Multi-Length Scale Structure of 2D/3D Dion-Jacobson Hybrid Perovskites Based on an Aromatic Diammonium Spacer

A. Ummadisingu; A. Mishra; D. J. Kubicki; T. LaGrange; A. Ducinskas et al. 

Bayesian probabilistic assignment of chemical shifts in organic solids

M. Cordova; M. Balodis; B. S. de Almeida; M. Ceriotti; L. Emsley 

Endogenous O-17 Dynamic Nuclear Polarization of Gd-Doped CeO2 from 100 to 370 K

M. A. Hope; S. Bjorgvinsdottir; D. M. Halat; G. Menzildjian; Z. Wang et al. 

NMR spectroscopy probes microstructure, dynamics and doping of metal halide perovskites

D. J. Kubicki; S. D. Stranks; C. P. Grey; L. Emsley 

Naphthalenediimide/Formamidinium-Based Low-Dimensional Perovskites

A. Mishra; P. Ahlawat; G. C. Fish; F. Jahanbakhshi; M. Mladenovic et al. 

Pure Isotropic Proton Solid State NMR

P. Moutzouri; B. S. de Almeida; D. Torodii; L. Emsley 

Quantification of magic angle spinning dynamic nuclear polarization NMR spectra

A. Bertarello; P. Berruyer; U. Skantze; S. Sardana; M. Sardana et al. 

Two-step immobilization of metronidazole prodrug on TEMPO cellulose nanofibrils through thiol-yne click chemistry for in situ controlled release

H. Durand; I. Baussanne; M. Demeunynck; J. Viger-Gravel; L. Emsley et al. 

Multimodal host–guest complexation for efficient and stable perovskite photovoltaics

H. Zhang; F. T. Eickemeyer; Z. Zhou; M. Mladenović; F. Jahanbakhshi et al. 

High Sensitivity Detection of a Solubility Limiting Surface Transformation of Drug Particles by DNP SENS

J. Viger-Gravel; A. C. Pinon; S. Bjoergvinsdottir; U. Skantze; A. S. Ankarberg et al. 

Structure determination of an amorphous drug through large-scale NMR predictions

M. Cordova; M. Balodis; A. Hofstetter; F. Paruzzo; S. O. N. Lill et al. 

Decoupling the effects of defects on efficiency and stability through phosphonates in stable halide perovskite solar cells

H. Xie; Z. Wang; Z. Chen; C. Pereyra; M. Pols et al. 

Benzylammonium‐Mediated Formamidinium Lead Iodide Perovskite Phase Stabilization for Photovoltaics

A. Q. Alanazi; M. H. Almalki; A. Mishra; D. J. Kubicki; Z. Wang et al. 

The Atomic-Level Structure of Cementitious Calcium Aluminate Silicate Hydrate Determined by NMR

P. Moutzouri; L. Emsley 

Bulk Hyperpolarization of Inorganic Materials

S. Bjorgvinsdottir; L. Emsley 

Advanced characterization of regioselectively substituted methylcellulose model compounds by DNP enhanced solid-state NMR spectroscopy

P. Berruyer; M. Gericke; P. Moutzouri; D. Jakobi; M. Bardet et al. 

Similarities and Differences among Protein Dynamics Studied by Variable Temperature Nuclear Magnetic Resonance Relaxation

B. Busi; J. R. Yarava; A. Bertarello; F. Freymond; W. Adamski et al. 

Unravelling the Behavior of Dion-Jacobson Layered Hybrid Perovskites in Humid Environments

A. Ducinskas; G. Y. Kim; D. Moia; A. Senocrate; Y-R. Wang et al. 

Iron incorporation in synthetic precipitated calcium silicate hydrates

J. Siramanont; B. J. Walder; L. Emsley; P. Bowen 

Nanoscale Phase Segregation in Supramolecular π-Templating for Hybrid Perovskite Photovoltaics from NMR Crystallography

M. A. Hope; T. Nakamura; P. Ahlawat; A. Mishra; M. Cordova et al. 

Scaling analyses for hyperpolarization transfer across a spin-diffusion barrier and into bulk solid media

N. A. Prisco; A. C. Pinon; L. Emsley; B. F. Chmelka 

A Magic Angle Spinning Activated O-17 DNP Raser

M. A. Hope; S. Bjorgvinsdottir; C. P. Grey; L. Emsley 

MAS NMR Studies of Hierarchical Interplay in Protein Dynamics

Hyperpolarization of inorganic solids

Crown Ether Modulation Enables over 23% Efficient Formamidinium-Based Perovskite Solar Cells

T-S. Su; F. T. Eickemeyer; M. A. Hope; F. Jahanbakhshi; M. Mladenovic et al. 

