NMR@CEMHTI

Recent NMR papers from ACS, RSC, Wiley, Nature, Elsevier, Chemrxiv, Arxiv...

this list is updated daily from the rss feeds of the editors - the selection is made on NMR related key words... that could be enhanced ;-)
implemented from PaperBots by FX Coudert - many thanks
updated 2021-10-24 06:00:04

Labile photo‐induced free radical in alpha‐ketoglutaric acid: a universal endogenous polarizing agent for in vivo hyperpolarized 13C magnetic resonance

Adam P. Gaunt, Jennifer S. Lewis, Friederike Hesse, Tian Cheng, Irene Marco-Rius, Kevin M. Brindle, Arnaud Comment
link... found in rss feed
2021-10-22 10:54:47

Experimental and Theoretical Solid-State 29Si NMR Studies on Defect Structures in La9.33+x(SiO4)6O2+1.5x Apatite Oxide Ion Conductors

Wenhao Liu, Shipeng Geng, Wenda Zhang, Fuhui Liao, Mingxue Tang, Hui Fu, and Xiaojun Kuang
Inorganic Chemistry link... found in rss feed
2021-10-22 04:00:00

Residue-resolved monitoring of protein hyperpolarization at sub-second time resolution

Mattia Negroni,Dennis Kurzbach
None link... found in rss feed
2021-10-22 00:00:00

Gold(I) 1,2,3-Triazolylidene Complex Featuring the Interaction Between Gold and Methine Hydrogen

Adi Narayana Mannem,Moulali Vaddamanu,Arruri Sathyanarayana,Kumar Siddhant,Shohei Sugiyama,Kazuhisa Ozaki,Aravind Kumar Rengan,Kavitha Velappan,Kyohei Hisano,Osamu Tsutsumi,Prabusankar Ganesan
Dalton Transaction link... found in rss feed
2021-10-22 00:00:00

Na3V2(PO4)3 Revisited: A High-Resolution Solid-State NMR Study

Yuxin Liao, Chao Li, Fushan Geng, Ming Shen, and Bingwen Hu
Journal of Physical Chemistry C link... found in rss feed
2021-10-21 04:00:00

Improved Description of Organic Matter in Shales by Enhanced Solid Fraction Detection with Low-Field 1H NMR Relaxometry

F. Panattoni, A. A. Colbourne, E. J. Fordham, J. Mitchell, C. P. Grey, and P. C. M. M. Magusin
acs.energyfuels link... found in rss feed
2021-10-21 04:00:00

Direct Experimental Characterization of a Bridged Bicyclic Glycosyl Dioxacarbenium Ion by 1H and 13C NMR Spectroscopy: Importance of Conformation on Participation by Distal Esters

Kapil Upadhyaya, Yagya P. Subedi, David Crich
link... found in rss feed
2021-10-21 00:07:15

Charge Neutral Halogen Bonding Tetradentate-Iodotriazole Macrocycles Capable of Anion Recognition and Sensing in Highly Competitive Aqueous Media

Thanthapatra Bunchuay,Kajjana Boonpalit,Andrew Docker,Araya Ruengsuk,Jonggol Tantirungrotechai,Mongkol Sukwattanasinitt,Panida Surawatanawong,Paul D. Beer
Chemical Communication link... found in rss feed
2021-10-21 00:00:00

Optical-Frequency Magnetic Polarizability in a Layered Semiconductor

Ryan A. DeCrescent, Rhys M. Kennard, Michael L. Chabinyc, and Jon A. Schuller
PhysRevLett.127.173604 link... found in rss feed
2021-10-20 10:00:00

Optical-Frequency Magnetic Polarizability in a Layered Semiconductor

Ryan A. DeCrescent, Rhys M. Kennard, Michael L. Chabinyc, and Jon A. Schuller
PhysRevLett.127.173604 link... found in rss feed
2021-10-20 10:00:00

One-Dimensional Conjugated Carbon Nitrides: Synthesis and Structure Determination by HRTEM and Solid-State NMR

Fangyan Liu, Yan Tong, Caifu Li, and Xiaolong Liu
Journal of Physical Chemistry Letters link... found in rss feed
2021-10-20 04:00:00

