

[10] PREDICTIONS OF THE BOND LENGTH AND VIBRATIONAL FREQUENCY OF GE-2 [J].

NORTHRUP, JE ;

COHEN, ML .

CHEMICAL PHYSICS LETTERS, 1983, 102 (05) :440-441

← 1 2 3 →