Multimodal Response to Copper Binding in Superoxide Dismutase Dynamics

M. Bonaccorsi; M. J. Knight; T. Le Marchand; H. R. W. Dannatt; T. Schubeis et al. 

Fast remote correlation experiments for 1H homonuclear decoupling in solids

P. Moutzouri; B. Simões de Almeida; L. Emsley 

Vapor-assisted deposition of highly efficient, stable black-phase FAPbI(3) perovskite solar cells

H. Lu; Y. Liu; P. Ahlawat; A. Mishra; W. R. Tress et al. 

Dynamic Nuclear Polarization Enhancement of 200 at 21.15 T Enabled by 65 kHz Magic Angle Spinning

P. Berruyer; S. Björgvinsdóttir; A. Bertarello; G. Stevanato; Y. Rao et al. 

Cd-113 Solid-State NMR at 21.1 T Reveals the Local Structure and Passivation Mechanism of Cadmium in Hybrid and All-Inorganic Halide Perovskites

D. J. Kubicki; D. Prochowicz; A. Hofstetter; B. J. Walder; L. Emsley 

Sensitivity Enhancements in Lithium Titanates by Incipient Wetness Impregnation DNP NMR

S. Bjorgvinsdottir; P. Moutzouri; P. Berruyer; M. A. Hope; L. Emsley 

Enhanced Intersystem Crossing and Transient Electron Spin Polarization in a Photoexcited Pentacene–Trityl Radical

C. E. Avalos; S. Richert; E. Socie; G. Karthikeyan; G. Casano et al. 

The Atomic-Level Structure of Cementitious Calcium Aluminate Silicate Hydrate

A. K. Mohamed; P. Moutzouri; P. Berruyer; B. J. Walder; J. Siramanont et al. 

Colloidal-ALD-Grown Core/Shell CdSe/CdS Nanoplatelets as Seen by DNP Enhanced PASS-PIETA NMR Spectroscopy

L. Piveteau; D. N. Dirin; C. P. Gordon; B. J. Walder; T-C. Ong et al. 

Local Structure and Dynamics in Methylammonium, Formamidinium, and Cesium Tin(II) Mixed-Halide Perovskites from Sn-119 Solid-State NMR

D. J. Kubicki; D. Prochowicz; E. Salager; A. Rakhmatullin; C. P. Grey et al. 

TinyPols: a family of water-soluble binitroxides tailored for dynamic nuclear polarization enhanced NMR spectroscopy at 18.8 and 21.1 T

A. Lund; G. Casano; G. Menzildjian; M. Kaushik; G. Stevanato et al. 

Structural and DNA binding properties of mycobacterial integration host factor mIHF

N. T. Odermatt; M. Lelli; T. Herrmann; L. A. Abriata; A. Japaridze et al. 

Atomistic origins of the limited phase stability of Cs+-rich FAxCs(1-x)PbI3 mixtures

A. Boziki; D. J. Kubicki; A. Mishra; S. Meloni; L. Emsley et al. 

Homonuclear Decoupling in H-1 NMR of Solids by Remote Correlation

P. Moutzouri; F. M. Paruzzo; B. S. de Almeida; G. Stevanato; L. Emsley 

Cellulose phosphorylation comparison and analysis of phosphorate position on cellulose fibers

F. Rol; C. Sillard; M. Bardet; J. R. Yarava; L. Emsley et al. 

Intermediate Phase Enhances Inorganic Perovskite and Metal Oxide Interface for Efficient Photovoltaics

