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RESEARCH PAPER · Inorganic Chemistry · 2010

Structures and Phase Transitions in (MoO2)2P2O7

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Structures and Phase Transitions in (MoO2)2P2O7OriginalChemInform Abstract: Structures and Phase Transitions in (MoO2)2P2O7.0Computation and NMR crystallography of terbutaline sulfate83New perspectives in the PAW/GIPAW approach: JP-O-Si coupling constants, antisymmetric parts of shift tensors and NQR predictions45Prediction of NMR J-coupling in solids with the planewave pseudopotential approach26Structural and Mechanistic Studies of the Dehydration of MoO2PO3OH·H2O and the In situ Identification of Two New Molybdenum Phosphates18High-Resolution 1H NMR Spectroscopy of Solids47New compounds and structures in the solid state0Towards homonuclear J solid-state NMR correlation experiments for half-integer quadrupolar nuclei: experimental and simulated 11B MAS spin-echo dephasing and calculated 2JBB coupling constants for lithium diborate36The PAW/GIPAW approach for computing NMR parameters: A new dimension added to NMR study of solids411A simple route to full structural analysis of biophosphates and their application to materials discovery5Photochemical-mediated solid-state [2+2]-cycloaddition reactions of an unsymmetrical dibenzylidene acetone (monothiophos-dba)24NMR Crystallography Comparative Studies of Chiral (1R,2S,3R,5R)-3-Amino-6,6-dimethylbicyclo[3.1.1]heptan-2-ol and Its p-Toluenesulfonamide Derivative4A General Protocol for Determining the Structures of Molecularly Ordered but Noncrystalline Silicate Frameworks79Solid‐State Nuclear Magnetic Resonance Spectroscopy13Vanadium promoted molybdenum phosphate catalysts for the vapour phase partial oxidation of methanol to formaldehyde19Acetalization of glycerol with acetone to bio fuel additives over supported molybdenum phosphate catalysts77Synthesis and crystal structure of mixed metal(III) tungstenyl(VI) ortho-pyrophosphates7Perspective: Current advances in solid-state NMR spectroscopy39NMR crystallography of molecular organics182Effect of Mo/P Ratios on Dimensions: Syntheses, Structures, and Properties of Three New Molybdophosphates10Hydrogen-Mediated Noncovalent Interactions in Solids: What Can NMR Crystallography Tell About?16Warm white emission of Ca2P2O7: Dy3+, Eu3+ phosphor via hydrothermal method31Learning Design Rules for Selective Oxidation Catalysts from High-Throughput Experimentation and Artificial Intelligence54GIPAW Pseudopotentials of d Elements for Solid-State NMR14Mo2P2O11: A Potential Cathode Material for Rechargeable Sodium-Ion Batteries10Catalytic and structural insights into MoPO/TiO2-ZrO2 catalysts: optimizing esterification for ethyl levulinate production0Introduction to the Interactions of NMR and Their Application to NMR Crystallography0Temperature-induced structural phase transitions in inorganic compounds: symmetry and information-entropy analysis1

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  1. ChemInform Abstract: Structures and Phase Transitions in (MoO2)2P2O7.

    ChemInform · 2010-05-27

    Sarah E. Lister, Anne Soleilhavoup, Ray Leslie Withers, Paul Hodgkinson, John S. O. Evans

    Read original paper ↗ ·
  2. Computation and NMR crystallography of terbutaline sulfate

    Magnetic Resonance in Chemistry · 2010-06-29

    Robin K. Harris, Paul Hodgkinson, Vadim Zorin, Jean‐Nicolas Dumez, Bénédicte Elena‐Herrmann, Lyndon Emsley, Elodie Salager, Robin S. Stein

    Read original paper ↗ ·
  3. New perspectives in the PAW/GIPAW approach: JP-O-Si coupling constants, antisymmetric parts of shift tensors and NQR predictions

