THEORETICAL DEFORMATION DENSITY FOR OXALIC-ACID

被引:13
作者
JOHANSEN, H
机构
来源
ACTA CRYSTALLOGRAPHICA SECTION A | 1979年 / 35卷 / MAR期
关键词
D O I
10.1107/S0567739479000668
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
[No abstract available]
引用
收藏
页码:319 / 325
页数:7
相关论文
共 21 条
[1]   HYDROGEN-BOND STUDIES .77. ELECTRON-DENSITY DISTRIBUTION IN ALPHA-GLYCINE - X-N DIFFERENCE FOURIER SYNTHESIS VS AB-INITIO CALCULATIONS [J].
ALMLOF, J ;
KVICK, A ;
THOMAS, JO .
JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (08) :3901-3906
[2]  
ALMLOF J, 1972, 2ND P SEM COMP PROBL, P14
[3]  
BAGUS PS, 1972, RJ1077 IBM RES REP
[4]  
Coppens, 1977, ADV QUANTUM CHEM, V10, P1, DOI DOI 10.1016/S0065-3276(08)60577-8
[5]   AN EXPERIMENTAL DETERMINATION OF ASPHERICITY OF ATOMIC CHARGE DISTRIBUTION IN OXALIC ACID DIHYDRATE [J].
COPPENS, P ;
SABINE, TM ;
DELAPLAN.RG ;
IBERS, JA .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1969, B 25 :2451-&
[6]   SOME IMPLICATIONS OF COMBINED X-RAY AND NEUTRON-DIFFRACTION STUDIES [J].
COPPENS, P .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1974, 30 (FEB15) :255-261
[7]   NEUTRON DIFFRACTION STUDY OF HYDROGEN BONDING AND THERMAL MOTION IN DEUTERATED ALPHA AND BETA OXALIC ACID DIHYDRATE [J].
COPPENS, P ;
SABINE, TM .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1969, B 25 :2442-&
[8]   ABINITIO SCF COMPUTATIONS ON BENZENE AND BENZENIUM ION USING A LARGE CONTRACTED GAUSSIAN BASIS SET [J].
ERMLER, WC ;
MULLIKEN, RS ;
CLEMENTI, E .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (02) :388-394
[9]   THEORETICAL CALCULATIONS OF DEFORMATION DENSITIES IN SOME TRANSITION-METAL COMPLEXES [J].
JOHANSEN, H .
ACTA CRYSTALLOGRAPHICA SECTION A, 1976, 32 (MAY1) :353-355
[10]  
Koopmans T.A., 1934, PHYSICA, V1, P104, DOI DOI 10.1016/S0031-8914(34)90011-2