J. Zhang; Z. Wang; A. Mishra; M. Yu; M. Shasti et al. 

Open and Closed Radicals: Local Geometry around Unpaired Electrons Governs Magic-Angle Spinning Dynamic Nuclear Polarization Performance

G. Stevanato; G. Casano; D. J. Kubicki; Y. Rao; L. Esteban Hofer et al. 

Guanine‐Stabilized Formamidinium Lead Iodide Perovskites

L. Hong; J. V. Milic; P. Ahlawat; M. Mladenovic; D. J. Kubicki et al. 

Topology of Pretreated Wood Fibers Using Dynamic Nuclear Polarization

J. Viger-Gravel; W. Lan; A. C. Pinon; P. Berruyer; L. Emsley et al. 

High-resolution H-1 NMR of powdered solids by homonuclear dipolar decoupling

F. M. Paruzzo; L. Emsley 

Rapid Structure Determination of Molecular Solids Using Chemical Shifts Directed by Unambiguous Prior Constraints

A. Hofstetter; M. Balodis; F. M. Paruzzo; C. M. Widdifield; G. Steyanato et al. 

Ba-induced phase segregation and band gap reduction in mixed-halide inorganic perovskite solar cells

W. Xiang; Z. Wang; D. J. Kubicki; X. Wang; W. Tress et al. 

Atomic-Level Microstructure of Efficient Formamidinium-Based Perovskite Solar Cells Stabilized by 5-Ammonium Valeric Acid Iodide Revealed by Multinuclear and Two-Dimensional Solid-State NMR

A. Q. M. Alanazi; D. J. Kubicki; D. Prochowicz; E. A. R. Alharbi; M. E. F. Bouduban et al. 

Measurement of Proton Spin Diffusivity in Hydrated Cementitious Solids

B. J. Walder; N. A. Prisco; F. M. Paruzzo; J. R. Yarava; B. F. Chmelka et al. 

Line narrowing in H-1 NMR of powdered organic solids with TOP-CT-MAS experiments at ultra-fast MAS

F. M. Paruzzo; B. J. Walder; L. Emsley 

Atomic-level passivation mechanism of ammonium salts enabling highly efficient perovskite solar cells

E. A. Alharbi; A. Y. Alyamani; D. J. Kubicki; A. R. Uhl; B. J. Walder et al. 

Lead-Oxygen Bond Length Distributions of the Relaxor Ferroelectric 0.67PbMg(1/3)Nb(2/3)O(3)-0.33PbTiO(3) from Pb-207 Nuclear Magnetic Resonance

C. E. Avalos; B. J. Walder; L. Emsley 

Dynamic Nuclear Polarization Magic-Angle Spinning Nuclear Magnetic Resonance Combined with Molecular Dynamics Simulations Permits Detection of Order and Disorder in Viral Assemblies

R. Gupta; H. Zhang; M. Lu; G. Hou; M. Caporini et al. 

A Factor Two Improvement in High-Field Dynamic Nuclear Polarization from Gd(III) Complexes by Design

G. Stevanato; D. J. Kubicki; G. Menzildjian; A-S. Chauvin; K. Keller et al. 

F-19 Magic Angle Spinning Dynamic Nuclear Polarization Enhanced NMR Spectroscopy

J. Viger-Gravel; C. E. Avalos; D. J. Kubicki; D. Gajan; M. Lelli et al. 

Supramolecular Engineering for Formamidinium-Based Layered 2D Perovskite Solar Cells: Structural Complexity and Dynamics Revealed by Solid-State NMR Spectroscopy

J. V. Milic; J-H. Im; D. J. Kubicki; A. Ummadisingu; J-Y. Seo et al. 

Nucleobase pairing and photodimerization in a biologically derived metal-organic framework nanoreactor

S. L. Anderson; P. G. Boyd; A. Gladysiak; T. N. Nguyen; R. G. Palgrave et al. 

Multifunctional Molecular Modulation for Efficient and Stable Hybrid Perovskite Solar Cells