Colorless Chemical Substance Detection in the Degradation of Tetracycline Based on Operando 1H Nuclear Magnetic Resonance Spectroscopy

Da-Xiu Wei, Jingxian Dong, Bei-Bei Xu, Xiaomeng You, Guoliang Gao, Jia-Xiang Xin, Jie Ci, Xue Lu Wang, and Ye-Feng Yao
Journal of Physical Chemistry C link... found in rss feed
2021-10-20 04:00:00

Facet controlled anisotropic magnons in Y3Fe5O12 thin films

Rohit Medwal,Angshuman Deka,Joseph Vimal Vas,Martial Duchamp,Hironori Asada,Surbhi Gupta,Yasuhiro Fukuma,Rajdeep Singh Rawat
link... found in rss feed
2021-10-19 11:19:23

High-speed NMR imaging of capillary action in thin nontransparent porous media

R. Nicasy, H. P. Huinink, S. J. F. Erich, and O. C. G. Adan
PhysRevE.104.L043101 link... found in rss feed
2021-10-19 10:00:00

Side‐Chain Interactions in d/l Peptide Nanotubes: Studies by Crystallography, NMR Spectroscopy and Molecular Dynamics

Mitchell R. Silk, Jason R. Price, Biswaranjan Mohanty, Hanna‐Kirsti S. Leiros, Bjarte A. Lund, Philip E. Thompson, David K. Chalmers
link... found in rss feed
2021-10-19 07:56:35

Suppressing Singlet Oxygen Formation during the Charge Process of Li-O2 Batteries with a Co3O4 Solid Catalyst Revealed by Operando Electron Paramagnetic Resonance

Yang Lin, Qi Yang, Fushan Geng, Hui Feng, Mengdi Chen, and Bingwen Hu
Journal of Physical Chemistry Letters link... found in rss feed
2021-10-19 04:00:00

Lipid Nanodiscs for High-Resolution NMR Studies of Membrane Proteins

Umut Günsel and Franz Hagn
Chemical Review link... found in rss feed
2021-10-19 04:00:00

Polymorphs of Rb3ScF6: X-ray and neutron diffraction, solid-state NMR, and DFT calculations study

A.Rakhmatullin, M.S.Molokeev, G.King, I.B.Polovov, K.V.Maksimtsev, E.Chesneau, E.Suard, R.Bakirov, F.Šimko, C.Bessada, M.Allix
Polymorphs of Rb3ScF6: X-ray and neutron diffraction, solid-state NMR, and DFT calculations study
Inorganic Chemistry 60 6016–6026 2021doi:10.1021/acs.inorgchem.1c00485

link... found in rss feed
2021-10-18 12:14:02

Pairing interaction in superconducting UCoGe tunable by magnetic field

K. Ishida, S. Matsuzaki, M. Manago, T. Hattori, S. Kitagawa, M. Hirata, T. Sasaki, and D. Aoki
PhysRevB.104.144505 link... found in rss feed
2021-10-18 10:00:00

Pairing interaction in superconducting UCoGe tunable by magnetic field

K. Ishida, S. Matsuzaki, M. Manago, T. Hattori, S. Kitagawa, M. Hirata, T. Sasaki, and D. Aoki
PhysRevB.104.144505 link... found in rss feed
2021-10-18 10:00:00

Unambiguous Tracking of Protein Phosphorylation by Fast High‐Resolution FOSY NMR**

Dmitry M. Lesovoy, Panagiota S. Georgoulia, Tammo Diercks, Irena Matečko‐Burmann, Björn M. Burmann, Eduard V. Bocharov, Wolfgang Bermel, Vladislav Y. Orekhov
link... found in rss feed
2021-10-18 00:00:00

Unraveling Hydrocarbon Pool Boosted Propane Aromatization on Gallium/ZSM‐5 Zeolite by Solid‐State Nuclear Magnetic Resonance Spectroscopy

Chao Wang, Xingling Zhao, Min Hu, Guodong Qi, Qiang Wang, Shenhui Li, Jun Xu, Feng Deng
link... found in rss feed
2021-10-18 00:00:00

Inside Cover: Unambiguous Tracking of Protein Phosphorylation by Fast High‐Resolution FOSY NMR (Angew. Chem. Int. Ed. 44/2021)

