THE BINDING IN NEUTRAL TRANSITION-METAL WATER COMPLEXES

被引：30

作者：

BLOMBERG, MRA

BRANDEMARK, UB

SIEGBAHN, PEM

机构：

来源：

CHEMICAL PHYSICS LETTERS | 1986年 / 126卷 / 3-4期

关键词：

D O I：

10.1016/S0009-2614(86)80091-4

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

页码：317 / 324

页数：8

共 29 条

[21] FINITE-PERTURBATION CALCULATION OF STATIC QUADRUPOLE AND MIXED DIPOLE-OCTUPOLE POLARIZABILITIES FOR GROUND-STATES OF 1ST-ROW ATOMS [J].

REINSCH, EA ;

MEYER, W .

PHYSICAL REVIEW A, 1978, 18 (05) :1793-1796

[22] A COMPLETE ACTIVE SPACE SCF METHOD (CASSCF) USING A DENSITY-MATRIX FORMULATED SUPER-CI APPROACH [J].

ROOS, BO ;

TAYLOR, PR ;

SIEGBAHN, PEM .

CHEMICAL PHYSICS, 1980, 48 (02) :157-173

[23] LASER PHOTO-ELECTRON SPECTROMETRY OF NI(CO)1-, NI(CO)2-, AND NI(CO)3- [J].

STEVENS, AE ;

FEIGERLE, CS ;

LINEBERGER, WC .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (19) :5026-5031

[24] SMALL GAUSSIAN EXPANSIONS OF SLATER-TYPE ORBITALS [J].

STEWART, RF .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (01) :431-&

[25] SYSTEMATIC PREPARATION OF NEW CONTRACTED GAUSSIAN-TYPE ORBITAL SET .1. TRANSITION-METAL ATOMS FROM SC TO ZN [J].

TATEWAKI, H ;

HUZINAGA, S .

JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (11) :4339-4348

[26] A SYSTEMATIC PREPARATION OF NEW CONTRACTED GAUSSIAN-TYPE ORBITAL SETS .3. 2ND-ROW ATOMS FROM LI THROUGH NE [J].

TATEWAKI, H ;

HUZINAGA, S .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1980, 1 (03) :205-228

[27] ELECTRONIC STATES OF MATRIX-ISOLATED NI ATOMS - A MAGNETIC CIRCULAR AND LINEAR DICHROISM STUDY [J].

VALA, M ;

EYRING, M ;

PYKA, J ;

RIVOAL, JC ;

GRISOLIA, C .

JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (03) :969-974

[28]

VANDUIJNEVELDT FB, 1971, IBM RJ945 RES REPT

[29] GAUSSIAN BASIS SET FOR MOLECULAR WAVEFUNCTIONS CONTAINING THIRD-ROW ATOMS [J].

WACHTERS, AJ .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (03) :1033-&

← 1 2 3 →