On the public citation graph

GIPAW (gauge including projected augmented wave) and local dynamics in 13C and 29Si solid state NMR: the study case of silsesquioxanes (RSiO1.5)8

https://doi.org/10.1039/b907450c
0 signed · 85 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.
Claim with ORCID
Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/mrc.1360openalex-snapshot
Combined ab initio computational and experimental multinuclear solid‐state magnetic resonance study of phenylphosphonic acid
inferredcites →https://doi.org/10.1002/mrc.2128openalex-snapshot
Using17O solid-state NMR and first principles calculation to characterise structure and dynamics in inorganic framework materials
inferredcites →https://doi.org/10.1002/mrc.2132openalex-snapshot
Chemical shift computations on a crystallographic basis: some reflections and comments
inferredcites →https://doi.org/10.1002/mrc.2151openalex-snapshot
Efficient low-power heteronuclear decoupling in13C high-resolution solid-state NMR under fast magic angle spinning
inferredcites →https://doi.org/10.1002/mrc.984openalex-snapshot
Modelling one‐ and two‐dimensional solid‐state NMR spectra
inferredcites →https://doi.org/10.1007/bf03162288openalex-snapshot
The NMR-WEBLAB: An internet approach to NMR lineshape analysis
inferredcites →https://doi.org/10.1007/s00723-007-0040-1openalex-snapshot
Calcium Phosphates and Hydroxyapatite: Solid-State NMR Experiments and First-Principles Calculations
inferredcites →https://doi.org/10.1016/j.cplett.2004.09.122openalex-snapshot
Direct spectral optimisation of proton–proton homonuclear dipolar decoupling in solid-state NMR
inferredcites →https://doi.org/10.1016/j.cplett.2008.09.004openalex-snapshot
New perspectives on calcium environments in inorganic materials containing calcium–oxygen bonds: A combined computational–experimental 43Ca NMR approach
inferredcites →https://doi.org/10.1016/j.jmr.2005.11.003openalex-snapshot
Symmetry-based recoupling of 17O–1H spin pairs in magic-angle spinning NMR
inferredcites →https://doi.org/10.1016/j.jmr.2007.03.018openalex-snapshot
First principles NMR calculations of phenylphosphinic acid C6H5HPO(OH): Assignments, orientation of tensors by local field experiments and effect of molecular motion
inferredcites →https://doi.org/10.1016/j.saa.2007.09.034openalex-snapshot
Effect of temperature on the EPR properties of a rhamnose alkoxy radical: A DFT molecular dynamics study
inferredcites →https://doi.org/10.1021/ar600030jopenalex-snapshot
Advanced Solid State NMR Techniques for the Characterization of Sol–Gel-Derived Materials
inferredcites →https://doi.org/10.1021/cm7028432openalex-snapshot
First Principles Calculations of NMR Parameters in Biocompatible Materials Science: The Case Study of Calcium Phosphates, β- and γ-Ca(PO3)2. Combination with MAS-J Experiments
inferredcites →https://doi.org/10.1021/ic010700kopenalex-snapshot
Synthesis and Characterization of a Novel Cyclic Aluminophosphinate: Structure and Solid-State NMR Study
inferredcites →https://doi.org/10.1021/ic061964fopenalex-snapshot
Efficiency of the Refocused 31P−29Si MAS-J-INEPT NMR Experiment for the Characterization of Silicophosphate Crystalline Phases and Amorphous Gels
inferredcites →https://doi.org/10.1021/ic800637popenalex-snapshot
17O Solid-State NMR and First-Principles Calculations of Sodium Trimetaphosphate (Na3P3O9), Tripolyphosphate (Na5P3O10), and Pyrophosphate (Na4P2O7)
inferredcites →https://doi.org/10.1021/ja00219a007openalex-snapshot
Low-temperature carbon-13 magnetic resonance. 8. Chemical shielding anisotropy of olefinic carbons
inferredcites →https://doi.org/10.1021/ja027124ropenalex-snapshot
Accurate First Principles Prediction of 17O NMR Parameters in SiO2: Assignment of the Zeolite Ferrierite Spectrum
