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Complete (1)H resonance assignment of beta-maltose from (1)H-(1)H DQ-SQ CRAMPS and (1)H (DQ-DUMBO)-(13)C SQ refocused INEPT 2D solid-state NMR spectra and first principles GIPAW calculations.
Webber AL, Elena B, Griffin JM, Yates JR, Pham TN, Mauri F, Pickard CJ, Gil AM, Stein R, Lesage A, Emsley L, Brown SP. Webber AL, et al. Among authors: yates jr. Phys Chem Chem Phys. 2010 Jul 14;12(26):6970-83. doi: 10.1039/c001290d. Epub 2010 May 18. Phys Chem Chem Phys. 2010. PMID: 20480118
Towards homonuclear J solid-state NMR correlation experiments for half-integer quadrupolar nuclei: experimental and simulated 11B MAS spin-echo dephasing and calculated 2J(BB) coupling constants for lithium diborate.
Barrow NS, Yates JR, Feller SA, Holland D, Ashbrook SE, Hodgkinson P, Brown SP. Barrow NS, et al. Among authors: yates jr. Phys Chem Chem Phys. 2011 Apr 7;13(13):5778-89. doi: 10.1039/c0cp02343d. Epub 2011 Feb 14. Phys Chem Chem Phys. 2011. PMID: 21321719 Free article.
Weak Intermolecular CH···N Hydrogen Bonding: Determination of 13CH-15N Hydrogen-Bond Mediated J Couplings by Solid-State NMR Spectroscopy and First-Principles Calculations.
Webber AL, Yates JR, Zilka M, Sturniolo S, Uldry AC, Corlett EK, Pickard CJ, Pérez-Torralba M, Angeles Garcia M, Santa Maria D, Claramunt RM, Brown SP. Webber AL, et al. Among authors: yates jr. J Phys Chem A. 2020 Jan 23;124(3):560-572. doi: 10.1021/acs.jpca.9b10726. Epub 2020 Jan 9. J Phys Chem A. 2020. PMID: 31880451 Free article.
1,437 results