Rapid acquisition of data dense solid-state CPMG NMR spectral sets using multi-dimensional statistical analysis

Mason, H. E.; Uribe, E. C.; Shusterman, J. A.

doi:10.1039/C8CP02382D

Title: Rapid acquisition of data dense solid-state CPMG NMR spectral sets using multi-dimensional statistical analysis

Journal Article · Wed Jun 20 00:00:00 EDT 2018 · Physical Chemistry Chemical Physics. PCCP (Print)

DOI:https://doi.org/10.1039/C8CP02382D· OSTI ID:1463021

^[1]; Uribe, E. C. ^[2]; Shusterman, J. A. ^[3]

Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)
Sandia National Lab. (SNL-CA), Livermore, CA (United States)
Hunter College of City Univ. of New York, New York, NY (United States)

Tensor-rank decomposition methods have been applied to variable contact time²⁹Si{¹H} CP/CPMG NMR data sets to extract NMR dynamics information and dramatically decrease conventional NMR acquisition times.

View Accepted Manuscript (DOE)

Cite

Export

Save

Research Organization:: Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States); Sandia National Lab. (SNL-CA), Livermore, CA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Biological and Environmental Research (BER)

Grant/Contract Number:: AC52-07NA27344; AC04-94AL85000

OSTI ID:: 1463021

Alternate ID(s):: OSTI ID: 1456294; OSTI ID: 1464198

Report Number(s):: LLNL-JRNL-736456; SAND-2018-8223J; PPCPFQ; 888524

Journal Information:: Physical Chemistry Chemical Physics. PCCP (Print), Vol. 20, Issue 26; ISSN 1463-9076

Publisher:: Royal Society of ChemistryCopyright Statement

Country of Publication:: United States

Language:: English

Citation Metrics:

Cited by: 3 works

Citation information provided by
Web of Science

References (29)