inferredcites →https://doi.org/10.1021/ja051208topenalex-snapshot
Powder Crystallography by Proton Solid-State NMR Spectroscopy
inferredcites →https://doi.org/10.1021/ja062353popenalex-snapshot
Molecular Structure Determination in Powders by NMR Crystallography from Proton Spin Diffusion
inferredcites →https://doi.org/10.1021/ja071829hopenalex-snapshot
Resolving Structures from Powders by NMR Crystallography Using Combined Proton Spin Diffusion and Plane Wave DFT Calculations
inferredcites →https://doi.org/10.1021/ja074428aopenalex-snapshot
17O and29Si NMR Parameters of MgSiO3Phases from High-Resolution Solid-State NMR Spectroscopy and First-Principles Calculations
inferredcites →https://doi.org/10.1021/ja075892iopenalex-snapshot
Quantifying Weak Hydrogen Bonding in Uracil and 4-Cyano-4‘-ethynylbiphenyl: A Combined Computational and Experimental Investigation of NMR Chemical Shifts in the Solid State
inferredcites →https://doi.org/10.1021/ja800227fopenalex-snapshot
NMR Crystallography of Zeolites: Refinement of an NMR-Solved Crystal Structure Using ab Initio Calculations of 29Si Chemical Shift Tensors
inferredcites →https://doi.org/10.1021/ja8017253openalex-snapshot
Calcium-43 Chemical Shift Tensors as Probes of Calcium Binding Environments. Insight into the Structure of the Vaterite CaCO3 Polymorph by 43Ca Solid-State NMR Spectroscopy
inferredcites →https://doi.org/10.1021/ja9808853openalex-snapshot
Highly Porous Polyhedral Silsesquioxane Polymers. Synthesis and Characterization
inferredcites →https://doi.org/10.1021/jp044251wopenalex-snapshot
First-Principles Calculation of 17O and 25Mg NMR Shieldings in MgO at Finite Temperature: Rovibrational Effect in Solids
inferredcites →https://doi.org/10.1021/jp048462copenalex-snapshot
Ab Initio Calculations of NMR Parameters of Highly Coordinated Oxygen Sites in Aluminosilicates
inferredcites →https://doi.org/10.1021/jp0513925openalex-snapshot
Combined First-Principles Computational and Experimental Multinuclear Solid-State NMR Investigation of Amino Acids
inferredcites →https://doi.org/10.1021/jp062432nopenalex-snapshot
A Neutron Scattering and Nuclear Magnetic Resonance Study of the Structure of GeO2−P2O5 Glasses
inferredcites →https://doi.org/10.1021/jp072112jopenalex-snapshot
High-Resolution Solid-State NMR Studies of Poly(vinyl phosphonic acid) Proton-Conducting Polymer: Molecular Structure and Proton Dynamics
inferredcites →https://doi.org/10.1021/jp075921bopenalex-snapshot
Carbon-13 Chemical Shift Tensors of Disaccharides: Measurement, Computation and Assignment
inferredcites →https://doi.org/10.1021/jp711997yopenalex-snapshot
Temperature Study of a Glycine Radical in the Solid State Adopting a DFT Periodic Approach: Vibrational Analysis and Comparison with EPR Experiments
inferredcites →https://doi.org/10.1021/jp808651xopenalex-snapshot
Solid-State 17O NMR Spectroscopy of Hydrous Magnesium Silicates: Evidence for Proton Dynamics
inferredcites →https://doi.org/10.1021/jp972525sopenalex-snapshot
Pictorial Representation of Anisotropy and Macroscopic Reorientations of Samples in Solid-State NMR: First-Order Interactions
inferredcites →https://doi.org/10.1021/jp9830171openalex-snapshot
Pictorial Representation of Anisotropy and Macroscopic Reorientations of Samples in Solid-State NMR: Second-Order Interactions
inferredcites →https://doi.org/10.1039/a700700kopenalex-snapshot
Studies of octameric vinylsilasesquioxane by carbon-13 and silicon-29 cross polarization magic angle spinning and inversion recovery cross polarization nuclear magnetic resonance spectroscopy
inferredcites →https://doi.org/10.1039/b104774bopenalex-snapshot
Cubane shaped clusters, precursors for aluminophosphate frameworks: a solid state multinuclear NMR study, in time and frequency domains
