Accurate H-atom parameters from X-ray diffraction data

被引:15
|
作者
Farrugia, Louis J. [1 ]
机构
[1] Univ Glasgow, Sch Chem, Glasgow G12 8QQ, Lanark, Scotland
来源
IUCRJ | 2014年 / 1卷
关键词
D O I
10.1107/S2052252514018612
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:265 / 266
页数:2
相关论文
共 50 条
  • [21] ACCURATE POSITIONAL AND THERMAL PARAMETERS OF HEXAMETHYLENETETRAMINE FROM K-SHELL X-RAY-DIFFRACTION DATA
    STEVENS, ED
    HOPE, H
    ACTA CRYSTALLOGRAPHICA SECTION A, 1975, 31 (JUL1): : 494 - 498
  • [22] A GENERAL STRUCTURE FACTOR FORMALISM FOR INTERPRETING ACCURATE X-RAY AND NEUTRON DIFFRACTION DATA
    DAWSON, B
    PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1967, 298 (1454): : 255 - &
  • [23] Automated and accurate deposition of structures solved by X-ray diffraction to the Protein Data Bank
    Yang, HW
    Guranovic, V
    Dutta, S
    Feng, ZK
    Berman, HM
    Westbrook, JD
    ACTA CRYSTALLOGRAPHICA SECTION D-STRUCTURAL BIOLOGY, 2004, 60 : 1833 - 1839
  • [24] Determination of 'Experimental' Wavefunctions from X-ray Diffraction Data
    Turner, Michael
    Howard, Judith
    Yufit, Dimitri
    Jayatilaka, Dylan
    ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2005, 61 : C419 - C419
  • [25] Computing shapes of nanocrystals from X-ray diffraction data
    Sherwood, Daniel
    Emmanuel, Bosco
    CRYSTAL GROWTH & DESIGN, 2006, 6 (06) : 1415 - 1419
  • [26] Molecular electrostatic properties from X-ray diffraction data
    Koritsanszky, T
    FUNDAMENTAL PRINCIPLES OF MOLECULAR MODELING, 1996, : 143 - 166
  • [27] Reconstruction of a yeast cell from X-ray diffraction data
    Thibault, Pierre
    Elser, Veit
    Jacobsen, Chris
    Shapiro, David
    Sayre, David
    ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2006, 62 : 248 - 261
  • [28] Recover the phases from intensity data of x-ray diffraction
    Xu, G
    APPLIED PHYSICS LETTERS, 1998, 73 (07) : 909 - 911
  • [29] FOURIER ANALYSIS OF X-RAY DIFFRACTION DATA FROM LIQUIDS
    PAALMAN, HH
    RINGS, CJ
    REVIEWS OF MODERN PHYSICS, 1963, 35 (02) : 389 - &
  • [30] Wave function for beryllium from x-ray diffraction data
    Jayatilaka, D
    PHYSICAL REVIEW LETTERS, 1998, 80 (04) : 798 - 801