Concepedia

NMR crystallography: the use of chemical shifts

Robin K. Harris

Solid State Sciences · 2004 · 216 citations · 28 references

DOIFull text

Open access

Concepts

References

28

First-principles simulation: ideas, illustrations and the CASTEP code

Matthew Segall, Philip J. D. Lindan, Matt Probert et al. · Journal of Physics Condensed Matter · 2002 · 11.8K citations · Full text

, , +11

All-electron magnetic response with pseudopotentials: NMR chemical shifts

Chris J. Pickard, Francesco Mauri · Physical review. B, Condensed matter · 2001 · 1.8K citations · Full text

, , +17

Accurate First Principles Prediction of <sup>17</sup>O NMR Parameters in SiO<sub>2</sub>:  Assignment of the Zeolite Ferrierite Spectrum

Mickaël Profeta, Francesco Mauri, Chris J. Pickard · Journal of the American Chemical Society · 2002 · 422 citations

, , +17

Contemporary Advances in the Use of Powder X-Ray Diffraction for Structure Determination

Kenneth D. M. Harris, M. Tremayne, Benson M. Kariuki · Angewandte Chemie International Edition · 2001 · 365 citations

, , +17

Homonuclear radio frequency-driven recoupling in rotating solids

Andrew E. Bennett, Chad M. Rienstra, Janet M. Griffiths et al. · The Journal of Chemical Physics · 1998 · 358 citations

, , +14