inferredcites →https://doi.org/10.1039/b500674kopenalex-snapshot
A combined first principles computational and solid-state NMR study of a molecular crystal: flurbiprofen
inferredcites →https://doi.org/10.1039/b506815kopenalex-snapshot
Nanobuilding blocks based on the [OSiO1.5]x (x= 6, 8, 10) octasilsesquioxanes
inferredcites →https://doi.org/10.1039/b513392kopenalex-snapshot
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
inferredcites →https://doi.org/10.1039/b604520kopenalex-snapshot
23 Na multiple-quantum MAS NMR of the perovskites NaNbO 3 and NaTaO 3
inferredcites →https://doi.org/10.1039/b805326jopenalex-snapshot
NMR crystallography of p-tert-butylcalix[4]arene host–guest complexes using 1H complexation-induced chemical shifts
inferredcites →https://doi.org/10.1039/b821018gopenalex-snapshot
Powder NMR crystallography of thymol
inferredcites →https://doi.org/10.1063/1.2801984openalex-snapshot
A first principles theory of nuclear magnetic resonance J-coupling in solid-state systems
inferredcites →https://doi.org/10.1063/1.3081630openalex-snapshot
Calculation of NMR chemical shifts in organic solids: Accounting for motional effects
inferredcites →https://doi.org/10.1103/physrevb.43.1993openalex-snapshot
Efficient pseudopotentials for plane-wave calculations
inferredcites →https://doi.org/10.1103/physrevb.63.245101openalex-snapshot
All-electron magnetic response with pseudopotentials: NMR chemical shifts
inferredcites →https://doi.org/10.1103/physrevlett.48.1425openalex-snapshot
Efficacious Form for Model Pseudopotentials
inferredcites →https://doi.org/10.1103/physrevlett.77.3865openalex-snapshot
Generalized Gradient Approximation Made Simple
inferredcites →https://doi.org/10.1557/proc-847-ee13.26openalex-snapshot
Modification and Characterization of Si-Based Nanobuilding Blocks Precursors for Hybrid Materials

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.2139/ssrn.4788357openalex-extracted
Strengthen Metal-O Interaction Toward High Ionic Mobility on Doping Lifepo4
inferred← citeshttps://doi.org/10.1002/ejic.202100908openalex-snapshot
Volume Increments for Crystalline Borates
inferred← citeshttps://doi.org/10.1016/j.jelechem.2024.118371openalex-snapshot
Strengthen metal-O interaction toward high ionic mobility on doping LiFePO4
inferred← citeshttps://doi.org/10.1016/j.jorganchem.2018.08.009openalex-snapshot
13C NMR spectrum of crystalline [Rh(Acac) (CO)2]: A contribution to the discussion on [Rh(Acac) (CO)2] molecular structure in the solid state
inferred← citeshttps://doi.org/10.1016/j.mtphys.2025.101704openalex-snapshot
Smoothing Li transport via weak Metal-O bonds for improved ionic mobility in lithium lanthanum titanium oxide
inferred← citeshttps://doi.org/10.1016/j.ssnmr.2011.04.006openalex-snapshot
The PAW/GIPAW approach for computing NMR parameters: A new dimension added to NMR study of solids
inferred← citeshttps://doi.org/10.1016/j.ssnmr.2012.02.005openalex-snapshot
Quantitative structural characterization of POSS and octavinyl-POSS nanocomposites by solid state NMR
inferred← citeshttps://doi.org/10.1021/ac100761mopenalex-snapshot
Solid State NMR Spectroscopy
inferred← citeshttps://doi.org/10.1021/acs.jpcc.5b08868openalex-snapshot
Structure, Dynamics, and Host–Guest Interactions in POSS Functionalized Cross-Linked Nanoporous Hybrid Organic–Inorganic Polymers
inferred← citeshttps://doi.org/10.1021/acs.jpcc.6b10042openalex-snapshot
NMR Spectral Parameters in Graphene, Graphite, and Related Materials: Ab Initio Calculations and Experimental Results
inferred← citeshttps://doi.org/10.1021/cr300108aopenalex-snapshot
First-Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist’s Point of View
inferred← citeshttps://doi.org/10.1021/ja201002ropenalex-snapshot
