ELECTRON POPULATION ANALYSIS OF ACCURATE DIFFRACTION DATA .10. JOINT X-RAY AND NEUTRON DATA REFINEMENT OF STRUCTURAL AND CHARGE-DENSITY PARAMETERS

被引:31
作者
COPPENS, P
BOEHME, R
PRICE, PF
STEVENS, ED
机构
来源
ACTA CRYSTALLOGRAPHICA SECTION A | 1981年 / 37卷 / NOV期
关键词
D O I
10.1107/S0567739481001873
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:857 / 863
页数:7
相关论文
共 17 条
[1]   EXPERIMENTAL CHARGE-DENSITY IN SULFUR-CONTAINING MOLECULES - STUDY OF DEFORMATION ELECTRON-DENSITY IN SULFAMIC ACID AT 78-K BY X-RAY AND NEUTRON-DIFFRACTION [J].
BATS, JW ;
COPPENS, P ;
KOETZLE, TF .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1977, 33 (JAN15) :37-45
[2]   EXPERIMENTAL CHARGE-DISTRIBUTION IN SULFUR-CONTAINING MOLECULES - STRUCTURE DETERMINATION AND ELECTRON-DENSITY STUDY OF NASCN AT REDUCED TEMPERATURES [J].
BATS, JW ;
COPPENS, P ;
KVICK, A .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1977, 33 (MAY13) :1534-1542
[3]   EVIDENCE FOR SYSTEMATIC ERRORS IN X-RAY TEMPERATURE PARAMETERS RESULTING FROM BONDING EFFECTS [J].
COPPENS, P .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1968, B 24 :1272-&
[4]   SOME IMPLICATIONS OF COMBINED X-RAY AND NEUTRON-DIFFRACTION STUDIES [J].
COPPENS, P .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1974, 30 (FEB15) :255-261
[5]  
COPPENS P, 1980, COMPUTING CRYSTALLOG
[6]  
CRAVEN BM, 1979, ACTA CRYSTALLOGR B, V25, P934
[7]   ELECTRON POPULATION ANALYSIS OF ACCURATE DIFFRACTION DATA .6. TESTING ASPHERICAL ATOM REFINEMENTS ON SMALL-MOLECULE DATA SETS [J].
HANSEN, NK ;
COPPENS, P .
ACTA CRYSTALLOGRAPHICA SECTION A, 1978, 34 (NOV) :909-921
[8]  
HIRSHFELD FL, 1977, ISRAEL J CHEM, V16, P226
[9]   STATISTICS OF DERIVED INTENSITIES [J].
MCCANDLISH, LE ;
STOUT, GH ;
ANDREWS, LC .
ACTA CRYSTALLOGRAPHICA SECTION A, 1975, A 31 (MAR1) :245-249
[10]  
MCMULLEN RK, UNPUBLISHED