All Stories

  1. A systematic approach to enhancing the oxidation resistance of C/C composites using multi-layer SiC-ZrB₂-based coatings
  2. Hydrogen Production from Polyethylene Pyrolysis
  3. Comparative Analysis of Radial and Random Microstructures of Mesophase Pitch Carbon Fibers
  4. Enhancing durability and activity toward oxygen evolution reaction using single-site Re-doped NiFeOx catalysts at ampere-level
  5. Discovering chemical structure: general discussion
  6. Discovering structure–property correlations: general discussion
  7. Discovering synthesis targets: general discussion
  8. Discovering trends in big data: general discussion
  9. Comparative Analysis of Radial and Random Microstructures of Mesophase Pitch Carbon Fibers
  10. Impact of Oxygen and Methyl Functional Groups on Intermolecular Bridge Formation and Mesophase Pitch Stabilization
  11. On the Evolution of Coal Porosity During Pyrolysis
  12. Molecular origin of viscoelasticity and influence of methylation in mesophase pitch
  13. Molecular Origin of Viscoelasticity and Influence of Methylation in Mesophase Pitch
  14. Detailed Characterization of Vitrinite-Rich Subbituminous and Bituminous Coals for Utilization in Carbon Fiber Precursor Production
  15. Large-scale atomistic model construction of subbituminous and bituminous coals for solvent extraction simulations with reactive molecular dynamics
  16. On the role of methyl groups in the molecular architectures of mesophase pitches
  17. On the Evolution of Coal Porosity During Pyrolysis
  18. Quantum tunneling rotor as a sensitive atomistic probe of guests in a metal-organic framework
  19. Probing sub-5 Ångstrom micropores in carbon for precise light olefin/paraffin separation
  20. Large-Scale Atomistic Model Construction of Subbituminous and Bituminous Coals for Solvent Extraction Simulations with Reactive Molecular Dynamics
  21. Photoinduced reversible phase transition in a phenothiazine-based metal-organic framework
  22. Structure Evolution of Chemically Degraded ZIF-8
  23. Cyclophane-based two-dimensional polymer formed by an interfacial click reaction
  24. Influence of Metal Identity on Light-Induced Switchable Adsorption in Azobenzene-Based Metal–Organic Frameworks
  25. Investigating Molecular Architectures of Mesophase Pitch Toward Improved Carbon Fiber Precursors
  26. Light-induced switchable adsorption in azobenzene- and stilbene-based porous materials
  27. Evolution of porous materials from ancient remedies to modern frameworks
  28. Low rotational barriers for the most dynamically active methyl groups in the proposed antiviral drugs for treatment of SARS-CoV-2, apilimod and tetrandrine
  29. How does the atomic structure of framework materials deviate from the ideal?
  30. Controlled Metal Oxide and Porous Carbon Templation Using Metal-Organic Frameworks
  31. Order-disorder in room-temperature ionic liquids probed via methyl quantum tunneling
  32. Advanced characterisation techniques: multi-scale, in situ, and time-resolved: general discussion
  33. Novel computational tools: general discussion
  34. Towards complex systems and devices: general discussion
  35. Trends in the thermal stability of two-dimensional covalent organic frameworks
  36. Thermal decarboxylation for the generation of hierarchical porosity in isostructural metal–organic frameworks containing open metal sites
  37. Computers in neutron science
  38. Hydration-Induced Disorder Lowers the Energy Barriers for Methyl Rotation in Drug Molecules
  39. Destruction of Metal–Organic Frameworks: Positive and Negative Aspects of Stability and Lability
  40. Hydrogen-Bonded Organic Frameworks: A Rising Class of Porous Molecular Materials
  41. High‐Sensitivity Acoustic Molecular Sensors Based on Large‐Area, Spray‐Coated 2D Covalent Organic Frameworks
  42. Effect of Hydration on the Molecular Dynamics of Hydroxychloroquine Sulfate
  43. Understanding dynamic properties of materials using neutron spectroscopy and atomistic simulation
  44. Single-Crystal Polycationic Polymers Obtained by Single-Crystal-to-Single-Crystal Photopolymerization
  45. Challenges for large scale simulation: general discussion
  46. Metal oxide decorated porous carbons from controlled calcination of a metal–organic framework
  47. New approaches to study excited states in density functional theory: general discussion
  48. New density-functional approximations and beyond: general discussion
  49. Metal Oxide Decorated Porous Carbons from Controlled Calcination of a Metal-Organic Framework
  50. Impact of Pressure and Temperature on the Broadband Dielectric Response of the HKUST-1 Metal–Organic Framework
  51. A Hierarchical Nanoporous Diamondoid Superstructure
  52. Assembly of a Porous Supramolecular Polyknot from Rigid Trigonal Prismatic Building Blocks
  53. Quasi‐Harmonic Lattice Dynamics of a Prototypical Metal–Organic Framework
  54. Buckling of Two-Dimensional Covalent Organic Frameworks under Thermal Stress
  55. Quasi-Harmonic Lattice Dynamics of a Prototypical Metal-Organic Framework
  56. Buckling of Two-Dimensional Covalent Organic Frameworks Under Thermal Stress
  57. Interpenetration Isomerism in Triptycene‐Based Hydrogen‐Bonded Organic Frameworks
  58. Pressure-driven mechanical anisotropy and destabilization in zeolitic imidazolate frameworks
  59. Recovering waste plastics using shape-selective nano-scale reactors as catalysts
  60. Dielectric Properties of Zeolitic Imidazolate Frameworks in the Broad-Band Infrared Regime
  61. Understanding and Controlling the Dielectric Response of Metal-Organic Frameworks
  62. Applications of crystal structure prediction – inorganic and network structures: general discussion
  63. Crystal structure evaluation: calculating relative stabilities and other criteria: general discussion
  64. Probing Dielectric Properties of Metal–Organic Frameworks: MIL-53(Al) as a Model System for Theoretical Predictions and Experimental Measurements via Synchrotron Far- and Mid-Infrared Spectroscopy
  65. Detecting Molecular Rotational Dynamics Complementing the Low-Frequency Terahertz Vibrations in a Zirconium-Based Metal-Organic Framework
  66. Large elastic recovery of zinc dicyanoaurate
  67. Catalysis in MOFs: general discussion
  68. Electrophilicity of oxalic acid monomer is enhanced in the dimer by intermolecular proton transfer
  69. Tracking thermal-induced amorphization of a zeolitic imidazolate framework via synchrotron in situ far-infrared spectroscopy
  70. Explaining the mechanical mechanisms of zeolitic metal–organic frameworks: revealing auxeticity and anomalous elasticity
  71. Discovering connections between terahertz vibrations and elasticity underpinning the collective dynamics of the HKUST-1 metal–organic framework
  72. Isoreticular zirconium-based metal–organic frameworks: discovering mechanical trends and elastic anomalies controlling chemical structure stability
  73. Photonic hybrid crystals constructed from in situ host–guest nanoconfinement of a light-emitting complex in metal–organic framework pores
  74. Micromechanical Behavior of Polycrystalline Metal–Organic Framework Thin Films Synthesized by Electrochemical Reaction
  75. Identifying the Role of Terahertz Vibrations in Metal-Organic Frameworks: From Gate-Opening Phenomenon to Shear-Driven Structural Destabilization
  76. Intermolecular Interactions between Molecules in Various Conformational States: The Dimer of Oxalic Acid
  77. Communication: Remarkable electrophilicity of the oxalic acid monomer: An anion photoelectron spectroscopy and theoretical study
  78. Nanoporous metal organic framework materials for smart applications