DIRECT CALCULATION OF DYNAMIC DENSITIES

被引:8
作者
SCHERINGER, C
REITZ, H
机构
[1] UNIV MARBURG,FACHBEREICH GEOWISSENSCH,MARBURG,FED REP GER
[2] UNIV MARBURG,FACHBEREICH PHYS CHEM,MARBURG,FED REP GER
来源
ACTA CRYSTALLOGRAPHICA SECTION A | 1976年 / 32卷 / MAR1期
关键词
D O I
10.1107/S0567739476000594
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:271 / 273
页数:3
相关论文
共 12 条
[1]   ELECTRONIC WAVE FUNCTIONS .1. A GENERAL METHOD OF CALCULATION FOR THE STATIONARY STATES OF ANY MOLECULAR SYSTEM [J].
BOYS, SF .
PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1950, 200 (1063) :542-554
[2]   DISTRIBUTION OF BOND ELECTRONS IN DECABORANE MOLECULE (B1OH14) [J].
BRILL, R ;
DIETRICH, H ;
DIERKS, H .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1971, B 27 (OCT15) :2003-+
[3]   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-&
[4]   EFFECT OF MOLECULAR VIBRATIONS ON APPARENT BOND LENGTHS [J].
COULSON, CA ;
THOMAS, MW .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1971, B 27 (JUL15) :1354-&
[5]   STRUCTURE AND ELECTRON DENSITY OF 2,5-DIMETHYL-P-BENZOQUINONE [J].
HIRSHFEL.FL ;
RABINOVI.D .
ACTA CRYSTALLOGRAPHICA, 1967, 23 :989-&
[6]   DIFFERENCES DENSITIES BY LEAST-SQUARES REFINEMENT - FUMARAMIC ACID [J].
HIRSHFELD, FL .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1971, B 27 (APR15) :769-+
[7]  
HOSEMANN R, 1962, DIRECT ANALYSIS DIFF, P67
[8]   THEORETICAL CALCULATION OF TIME-AVERAGED ELECTRON-DENSITY DISTRIBUTION FOR VIBRATING ETHYNE MOLECULES IN A MODEL CRYSTAL-STRUCTURE [J].
RUYSINK, AFJ ;
VOS, A .
ACTA CRYSTALLOGRAPHICA SECTION A, 1974, A 30 (JUL1) :497-502
[9]  
SCHERINGER C, TO BE PUBLISHED
[10]   SMALL GAUSSIAN EXPANSIONS OF ATOMIC ORBITALS [J].
STEWART, RF .
JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (06) :2485-&