Pickard CJ - Search Results

1

Salager E, Stein RS, Pickard CJ, Elena B, Emsley L. Salager E, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2009 Apr 21;11(15):2610-21. doi: 10.1039/b821018g. Epub 2009 Feb 25. Phys Chem Chem Phys. 2009. PMID: 19421517

2

Assigning carbon-13 NMR spectra to crystal structures by the INADEQUATE pulse sequence and first principles computation: a case study of two forms of testosterone.

Harris RK, Joyce SA, Pickard CJ, Cadars S, Emsley L. Harris RK, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2006 Jan 7;8(1):137-43. doi: 10.1039/b513392k. Epub 2005 Nov 11. Phys Chem Chem Phys. 2006. PMID: 16482253

3

Combined first-principles computational and experimental multinuclear solid-state NMR investigation of amino acids.

Gervais C, Dupree R, Pike KJ, Bonhomme C, Profeta M, Pickard CJ, Mauri F. Gervais C, et al. Among authors: pickard cj. J Phys Chem A. 2005 Aug 11;109(31):6960-9. doi: 10.1021/jp0513925. J Phys Chem A. 2005. PMID: 16834055

4

Assigning powders to crystal structures by high-resolution (1)H-(1)H double quantum and (1)H-(13)C J-INEPT solid-state NMR spectroscopy and first principles computation. A case study of penicillin G.

Mifsud N, Elena B, Pickard CJ, Lesage A, Emsley L. Mifsud N, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2006 Aug 7;8(29):3418-22. doi: 10.1039/b605227d. Epub 2006 Jun 20. Phys Chem Chem Phys. 2006. PMID: 16855720

5

(23)Na multiple-quantum MAS NMR of the perovskites NaNbO(3) and NaTaO(3).

Ashbrook SE, Le Pollès L, Gautier R, Pickard CJ, Walton RI. Ashbrook SE, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2006 Aug 7;8(29):3423-31. doi: 10.1039/b604520k. Epub 2006 Jun 22. Phys Chem Chem Phys. 2006. PMID: 16855721 Free article.

6

NMR crystallography of oxybuprocaine hydrochloride, Modification II degrees.

Harris RK, Cadars S, Emsley L, Yates JR, Pickard CJ, Jetti RK, Griesser UJ. Harris RK, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2007 Jan 21;9(3):360-8. doi: 10.1039/b614318k. Epub 2006 Nov 24. Phys Chem Chem Phys. 2007. PMID: 17199152

7

Resolving structures from powders by NMR crystallography using combined proton spin diffusion and plane wave DFT calculations.

Pickard CJ, Salager E, Pintacuda G, Elena B, Emsley L. Pickard CJ, et al. J Am Chem Soc. 2007 Jul 25;129(29):8932-3. doi: 10.1021/ja071829h. Epub 2007 Jun 28. J Am Chem Soc. 2007. PMID: 17602560 No abstract available.

8

Probing the surface structure of hydroxyapatite using NMR spectroscopy and first principles calculations.

Chappell H, Duer M, Groom N, Pickard C, Bristowe P. Chappell H, et al. Phys Chem Chem Phys. 2008 Jan 28;10(4):600-6. doi: 10.1039/b714512h. Epub 2007 Nov 26. Phys Chem Chem Phys. 2008. PMID: 18183321

9

Structure and NMR assignment in calcined and as-synthesized forms of AlPO-14: a combined study by first-principles calculations and high-resolution 27Al-31P MAS NMR correlation.

Ashbrook SE, Cutajar M, Pickard CJ, Walton RI, Wimperis S. Ashbrook SE, et al. Among authors: pickard cj. Phys Chem Chem Phys. 2008 Oct 1;10(37):5754-64. doi: 10.1039/b805681a. Epub 2008 Jul 30. Phys Chem Chem Phys. 2008. PMID: 18956112

10

Characterizing slight structural disorder in solids by combined solid-state NMR and first principles calculations.

Cadars S, Lesage A, Pickard CJ, Sautet P, Emsley L. Cadars S, et al. Among authors: pickard cj. J Phys Chem A. 2009 Feb 5;113(5):902-11. doi: 10.1021/jp810138y. J Phys Chem A. 2009. PMID: 19133744

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

187 results

Search Page

Filters