ABOUT THE SIMULTANEOUS INTERPRETATION OF CHARGE AND SPIN-DENSITY DATA

被引：16

作者：

BECKER, P ^{[1
]}

COPPENS, P ^{[1
]}

机构：

[1] SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214

来源：

ACTA CRYSTALLOGRAPHICA SECTION A | 1985年 / 41卷 / MAR期

关键词：

D O I：

10.1107/S0108767385000368

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：177 / 182

页数：6

共 26 条

[1]

BECKER P, 1980, ELECTRON MAGNETIZATI

[2] POLARIZED NEUTRON STUDY OF COVALENCY EFFECTS IN YTTRIUM IRON-GARNET [J].

BONNET, M ;

DELAPALME, A ;

FUESS, H ;

BECKER, P .

JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, 1979, 40 (11) :863-876

[3]

Clementi E., 1974, Atomic Data and Nuclear Data Tables, V14, P177, DOI 10.1016/S0092-640X(74)80016-1

[4] AB INITIO COMPUTATIONS IN ATOMS AND MOLECULES [J].

CLEMENTI, E .

IBM JOURNAL OF RESEARCH AND DEVELOPMENT, 1965, 9 (01) :2-&

[5] AGREEMENT BETWEEN TRANSITION-METAL ORBITAL POPULATIONS FROM X-RAY AND POLARIZED NEUTRON-SCATTERING EXPERIMENTS [J].

COPPENS, P ;

HOLLADAY, A ;

STEVENS, ED .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (12) :3546-3547

[6] ELECTRON POPULATION ANALYSIS OF ACCURATE DIFFRACTION DATA .7. NET ATOMIC CHARGES AND MOLECULAR DIPOLE-MOMENTS FROM SPHERICAL-ATOM X-RAY REFINEMENTS, AND THE RELATION BETWEEN ATOMIC CHARGE AND SHAPE [J].

COPPENS, P ;

GURUROW, TN ;

LEUNG, P ;

STEVENS, ED ;

BECKER, PJ ;

YANG, YW .

ACTA CRYSTALLOGRAPHICA SECTION A, 1979, 35 (JAN) :63-72

[7] ELECTRON POPULATION ANALYSIS OF ACCURATE DIFFRACTION DATA .1. FORMALISMS AND RESTRICTIONS [J].

COPPENS, P ;

WILLOUGH.TV ;

CSONKA, LN .

ACTA CRYSTALLOGRAPHICA SECTION A-CRYSTAL PHYSICS DIFFRACTION THEORETICAL AND GENERAL CRYSTALLOGRAPHY, 1971, A 27 (MAY1) :248-&

[8] SPIN-DENSITY AND MANGANESE ELECTRONIC-STRUCTURE IN PHTHALOCYANINATOMANGANESE(II) [J].

FIGGIS, BN ;

WILLIAMS, GA ;

FORSYTH, JB ;

MASON, R .

JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1981, (09) :1837-1845

[9] COVALENT BONDING IN TRANS-TETRAAMMINEDINITRONICKEL(II) STUDIED BY POLARIZED NEUTRON-DIFFRACTION AT 4.5-K [J].

FIGGIS, BN ;

REYNOLDS, PA ;

MASON, R .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1983, 105 (03) :440-443

[10]

FIGGIS BN, 1983, J CHEM SOC DA, V4, P703

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