    Magnetic Resonance in Chemistry · 2010-06-29

    Christian Bonhomme, Christel Gervais, Cristina Coelho, Frédérique Pourpoint, Thierry Azaı̈s, Laure Bonhomme-Coury, Florence Babonneau, Guy Jacob, Maude Ferrari, D. Canet, Jonathan R. Yates, Chris J. Pickard, Siân A. Joyce, Francesco Mauri, Dominique Massiot A

    Read original paper ↗ ·
  4. Prediction of NMR J-coupling in solids with the planewave pseudopotential approach

    Magnetic Resonance in Chemistry · 2010-07-12

    Jonathan R. Yates

    Read original paper ↗ ·
  5. Structural and Mechanistic Studies of the Dehydration of MoO2PO3OH·H2O and the In situ Identification of Two New Molybdenum Phosphates

    Chemistry of Materials · 2010-08-12

    Sarah E. Lister, Victoria J. Rixom, John S. O. Evans

    Read original paper ↗ ·
  6. High-Resolution 1H NMR Spectroscopy of Solids

    Annual reports on NMR spectroscopy · 2011-01-01

    Paul Hodgkinson

    Read original paper ↗ ·
  7. New compounds and structures in the solid state

    Annual Reports Section A (Inorganic Chemistry) · 2011-01-01

    Edmund J. Cussen

    Read original paper ↗ ·
  8. Towards homonuclear J solid-state NMR correlation experiments for half-integer quadrupolar nuclei: experimental and simulated 11B MAS spin-echo dephasing and calculated 2JBB coupling constants for lithium diborate

    Physical Chemistry Chemical Physics · 2011-01-01

    Nathan S. Barrow, Jonathan R. Yates, Steve A. Feller, Diane Holland, Sharon Elizabeth Ashbrook, Paul Hodgkinson, Steven P. Brown

    Read original paper ↗ ·
  9. The PAW/GIPAW approach for computing NMR parameters: A new dimension added to NMR study of solids

    Solid State Nuclear Magnetic Resonance · 2011-05-09

    Thibault Charpentier

    Read original paper ↗ ·
  10. A simple route to full structural analysis of biophosphates and their application to materials discovery

    Dalton Transactions · 2012-01-01

    Matthew R. Hill, Timothy J. Bastow, LAURE N. BOURGEOIS, David R. Turner, Aaron Seeber, Katie E. McBean, HAROLD J. WHITFIELD

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  11. Photochemical-mediated solid-state [2+2]-cycloaddition reactions of an unsymmetrical dibenzylidene acetone (monothiophos-dba)

    CrystEngComm · 2012-01-01

    Amanda G. Jarvis, Hazel A. Sparkes, Sarah E. Tallentire, Lauren E. Hatcher, Mark R. Warren, Paul R. Raithby, David R. Allan, Adrian Charles Whitwood, Martin C. R. Cockett, Simon B. Duckett, Joanna L. Clark, Ian J. S. Fairlamb

    Read original paper ↗ ·
  12. NMR Crystallography Comparative Studies of Chiral (1R,2S,3R,5R)-3-Amino-6,6-dimethylbicyclo[3.1.1]heptan-2-ol and Its p-Toluenesulfonamide Derivative

    Crystal Growth & Design · 2012-11-14

    Magdalena Jaworska, Tomasz Pawlak, R. Kruszyński, Marta Ćwiklińska, M. Krzemiński

    Read original paper ↗ ·
  13. A General Protocol for Determining the Structures of Molecularly Ordered but Noncrystalline Silicate Frameworks

    Journal of the American Chemical Society · 2013-04-05

    Darren H. Brouwer, Sylvian Cadars, Juergen Eckert, Zheng Liu, Osamu Terasaki, Bradley F. Chmelka

    Read original paper ↗ ·
  14. Solid‐State Nuclear Magnetic Resonance Spectroscopy

    Unknown journal · 2013-08-02

    Sharon Elizabeth Ashbrook, Daniel M. Dawson, John M. Griffin

    Read original paper ↗ ·
  15. Vanadium promoted molybdenum phosphate catalysts for the vapour phase partial oxidation of methanol to formaldehyde