Dmitry M. Lesovoy, Panagiota S. Georgoulia, Tammo Diercks, Irena Matečko‐Burmann, Björn M. Burmann, Eduard V. Bocharov, Wolfgang Bermel, Vladislav Y. Orekhov
link... found in rss feed
2021-10-18 00:00:00

Mapping of N−C Bond Formation from a Series of Crystalline Peri‐Substituted Naphthalenes by Charge Density and Solid‐State NMR Methodologies

Gregory J. Rees, Mateusz B. Pitak, Alberth Lari, Stephen P. Day, Jonathan R. Yates, Peter Gierth, Kristian Barnsley, Mark E. Smith, Simon J. Coles, John V. Hanna, John D. Wallis
link... found in rss feed
2021-10-18 00:00:00

Identification of RNA Base Pairs and Complete Assignment of Nucleobase Resonances by Proton‐Detected Solid‐State NMR Spectroscopy at 100 kHz MAS

Philipp Innig Aguion, John Kirkpatrick, Teresa Carlomagno, Alexander Marchanka
link... found in rss feed
2021-10-18 00:00:00

Do Double-Hybrid Exchange–Correlation Functionals Provide Accurate Chemical Shifts? A Benchmark Assessment for Proton NMR

Marcelo T. de Oliveira, Júlia M. A. Alves, Ataualpa A. C. Braga, David J. D. Wilson, and Cristina A. Barboza
acs.jctc link... found in rss feed
2021-10-12 04:00:00

Measuring the bending modulus of lipid bilayers with cholesterol

John F. Nagle
PhysRevE.104.044405 link... found in rss feed
2021-10-08 10:00:00

Controlled Morphology Synthesis of Nanostructured β-AlF3–x(OH)x with Tunable Specific Surface Area

Valentine Camus-Génot, Amandine Guiet, Jérôme Lhoste, Franck Fayon, Monique Body, Stéphanie Kodjikian, Romain Moury, Marc Leblanc, Jean Louis Bobet, Christophe Legein, Vincent Maisonneuve
Controlled Morphology Synthesis of Nanostructured β-AlF3–x(OH)x with Tunable Specific Surface Area
Crystal Growth & Design 21 5914-5927 2021doi:10.1021/acs.cgd.1c00808
link... found in rss feed
2021-10-07 11:07:16

Atomic-Scale Structure and Its Impact on Chemical Properties of Aluminum Oxide Layers Prepared by Atomic Layer Deposition on Silica

Monu Kaushik, César Leroy, Zixuan Chen, David Gajan, Elena Willinger, Christoph R.Müller, Franck Fayon, Dominique Massiot, Alexey Fedorov, Christophe Copéret, Anne Lesage, Pierre Florian
Atomic-Scale Structure and Its Impact on Chemical Properties of Aluminum Oxide Layers Prepared by Atomic Layer Deposition on Silica
Chemistry of Materials 33 3335–334 2021doi:10.1021/acs.chemmater.1c00516

link... found in rss feed
2021-10-05 10:20:35

Adaptive Cylindrical Wireless Metasurfaces in Clinical Magnetic Resonance Imaging

Zhonghai Chi, Yi Yi, Yakui Wang, Maopeng Wu, Lixue Wang, Xihai Zhao, Yonggang Meng, Zhuozhao Zheng, Qian Zhao, Ji Zhou
link... found in rss feed
2021-10-05 06:05:58

19F Solid‐State NMR and Vibrational Raman Characterization of Corticosteroid Drug‐Lipid Membrane Interactions

Bethany Mapley, David Townsend, John Griffin, Lorna Ashton, David A. Middleton
link... found in rss feed
2021-10-05 02:51:00

Structural Elucidation, Aggregation and Dynamic Behaviour of N,N,N,N‐Copper(I) Schiff Base Complexes in Solid and in Solution: a Combined NMR, X‐ray Spectroscopic and Crystallographic Investigation

Isabelle Gerz, Sergio Augusto Venturinelli Jannuzzi, Knut T. Hylland, Chiara Negri, David S. Wragg, Sigurd Øien-Ødegaard, Mats Tilset, Unni Olsbye, Serena DeBeer, Mohamed Amedjkouh
link... found in rss feed
2021-10-04 00:00:00