Investigation of the Interface in Silica-Encapsulated Liposomes by Combining Solid State NMR and First Principles Calculations
inferred← citeshttps://doi.org/10.1021/ja9062629openalex-snapshot
Time Averaging of NMR Chemical Shifts in the MLF Peptide in the Solid State
inferred← citeshttps://doi.org/10.1021/jp2105133openalex-snapshot
Exploiting the Chemical Shielding Anisotropy to Probe Structure and Disorder in Ceramics: 89Y MAS NMR and First-Principles Calculations
inferred← citeshttps://doi.org/10.1021/jp308787zopenalex-snapshot
29Si Chemical Shift Anisotropies in Hydrated Calcium Silicates: A Computational Study
inferred← citeshttps://doi.org/10.1021/jp906764eopenalex-snapshot
Cation Disorder in Pyrochlore Ceramics: 89Y MAS NMR and First-Principles Calculations
inferred← citeshttps://doi.org/10.1039/9781837673179-00061openalex-snapshot
First-principles Calculation of NMR Parameters
inferred← citeshttps://doi.org/10.1039/9781837673179-00175openalex-snapshot
Accurate Predictions of Solid-state NMR Parameters
inferred← citeshttps://doi.org/10.1039/b916076kopenalex-snapshot
Mg-25 ultra-high field solid state NMR spectroscopy and first principles calculations of magnesium compounds
inferred← citeshttps://doi.org/10.1039/b924666eopenalex-snapshot
Dynamics on the microsecond timescale in hydrous silicates studied by solid-state 2H NMR spectroscopy
inferred← citeshttps://doi.org/10.1039/c000353kopenalex-snapshot
Natural abundance high field 43Ca solid state NMR in cement science
inferred← citeshttps://doi.org/10.1039/c0cp01274bopenalex-snapshot
119 Sn MAS NMR and first-principles calculations for the investigation of disorder in stannate pyrochlores
inferred← citeshttps://doi.org/10.1039/c1cp20258hopenalex-snapshot
93Nb NMR and DFT investigation of the polymorphs of NaNbO3
inferred← citeshttps://doi.org/10.1039/c3ce41233dopenalex-snapshot
Structural assessment of anhydrous sulfates with high field 33S solid state NMR and first principles calculations
inferred← citeshttps://doi.org/10.1039/c6cc02542kopenalex-snapshot
Combining solid-state NMR spectroscopy with first-principles calculations – a guide to NMR crystallography
inferred← citeshttps://doi.org/10.1039/c6cp08393eopenalex-snapshot
Temperature dependence of X-ray absorption and nuclear magnetic resonance spectra: probing quantum vibrations of light elements in oxides
inferred← citeshttps://doi.org/10.1039/c7cp05233bopenalex-snapshot
Solid-state dynamics and single-crystal to single-crystal structural transformations in octakis(3-chloropropyl)octasilsesquioxane and octavinyloctasilsesquioxane
inferred← citeshttps://doi.org/10.1039/c8ra07736copenalex-snapshot
Synthesis and characterization of methylammonium phosphates as crystalline approximants for anhydrous, low melting phosphate glasses
inferred← citeshttps://doi.org/10.1039/d5dt00928fopenalex-snapshot
Structural changes induced by the promoter Ga in nanocrystalline ZnO support used in methanol catalysis
inferred← citeshttps://doi.org/10.1070/rc2012v081n02abeh004213openalex-snapshot
Structural studies of crystals of organic and organoelement compounds using modern quantum chemical calculations within the framework of the density functional theory
inferred← citeshttps://doi.org/10.1103/physrevb.92.144310openalex-snapshot
Phonon effects on x-ray absorption and nuclear magnetic resonance spectroscopies
inferred← citeshttps://doi.org/10.1139/v11-044openalex-snapshot
High-field multinuclear solid-state nuclear magnetic resonance (NMR) and first principle calculations in MgSO4 polymorphs
inferred← citeshttps://doi.org/10.70675/de659b7dzdc4fz418dz8072zb9c9e5212e31openalex-snapshot
Modélisation de verres de tellure, matériaux pour l’optique infrarouge
Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.