Spatial distribution of organic functional groups supported on mesoporous silica nanoparticles: a study by conventional and DNP-enhanced ²⁹ Si solid-state NMR Kobayashi, Takeshi; Singappuli-Arachchige, Dilini; Wang, Zhuoran Physical Chemistry Chemical Physics, Vol. 19, Issue 3 https://doi.org/10.1039/C6CP07642D	journal	January 2017
Probing the interaction of U( vi ) with phosphonate-functionalized mesoporous silica using solid-state NMR spectroscopy Uribe, Eva C.; Mason, Harris E.; Shusterman, Jennifer A. Dalton Transactions, Vol. 45, Issue 25 https://doi.org/10.1039/C6DT01200K	journal	January 2016
Solid-state NMR spectroscopy of Pb-rich apatite Mason, Harris E.; Hirner, Joshua J.; Xu, Wenqian Magnetic Resonance in Chemistry, Vol. 47, Issue 12 https://doi.org/10.1002/mrc.2514	journal	December 2009
Development and Testing of Diglycolamide Functionalized Mesoporous Silica for Sorption of Trivalent Actinides and Lanthanides Shusterman, Jennifer A.; Mason, Harris E.; Bowers, Jon ACS Applied Materials & Interfaces, Vol. 7, Issue 37 https://doi.org/10.1021/acsami.5b04481	journal	September 2015
¹¹⁹ Sn MAS NMR Study of the Interaction of Probe Molecules with Sn-BEA: The Origin of Penta- and Hexacoordinated Tin Formation Yakimov, Alexander V.; Kolyagin, Yury G.; Tolborg, Søren The Journal of Physical Chemistry C, Vol. 120, Issue 49 https://doi.org/10.1021/acs.jpcc.6b09999	journal	December 2016
Unmixing the NMR spectra of similar species – vive la différence Colbourne, Adam A.; Meier, Sebastian; Morris, Gareth A. Chemical Communications, Vol. 49, Issue 89 https://doi.org/10.1039/c3cc46228e	journal	January 2013
Synthesis and characterization of polymeric C18 stationary phases for liquid chromatography Sander, Lane C.; Wise, Stephen A. Analytical Chemistry, Vol. 56, Issue 3 https://doi.org/10.1021/ac00267a047	journal	March 1984
Site-resolved 2H relaxation experiments in solid materials by global line-shape analysis of MAS NMR spectra Lindh, E. L.; Stilbs, P.; Furó, I. Journal of Magnetic Resonance, Vol. 268 https://doi.org/10.1016/j.jmr.2016.04.014	journal	July 2016
Dynamic Nuclear Polarization Surface Enhanced NMR Spectroscopy Rossini, Aaron J.; Zagdoun, Alexandre; Lelli, Moreno Accounts of Chemical Research, Vol. 46, Issue 9 https://doi.org/10.1021/ar300322x	journal	March 2013
Global least‐squares analysis of large, correlated spectral data sets and application to chemical kinetics and time‐resolved fluorescence Stilbs, Peter; Paulsen, Kim Review of Scientific Instruments, Vol. 67, Issue 12 https://doi.org/10.1063/1.1147539	journal	December 1996
One hundred fold overall sensitivity enhancements for Silicon-29 NMR spectroscopy of surfaces by dynamic nuclear polarization with CPMG acquisition Rossini, Aaron J.; Zagdoun, Alexandre; Lelli, Moreno Chem. Sci., Vol. 3, Issue 1 https://doi.org/10.1039/C1SC00550B	journal	January 2012
Natural Abundance ¹⁷ O DNP Two-Dimensional and Surface-Enhanced NMR Spectroscopy Perras, Frédéric A.; Kobayashi, Takeshi; Pruski, Marek Journal of the American Chemical Society, Vol. 137, Issue 26 https://doi.org/10.1021/jacs.5b03905	journal	June 2015
29Si and 17O (Q)CPMG-MAS solid-state NMR experiments as an optimum approach for half-integer nuclei having long T1 relaxation times Larsen, Flemming H.; Farnan, Ian Chemical Physics Letters, Vol. 357, Issue 5-6 https://doi.org/10.1016/S0009-2614(02)00520-1	journal	May 2002
Probing the Surface Structure of Divalent Transition Metals Using Surface Specific Solid-State NMR Spectroscopy Mason, Harris E.; Harley, Stephen J.; Maxwell, Robert S. Environmental Science & Technology, Vol. 46, Issue 5 https://doi.org/10.1021/es203733c	journal	February 2012
Kinetics of Cross-Polarization in Solid-State NMR: A Guide for Chemists Kolodziejski, Waclaw; Klinowski, Jacek Chemical Reviews, Vol. 102, Issue 3 https://doi.org/10.1021/cr000060n	journal	March 2002
Synthesis of ordered large pore SBA-15 spherical particles for adsorption of biomolecules Katiyar, Amit; Yadav, Santosh; Smirniotis, Panagiotis G. Journal of Chromatography A, Vol. 1122, Issue 1-2 https://doi.org/10.1016/j.chroma.2006.04.055	journal	July 2006
Application of ¹¹⁹ Sn CPMG MAS NMR for Fast Characterization of Sn Sites in Zeolites with Natural ¹¹⁹ Sn Isotope Abundance Kolyagin, Yury G.; Yakimov, Alexander V.; Tolborg, Søren The Journal of Physical Chemistry Letters, Vol. 7, Issue 7 https://doi.org/10.1021/acs.jpclett.6b00249	journal	March 2016
Direct dynamic nuclear polarization targeting catalytically active ²⁷ Al sites Lund, Alicia; Hsieh, Ming-Feng; Siaw, Ting-Ann Physical Chemistry Chemical Physics, Vol. 17, Issue 38 https://doi.org/10.1039/C5CP03396A	journal	January 2015
Analysis of trivalent cation complexation to functionalized mesoporous silica using solid-state NMR spectroscopy Shusterman, Jennifer; Mason, Harris; Bruchet, Anthony Dalton Trans., Vol. 43, Issue 44 https://doi.org/10.1039/C4DT02380C	journal	January 2014
Communication: Phase incremented echo train acquisition in NMR spectroscopy Baltisberger, Jay H.; Walder, Brennan J.; Keeler, Eric G. The Journal of Chemical Physics, Vol. 136, Issue 21 https://doi.org/10.1063/1.4728105	journal	June 2012
Mesoporous Silica Nanoparticles Loaded with Surfactant: Low Temperature Magic Angle Spinning ¹³ C and ²⁹ Si NMR Enhanced by Dynamic Nuclear Polarization Lafon, Olivier; Thankamony, Aany S. Lilly; Kobayashi, Takeshi The Journal of Physical Chemistry C, Vol. 117, Issue 3 https://doi.org/10.1021/jp310109s	journal	January 2013
Organic layer formation and sorption of U( vi ) on acetamide diethylphosphonate-functionalized mesoporous silica Uribe, Eva C.; Mason, Harris E.; Shusterman, Jennifer A. Dalton Transactions, Vol. 46, Issue 16 https://doi.org/10.1039/C7DT00362E	journal	January 2017
Sensitivity-Enhanced Quadrupolar-Echo NMR of Half-Integer Quadrupolar Nuclei. Magnitudes and Relative Orientation of Chemical Shielding and Quadrupolar Coupling Tensors Larsen, Flemming H.; Jakobsen, Hans J.; Ellis, Paul D. The Journal of Physical Chemistry A, Vol. 101, Issue 46 https://doi.org/10.1021/jp971547b	journal	November 1997
Analysis of sensitivity enhancement by dynamic nuclear polarization in solid-state NMR: a case study of functionalized mesoporous materials Kobayashi, Takeshi; Lafon, Olivier; Lilly Thankamony, Aany S. Physical Chemistry Chemical Physics, Vol. 15, Issue 15 https://doi.org/10.1039/c3cp00039g	journal	January 2013
Surface-selective direct ¹⁷ O DNP NMR of CeO ₂ nanoparticles Hope, Michael A.; Halat, David M.; Magusin, Pieter C. M. M. Chemical Communications, Vol. 53, Issue 13 https://doi.org/10.1039/C6CC10145C	journal	January 2017
Constraints on aluminum and scandium substitution mechanisms in forsterite, periclase, and larnite: High-resolution NMR McCarty, Ryan J.; Stebbins, Jonathan F. American Mineralogist, Vol. 102, Issue 6 https://doi.org/10.2138/am-2017-5976	journal	June 2017
Spectral deconvolution of NMR cross polarization data sets Hedin, Niklas; Ng, Jovice B. S.; Stilbs, Peter Solid State Nuclear Magnetic Resonance, Vol. 35, Issue 4 https://doi.org/10.1016/j.ssnmr.2009.04.001	journal	July 2009
Speedy Component Resolution: An Improved Tool for Processing Diffusion-Ordered Spectroscopy Data Nilsson, Mathias; Morris, Gareth A. Analytical Chemistry, Vol. 80, Issue 10 https://doi.org/10.1021/ac7025833	journal	May 2008
29Si NMR in solid state with CPMG acquisition under MAS Wiench, J. W.; Lin, V. S. -Y.; Pruski, M. Journal of Magnetic Resonance, Vol. 193, Issue 2 https://doi.org/10.1016/j.jmr.2008.05.007	journal	August 2008