Ultrahigh-Resolution Magnetic Resonance Mass Spectrometry Characterization of Asphaltenes Obtained in the Presence of Minerals

Estrella Rogel, Kyle Hench, and Matthias Witt
acs.energyfuels link... found in rss feed
2021-10-01 04:00:00

Interactions between PAMAM−NH2 and 6‐Mercaptopurine: Qualitative and Quantitative NMR studies

Xueke Gao, Minjun Ma, Christian Marcus Pedersen, Rui Liu, Zhenzhou Zhang, Honghong Chang, Yan Qiao, Yingxiong Wang
link... found in rss feed
2021-09-30 04:13:31

Isobutane Transformation to Aromatics on Zn‐Modified Zeolites: Intermediates and the Effect of Zn2+ and ZnO Species on the Reaction Occurrence Revealed by 13C MAS NMR

Anton A. Gabrienko, Zoya N. Lashchinskaya, Sergei S. Arzumanov, Alexander V. Toktarev, Dieter Freude, Jürgen Haase, Alexander G. Stepanov
link... found in rss feed
2021-09-27 05:59:57

Refining crystal structures using 13C NMR chemical shift tensors as a target function

Luther Wang,James K. Harper
None link... found in rss feed
2021-09-24 00:00:00

Preface to the virtual special issue on advanced NMR on glasses

G.Tricot, F.Fayon, T.Charpentier
Preface to the virtual special issue on advanced NMR on glasses
Journal of Non Crystalline Solids 572 121095 2021doi:10.1016/j.jnoncrysol.2021.121095
link... found in rss feed
2021-09-23 10:32:10

Investigation of CO2 Orientational Dynamics through Simulated NMR Line Shapes

Patrick Melix, Thomas Heine
link... found in rss feed
2021-09-23 00:46:55

Pore-Size Measurement from Eigenvalues of Magnetic Resonance Relaxation

Armin Afrough, Florea Marica, Bryce MacMillan, and Bruce J. Balcom
PhysRevApplied.16.034040 link... found in rss feed
2021-09-22 10:00:00

A New Metric for Evaluating DFT Calculated Proton and Carbon Chemical Shifts of Natural Products and Organic Compounds

Gregory K. Pierens
link... found in rss feed
2021-09-21 05:42:40

A multifunctional targeted nanoprobe with high NIR-II PAI/MRI performance for precise theranostics of orthotopic early-stage hepatocellular carcinoma

Linyun He,Yachao Zhang,Jiangbo Chen,Gongyuan Liu,Jingyi Zhu,Xiaozhen Li,Dengfeng Li,Yuqi Yang,Chun-Sing Lee,Jiahai Shi,Chao Yin,Puxiang Lai,Lidai Wang,Chihua Fang
None link... found in rss feed
2021-09-18 00:00:00

Two-bond 13C–13C spin-coupling constants in saccharides: dependencies on exocyclic hydroxyl group conformation

Jieye Lin,Reagan J. Meredith,Allen G. Oliver,Ian Carmichael,Anthony S. Serianni
None link... found in rss feed
2021-09-14 00:00:00

Network structure of swollen iodine-doped poly(vinyl alcohol) amorphous domain as characterized by low field NMR

Yahui Li,Junsheng Yang,Hong Cheng,Linkun Cai,Ke Ye,Zhijie Xia,Qianlei Zhang,Daoliang Wang,Wei Chen
None link... found in rss feed
2021-09-09 00:00:00

Glass structure of industrial ground granulated blast furnace slags (GGBS) investigated by time-resolved Raman and NMR spectroscopies

Simon Blotevogel, Valérie Montouillout, Aurélien Canizares, Patrick Simon, Erwan Chesneau, Abel Danezan, Thomas Wattez, Andreas Ehrenberg, Mathilde Poirier, Cédric Patapy, Martin Cyr
Glass structure of industrial ground granulated blast furnace slags (GGBS) investigated by time-resolved Raman and NMR spectroscopies
Journal of Materials Science in pressdoi:10.1007/s10853-021-06446-4
link... found in rss feed
2021-09-08 11:27:45

Intrinsic anisotropy parameters of a series of lanthanoid complexes deliver new insights into the structure-magnetism relationship

