ELECTRONIC-STRUCTURE OF MOLECULES HAVING ARBITRARY BOUNDARIES

被引：3

作者：

SCHEIRE, L ^{[1
]}

PHARISEAU, P ^{[1
]}

机构：

[1] RIJKS UNIV GHENT,SEMINARIE WISKUNDIGE NATUURKUNDE,KRIJGSLAAN 271-S9,B9000 GHENT,BELGIUM

来源：

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1975年 / 9卷 / 05期

关键词：

D O I：

10.1002/qua.560090511

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

收藏

页码：887 / 900

页数：14

相关论文

共 9 条

[1] CALCULATION OF IONIZATION ENERGIES OF SULPHUR HEXAFLUORIDE MOLECULE BY MULTIPLE SCATTERING METHOD
CONNOLLY, JW
JOHNSON, KH
[J]. CHEMICAL PHYSICS LETTERS, 1971, 10 (05) : 616 - &
[2] SOLUTION OF SCHRODINGER AND RELATED EQUATIONS FOR IRREGULAR AND COMPOSITE REGIONS
EYGES, L
[J]. ANNALS OF PHYSICS, 1973, 81 (02) : 567 - 590
[3] HERMAN F, IN PRESS
[4] MULTIPLE-SCATTERING MODEL FOR POLYATOMIC MOLECULES
JOHNSON, KH
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (08) : 3085 - &
[5] CHEMICAL BONDING OF A MOLECULAR TRANSITION-METAL ION IN A CRYSTALLINE ENVIRONMENT
JOHNSON, KH
SMITH, FC
[J]. PHYSICAL REVIEW B, 1972, 5 (03): : 831 - &
[6] MESSIAH A, 1965, MECANIQUE QUANTIQUE, V1, P297
[7] SCHEIRE L, 1974, PHYSICA, V74, P596
[8] SCATTERING MODEL OF MOLECULAR ELECTRONIC STRUCTURE
SMITH, FC
JOHNSON, KH
[J]. PHYSICAL REVIEW LETTERS, 1969, 22 (22) : 1168 - &
[9] NON-MUFFIN-TIN ENERGY BANDS FOR SILICON BY KORRINGA-KOHN-ROSTOKER METHOD
WILLIAMS, AR
[J]. PHYSICAL REVIEW B, 1970, 1 (08): : 3417 - &