    Applied Catalysis A General · 2014-08-01

    Gareth T. Whiting, Jonathan K. Bartley, Nicholas F. Dummer, Graham J. Hutchings, Stuart H. Taylor

    Read original paper ↗ ·
  16. Acetalization of glycerol with acetone to bio fuel additives over supported molybdenum phosphate catalysts

    Journal of Molecular Catalysis A Chemical · 2015-09-12

    Sailaja Gadamsetti, N. Pethan Rajan, Ginjupalli Srinivasa Rao, Komandur V. R. Chary

    Read original paper ↗ ·
  17. Synthesis and crystal structure of mixed metal(III) tungstenyl(VI) ortho-pyrophosphates

    Solid State Sciences · 2015-09-16

    Subrata Chandra Roy, Branimir Raguž, Wilfried Assenmacher, Robert Glaum

    Read original paper ↗ ·
  18. Perspective: Current advances in solid-state NMR spectroscopy

    The Journal of Chemical Physics · 2018-07-23

    Sharon Elizabeth Ashbrook, Paul Hodgkinson

    Read original paper ↗ ·
  19. NMR crystallography of molecular organics

    Progress in Nuclear Magnetic Resonance Spectroscopy · 2020-03-18

    Paul Hodgkinson

    Read original paper ↗ ·
  20. Effect of Mo/P Ratios on Dimensions: Syntheses, Structures, and Properties of Three New Molybdophosphates

    Inorganic Chemistry · 2020-04-03

    Haonan Liu, Hongping Wu, Hongwei Yu, Zhanggui Hu, Jiyang Wang, Yicheng Wu

    Read original paper ↗ ·
  21. Hydrogen-Mediated Noncovalent Interactions in Solids: What Can NMR Crystallography Tell About?

    Molecules · 2020-08-18

    I. Grosu, Xenia Filip, Maria Olimpia Miclaus, Claudiu Filip

    Read original paper ↗ ·
  22. Warm white emission of Ca2P2O7: Dy3+, Eu3+ phosphor via hydrothermal method

    Journal of Alloys and Compounds · 2021-11-21

    Xiao-Fang Yu, Zhiyi Wang, Qingran wang, Xiaoyun Mi

    Read original paper ↗ ·
  23. Learning Design Rules for Selective Oxidation Catalysts from High-Throughput Experimentation and Artificial Intelligence

    ACS Catalysis · 2022-01-31

    Lucas Foppa, Christopher A. Sutton, Luca M. Ghiringhelli, Sandip De, Patricia Löser, Stephan A. Schunk, Ansgar Schäfer, Matthias Scheffler

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  24. GIPAW Pseudopotentials of d Elements for Solid-State NMR

    Materials · 2022-05-06

    Christian Tantardini, Alexander G. Kvashnin, Davide Ceresoli

    Read original paper ↗ ·
  25. Mo2P2O11: A Potential Cathode Material for Rechargeable Sodium-Ion Batteries

    Energy & Fuels · 2022-12-29

    Saurabh Kumar, Mahatim Singh, Rakesh Mondal, Mridul Kumar, Rajiv Prakash, Preetam Singh

    Read original paper ↗ ·
  26. Catalytic and structural insights into MoPO/TiO2-ZrO2 catalysts: optimizing esterification for ethyl levulinate production

    Emergent Materials · 2024-02-23

    Sailaja Gadamsetti, Srinivasa Rao Ginjupalli, N. Pethan Rajan, Balaga Viswanadham, Putrakumar Balla, Komandur V. R. Chary

    Read original paper ↗ ·
  27. Introduction to the Interactions of NMR and Their Application to NMR Crystallography

    Royal Society of Chemistry eBooks · 2025-03-31

    Paul Hodgkinson, Karen E. Johnston

    Read original paper ↗ ·
  28. Temperature-induced structural phase transitions in inorganic compounds: symmetry and information-entropy analysis

    Progress in Solid State Chemistry · 2025-09-11

    Sergey V. Krivovichev

    Read original paper ↗ ·