Raphael Vogel, Thomas Müntener, Daniel Häussinger
link... found in rss feed
2021-09-08 00:00:00

Taming the dynamics in a pharmaceutical by cocrystallization: investigating the impact of the coformer by solid-state NMR

Patrick M. J. Szell,Józef R. Lewandowski,Helen Blade,Leslie P. Hughes,Sten O. Nilsson Lill,Steven P. Brown
None link... found in rss feed
2021-09-02 00:00:00

Letter to the Editor on the paper by Diop and collaborators

Dominique Massiot, Catherine Bessada
Letter to the Editor on the paper by Diop and collaborators
Metallurgical and Materials Transactions B submitted 2021doi:https://hal.archives-ouvertes.fr/hal-03294824

link... found in rss feed
2021-08-26 10:50:42

Complementary Nuclear Magnetic Resonance-Based Metabolomics Approaches for Glioma Biomarker Identification in a Drosophila melanogaster Model

Marion Maravat, Marylène Bertrand, Céline Landon, Franck Fayon, Séverine Morisset-Lopez, Vincent Sarou-Kanian, Martine Decoville
Complementary Nuclear Magnetic Resonance-Based Metabolomics Approaches for Glioma Biomarker Identification in a Drosophila melanogaster Model
Journal of Proteome Research 20 3977–3991 2021doi:10.1021/acs.jproteome.1c00304

link... found in rss feed
2021-08-26 10:25:52

Emerging heterogeneous catalysts for biomass conversion: studies of the reaction mechanism

Longfei Lin,Xue Han,Buxing Han,Sihai Yang
Chemical Society Review link... found in rss feed
2021-08-18 00:00:00

Atomic structure of light-induced efficiency-degrading defects in boron-doped Czochralski silicon solar cells

Abigail R. Meyer,P. Craig Taylor,Michael B. Venuti,Serena Eley,Vincenzo LaSalvia,William Nemeth,Matthew R. Page,David L. Young,Paul Stradins,Sumit Agarwal
None link... found in rss feed
2021-08-13 00:00:00

Influence of functionalization method on isomorphic substitution and formation of extra-framework oxides in silica for water vapor adsorption

link... found in rss feed
2021-08-09 00:00:00

Solid-State NMR Spectroscopy: A Key Tool to Unravel the Supramolecular Structure of Drug Delivery Systems

Marianna Porcino, Xue Li, Ruxandra Gref, Charlotte Martineau-Corcos
Solid-State NMR Spectroscopy: A Key Tool to Unravel the Supramolecular Structure of Drug Delivery Systems
Molecules 26 2021doi:10.3390/molecules26144142

link... found in rss feed
2021-08-06 12:50:30

Iterative baseline correction algorithm for dead time truncated one-dimensional solid-state MAS NMR spectra

Maxime Yon, Franck Fayon, Dominique Massiot, Vincent Sarou-Kanian
Iterative baseline correction algorithm for dead time truncated one-dimensional solid-state MAS NMR spectra
Solid State NMR 110 101699 2020doi:10.1016/j.ssnmr.2020.101699

link... found in rss feed
2021-07-09 13:05:23

Sodium Site Exchange and Migration in a Polar Stuffed-Cristobalite Framework Structure

Alberto J.Fernández-Carrión, Aydar Rakhmatullin, Li Yang, Michael J.Pitcher, Dominique Massiot, Florence Porcher, Mathieu Allix, Xiaojun Kuang
Sodium Site Exchange and Migration in a Polar Stuffed-Cristobalite Framework Structure
Inorganic Chemistry 60 4322–4331 2021doi:10.1021/acs.inorgchem.1c00319

link... found in rss feed
2021-07-09 13:03:38

Core Scientific Dataset Model: A lightweight and portable model and file format for multi-dimensional scientific data

Deepansh J.Srivastava, Thomas Vosegaard, Dominique Massiot, Philip J.Grandinetti
Core Scientific Dataset Model: A lightweight and portable model and file format for multi-dimensional scientific data
Plos One 15 e0225953 2020doi:10.1371/journal.pone.0225953

link... found in rss feed
2021-07-09 12:46:43

In situ NMR Techniques for Li-ion Batteries

M.Tang, M.Deschamps
In situ NMR Techniques for Li-ion Batteries
NMR and MRI of Electrochemical Energy Storage Materials and Devices 16 483-512 2021doi:
link... found in rss feed
2021-07-06 15:16:43