J. V. Milic; D. J. Kubicki; L. Emsley; M. Gratzel 

Solid-state NMR approaches to lead halide perovskites

D. Kubicki; D. Prochowicz; A. Hofstetter; M. Graetzel; L. Emsley 

Characterization of semiconductor nanocrystals using advanced NMR spectroscopy

L. Piveteau; T-C. Ong; B. Walder; D. Dirin; D. Moscheni et al. 

One- and Two-Dimensional High-Resolution NMR from Flat Surfaces

B. J. Walder; C. Berk; W-C. Liao; A. J. Rossini; M. Schwarzwaelder et al. 

Maximizing nuclear hyperpolarization in pulse cooling under MAS

S. Bjorgyinsdottir; B. J. Walder; N. Matthey; L. Emsley 

Doping and phase segregation in Mn2+- and Co2+-doped lead halide perovskites from Cs-133 and H-1 NMR relaxation enhancement

D. J. Kubicki; D. Prochowicz; A. Pinon; G. Stevanato; A. Hofstetter et al. 

Chemical exchange at the ferroelectric phase transition of lead germanate revealed by solid state Pb-207 nuclear magnetic resonance

C. E. Avalos; B. J. Walder; J. Viger-Gravel; A. Magrez; L. Emsley 

Europium-Doped CsPbI2Br for Stable and Highly Efficient Inorganic Perovskite Solar Cells

W. Xiang; Z. Wang; D. J. Kubicki; W. Tress; J. Luo et al. 

New Approaches to NMR Crystallography

Advanced Computational Methods for NMR Crystallography

Core-Shell Structure of Organic Crystalline Nanoparticles Determined by Relayed Dynamic Nuclear Polarization NMR

A. C. Pinon; U. Skantze; J. Viger-Gravel; S. Schantz; L. Emsley 

Addition of adamantylammonium iodide to hole transport layers enables highly efficient and electroluminescent perovskite solar cells

M. M. Tavakoli; W. Tress; J. V. Milic; D. Kubicki; L. Emsley et al. 

Probing Protein Dynamics Using Multifield Variable Temperature NMR Relaxation and Molecular Dynamics Simulation

B. Busi; J. R. Yarava; A. Hofstetter; N. Salvi; D. Cala-De Paepe et al. 

BDPA-Nitroxide Biradicals Tailored for Efficient Dynamic Nuclear Polarization Enhanced Solid-State NMR at Magnetic Fields up to 21.1 T

D. Wisser; G. Karthikeyan; A. Lund; G. Casano; H. Karoui et al. 

Resolving the Core and the Surface of CdSe Quantum Dots and Nanoplatelets Using Dynamic Nuclear Polarization Enhanced PASS-PIETA NMR Spectroscopy

L. Piveteau; T-C. Ong; B. J. Walder; D. N. Dirin; D. Moscheni et al. 

Structure of Lipid Nanoparticles Containing siRNA or mRNA by Dynamic Nuclear Polarization-Enhanced NMR Spectroscopy

J. Viger-Gravel; A. Schantz; A. C. Pinon; A. J. Rossini; S. Schantz et al. 

Formation of Stable Mixed Guanidinium–Methylammonium Phases with Exceptionally Long Carrier Lifetimes for High-Efficiency Lead Iodide-Based Perovskite Photovoltaics

D. J. Kubicki; D. Prochowicz; A. Hofstetter; M. Saski; P. Yadav et al. 

Chemical shifts in molecular solids by machine learning

F. M. Paruzzo; A. Hofstetter; F. Musil; S. De; M. Ceriotti et al. 

DNP in Materials Science: Touching the Surface

P. Berruyer; L. Emsley; A. Lesage 

Multifunctional molecular modulators for perovskite solar cells with over 20% efficiency and high operational stability

D. Bi; X. Li; J. V. Milić; D. J. Kubicki; N. Pellet et al. 

Solid-state NMR approaches to inorganic materials: From lead-halide perovskites to gallium phosphide

L. Emsley 

Refocused linewidths less than 10 Hz in H-1 solid-state NMR

F. Paruzzo; G. Stevanato; M. Halse; J. Schlagnitweit; D. Mammoli et al. 

Predicting the DNP-SENS efficiency in reactive heterogeneous catalysts from hydrophilicity

E. Pump; A. Bendjeriou-Sedjerari; J. Viger-Gravel; D. Gajan; B. Scotto et al. 

Phase Segregation in Potassium-Doped Lead Halide Perovskites from K-39 Solid-State NMR at 21.1 T

