L2 DISCRETIZATION OF ATOMIC AND MOLECULAR ELECTRONIC CONTINUA - MOMENT, QUADRATURE AND J-MATRIX TECHNIQUES

被引：85

作者：

REINHARDT, WP

机构：

[1] UNIV COLORADO,JOINT INST LAB ASTROPHYS,BOULDER,CO 80309

[2] NBS,BOULDER,CO 80309

来源：

COMPUTER PHYSICS COMMUNICATIONS | 1979年 / 17卷 / 1-2期

关键词：

D O I：

10.1016/0010-4655(79)90064-X

中图分类号：

TP39 [计算机的应用];

学科分类号：

081203 ; 0835 ;

摘要：

引用

页码：1 / 21

页数：21

共 12 条

[1] J-matrix method of scattering in any L2 basis -: art. no. 042703
Yamani, HA
Alhaidari, AD
Abdelmonem, MS
PHYSICAL REVIEW A, 2001, 64 (04): : 9
[2] L2 DISCRETIZATION TECHNIQUES - APPLICATION TO SCATTERING AND PHOTOIONIZATION
REINHARD.WP
BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1974, 19 (05): : 648 - 648
[3] J-matrix method of scattering in any L2basis
Yamani, H.A.
Alhaidari, A.D.
Abdelmonem, M.S.
2001, American Institute of Physics Inc. (64):
[4] ELECTRONIC-TRANSITION MOMENT OF THE BO+U-X1-SIGMA-+G SYSTEM OF L2 THROUGH GAIN MEASUREMENTS OF AN L2 OPTICALLY PUMPED LASER
KOFFEND, JB
BACIS, R
FIELD, RW
JOURNAL OF CHEMICAL PHYSICS, 1979, 70 (05): : 2366 - 2372
[5] EQUIVALENT QUADRATURE CALCULATION OF MATRIX-ELEMENTS OF (Z-P2/2M)-1 USING AN L2 EXPANSION TECHNIQUE
HELLER, EJ
REINHARDT, WP
YAMANI, HA
JOURNAL OF COMPUTATIONAL PHYSICS, 1973, 13 (04) : 536 - 550
[6] EXTRACTION OF CONTINUUM PROPERTIES FROM L2 BASIS SET MATRIX REPRESENTATIONS OF THE SCHRODINGER-EQUATION - THE STURM SEQUENCE POLYNOMIALS AND GAUSS QUADRATURE
BROAD, JT
LECTURE NOTES IN MATHEMATICS, 1982, 968 : 53 - 70
[7] The Fock matrix analysis for atomic orbitals in molecular orbitals II.: The electronic structure of N2 molecules
Hsu, Wen-Yi
Lee, Hsing-Yi
Wang, Shao-Pin
Chang, Tse-Chiang
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2008, 55 (01) : 97 - 102
[8] EQQ MEASUREMENTS IN THE X, 1G, OG+ AND B-STATE OF L2 - A TEST OF THE ELECTRONIC MOLECULAR EIGENFUNCTIONS
BACIS, R
BROYER, M
CHURASSY, S
VERGES, J
VIGUE, J
JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (06): : 2641 - 2650
[9] L-2 R-MATRIX STUDIES OF MOLECULAR COLLISION PROCESSES-ENERGY DEPENDENCE OF SIGMA-VJ-]V'J' FOR HE-4+H2
GERRATT, J
WILSON, IDL
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1980, 372 (1749) : 219 - 241
[10] DFT Studies on Molecular and Electronic Structures of Cationic Carbene Complexes [L2(η5-C5H5)Fe=CR2]+ (L = CO, PH3, dhpe, PPh3; R = H, F, CH3)
Hyla-Kryspin, Isabella
Mueck-Lichtenfeld, Christian
Grimme, Stefan
CROATICA CHEMICA ACTA, 2009, 82 (01) : 115 - 127

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