Probing 29Si-17O connectivities and proximities by solid-state NMR

Frédérique Pourpoint, Florian Venel, Raynald Giovine, Julien Trébosc, Tom Vancompernolle, Mostafa Taoufik, Vincent Sarou-Kanian, Régis M.Gauvin, Olivier Lafon
Probing 29Si-17O connectivities and proximities by solid-state NMR
Journal of Magnetic Resonance 107029 2021doi:10.1016/j.jmr.2021.107029
link... found in rss feed
2021-07-03 10:44:51

Local atomic and electronic structure in the LiVPO4(F,O) Tavorite-type materials from Solid State NMR combined with DFT calculations

T.Bamine, E.Boivin, C.Masquelier, L.Croguennec, E.Salager, D.Carlier
Local atomic and electronic structure in the LiVPO4(F,O) Tavorite-type materials from Solid State NMR combined with DFT calculations
Magnetic Resonance in Chemistry 58 1109-1117 2020doi:10.1002/mrc.5059
link... found in rss feed
2021-07-01 12:26:45

Monitoring metallic sub-micrometric lithium structures in Li-ion batteries by in situ electron paramagnetic resonance correlated spectroscopy and imaging

Charles-Emmanuel Dutoit*, Mingxue Tang, Didier Gourier, Jean-Marie Tarascon, Hervé Vezin*, Elodie Salager
Monitoring metallic sub-micrometric lithium structures in Li-ion batteries by in situ electron paramagnetic resonance correlated spectroscopy and imaging
Nature Communications 12 1410 2021doi:10.1038/s41467-021-21598-2

link... found in rss feed
2021-06-30 23:15:57

$^1$H singlet relaxation time prediction via intermolecular dipolar coupling using the molecular dynamics method. (arXiv:2110.10488v1 [physics.chem-ph])

Koichiro Miyanishi, Wataru Mizukami, Makoto Motoyama, Naoki Ichijo, Akinori Kagawa, Makoto Negoro, Masahiro Kitagawa
link... found in rss feed
1900-01-01 00:00:00

Manifestations of Spinodal Decomposition into Dilute Pd$_{1-x}$Fe$_{x}$ "Phases" in Iron-Implanted Palladium Films: FMR Study. (arXiv:2110.10397v1 [cond-mat.mtrl-sci])

A.I. Gumarov (1 and 2), I.V. Yanilkin (1), A.A. Rodionov (1), B.F. Gabbasov (1), R.V. Yusupov (1), M.N. Aliyev (3), R.I. Khaibullin (2), L.R. Tagirov (2 and 4) ((1) Institute of Physics, Kazan Federal University, (2) Zavoisky Physical-Technical Institute, FRC Kazan Scientific Centre of RAS, (3) Baku State University, (4) Tatarstan Academy of Sciences, Institute of Applied Research)
link... found in rss feed
1900-01-01 00:00:00

Manifestations of Spinodal Decomposition into Dilute Pd$_{1-x}$Fe$_{x}$ "Phases" in Iron-Implanted Palladium Films: FMR Study. (arXiv:2110.10397v1 [cond-mat.mtrl-sci])

A.I. Gumarov (1 and 2), I.V. Yanilkin (1), A.A. Rodionov (1), B.F. Gabbasov (1), R.V. Yusupov (1), M.N. Aliyev (3), R.I. Khaibullin (2), L.R. Tagirov (2 and 4) ((1) Institute of Physics, Kazan Federal University, (2) Zavoisky Physical-Technical Institute, FRC Kazan Scientific Centre of RAS, (3) Baku State University, (4) Tatarstan Academy of Sciences, Institute of Applied Research)
link... found in rss feed
1900-01-01 00:00:00

Dynamics of the multiferroic LiCuVO4 influenced by electric field. (arXiv:2110.11095v1 [cond-mat.str-el])

S.K. Gotovko, V.I. Marchenko, A. Prokofiev, L.E. Svistov
link... found in rss feed
1900-01-01 00:00:00