D. Kubicki; D. Prochowicz; A. Hofstetter; S. Zakeeruddin; M. Gratzel et al. 

Hyperpolarized long-lived nuclear spin states in monodeuterated methyl groups

S. Elliott; B. Meier; B. Vuichoud; G. Stevanato; L. Brown et al. 

Elucidating an Amorphous Form Stabilization Mechanism for Tenapanor Hydrochloride: Crystal Structure Analysis Using X-ray Diffraction, NMR Crystallography, and Molecular Modeling

S. Lill; C. Widdifield; A. Pettersen; A. Ankarberg; M. Lindkvist et al. 

DNP-enhanced solid-state NMR spectroscopy of active pharmaceutical ingredients

L. Zhao; A. Pinon; L. Emsley; A. Rossini 

DNP enhanced NMR with flip-back recovery

S. Bjorgvinsdottir; B. Walder; A. Pinon; J. Yarava; L. Emsley 

Direct observation of three-dimensional atomic-level structures on the surface of catalytic nanoparticles

L. Emsley 

Bulk Nuclear Hyperpolarization of Inorganic Solids by Relay from the Surface

S. Bjorgvinsdottir; B. Walder; A. Pinon; L. Emsley 

Spin Diffusion in Dynamic Nuclear Polarization Nuclear Magnetic Resonance

Surface-Enhanced NMR Spectroscopy

Structure of outer membrane protein G in lipid bilayers

J. S. Retel; A. J. Nieuwkoop; M. Hiller; V. A. Higman; E. Barbet-Massin et al. 

Cation Dynamics in Mixed-Cation (MA)(x)(FA)(1-x)PbI3 Hybrid Perovskites from Solid-State NMR

D. J. Kubicki; D. Prochowicz; A. Hofstetter; P. Pechy; S. M. Zakeeruddin et al. 

Phase Segregation in Cs-, Rb- and K-Doped Mixed-Cation (MA)(x)(FA)(1-x)Pbl(3) Hybrid Perovskites from Solid-State NMR

D. J. Kubicki; D. Prochowicz; A. Hofstetter; S. M. Zakeeruddin; M. Graetzel et al. 

Determining the Surface Structure of Silicated Alumina Catalysts via Isotopic Enrichment and Dynamic Nuclear Polarization Surface-Enhanced NMR Spectroscopy

A. G. M. Rankin; P. B. Webb; D. M. Dawson; J. Viger-Gravel; B. J. Walder et al. 

The Atomic-Level Structure of Cementitious Calcium Silicate Hydrate

A. Kumar; B. J. Walder; A. K. Mohamed; A. Hofstetter; B. Srinivasan et al. 

The structure and binding mode of citrate in the stabilization of gold nanoparticles

H. Al-Johani; E. Abou-Hamad; A. Jedidi; C. M. Widdifield; J. Viger-Gravel et al. 

Local Structures and Heterogeneity of Silica-Supported M(III) Sites Evidenced by EPR, IR, NMR, and Luminescence Spectroscopies

M. F. Delley; G. Lapadula; F. Nunez-Zarur; A. Comas-Vives; V. Kalendra et al. 

Does Z’ equal 1 or 2? Enhanced powder NMR crystallography verification of a disordered room temperature crystal structure of a p38 inhibitor for chronic obstructive pulmonary disease

C. M. Widdifield; S. O. N. Lill; A. Broo; M. Lindkvist; A. Pettersen et al. 

Frozen Acrylamide Gels as Dynamic Nuclear Polarization Matrices

J. Viger-Gravel; P. Berruyer; D. Gajan; J-M. Basset; A. Lesage et al. 

Measuring Nano- to Microstructures from Relayed Dynamic Nuclear Polarization NMR

A. C. Pinon; J. Schlagnitweit; P. Berruyer; A. J. Rossini; M. Lelli et al. 

Dynamic Nuclear Polarization Efficiency Increased by Very Fast Magic Angle Spinning

S. R. Chaudhari; D. Wisser; A. C. Pinon; P. Berruyer; D. Gajan et al.