All Stories

  1. From atoms to bonds, angles and torsions: molecular metrics from crystal space, and two Excel implementations
  2. The effective volumes of waters of crystallization: general organic solids
  3. The effective volumes of waters of crystallization: non-ionic pharmaceutical systems
  4. A brief introduction to nomography: graphical representation of mathematical relationships
  5. Addition to Crystallographic Information Resources
  6. Cohesive Energies and Enthalpies: Complexities, Confusions, and Corrections
  7. Correct Use of Helmholtz and Gibbs Function Differences, ΔAand ΔG: The van’t Hoff Reaction Box
  8. Crystallographic Information Resources
  9. Preliminary Property Design for Ionic Solids and Liquids
  10. Predictive thermodynamics for ionic solids and liquids
  11. Drinking-Straw Microbalance and Seesaw: Stability and Instability
  12. Illusions of Space: Charting Three Dimensions
  13. Thermodynamic consistencies and anomalies among end-member lanthanoid garnets
  14. Thermodynamic Consistencies and Anomalies among End-Member Silicate Garnets
  15. Thermodynamics of Inorganic Hydration and of Humidity Control, with an Extensive Database of Salt Hydrate Pairs
  16. Thermodynamic estimation: Ionic materials
  17. Estimation of the Thermodynamics of Ionic Materials
  18. Ambient Heat Capacities and Entropies of Ionic Solids: A Unique View Using the Debye Equation
  19. Single-Ion Values for Ionic Solids of Both Formation Enthalpies, ΔfH(298)ion, and Gibbs Formation Energies, ΔfG(298)ion
  20. Simple Route to Lattice Energies in the Presence of Complex Ions
  21. Single-Ion Heat Capacities,Cp(298)ion, of Solids: with a Novel Route to Heat-Capacity Estimation of Complex Anions
  22. Correction to Volume-Based Thermoelasticity: Consequences of the (Near) Proportionality of Isothermal Compressibility to Formula-Unit Volume
  23. Solid-State Energetics and Electrostatics: Madelung Constants and Madelung Energies
  24. Volume-based thermoelasticity: Thermal expansion coefficients and the Grüneisen ratio
  25. Ambient Isobaric Heat Capacities,Cp,m, for Ionic Solids and Liquids: An Application of Volume-Based Thermodynamics (VBT)
  26. Complexities of One-Component Phase Diagrams
  27. Thermodynamics of Condensed Phases: Formula Unit Volume,Vm, and the Determination of the Number of Formula Units,Z, in a Crystallographic Unit Cell
  28. Volume-Based Thermodynamics: A Prescription for Its Application and Usage in Approximation and Prediction of Thermodynamic Data
  29. Volume-Based Thermoelasticity: Consequences of the (Near) Proportionality of Isothermal Compressibility to Formula-Unit Volume
  30. Thermodynamic Difference Rules: A Prescription for Their Application and Usage to Approximate Thermodynamic Data†
  31. Volume-Based Thermoelasticity: Compressibility of Mineral-Structured Materials
  32. Volume-Based Thermodynamics for Ionic Materials
  33. Volume-Based Thermoelasticity: Compressibility of Inorganic Solids
  34. Equations of State and Phase Diagrams of Ammonia
  35. Systematic Thermodynamics of Magnéli-Phase and Other Transition Metal Oxides
  36. Single-Ion Entropies, S ion ° , of Solids—A Route to Standard Entropy Estimation
  37. Interactive 3D Phase Diagrams Using Jmol
  38. Systematic Thermodynamics of Hydration (and of Solvation) of Inorganic Solids
  39. Internally Consistent Ion Volumes and Their Application in Volume-Based Thermodynamics
  40. Determining the Pressure inside an Intact Carbonated Beverage Can
  41. The Thermodynamic Solvate Difference Rule:  Solvation Parameters and Their Use in Interpretation of the Role of Bound Solvent in Condensed-Phase Solvates
  42. Dealing with Outliers: Robust, Resistant Regression
  43. Born−Haber−Fajans Cycle Generalized:  Linear Energy Relation between Molecules, Crystals, and Metals
  44. Volume-Based Thermodynamics:  Estimations for 2:2 Salts
  45. Reaction to "The Concept of Ionic Strength Eighty Years after Its Introduction in Chemistry"
  46. Predictive thermodynamics for condensed phases
  47. Difference RuleA New Thermodynamic Principle:  Prediction of Standard Thermodynamic Data for Inorganic Solvates
  48. Lattice and phase transition thermodynamics of ionic liquids
  49. Standard absolute entropies, S°298, from volume or density
  50. Water, Water, Everywhere: Phase Diagrams of Ordinary Water Substance
  51. Standard Absolute Entropy, S298°, Values from Volume or Density. Part 1. Inorganic Materials.
  52. Standard Absolute Entropy, , Values from Volume or Density. 1. Inorganic Materials
  53. Ion volumes: a comparison
  54. Ionic Hydrates, MpXq·nH2O:  Lattice Energy and Standard Enthalpy of Formation Estimation
  55. Equations of State and Phase Diagrams
  56. Lattice Potential Energy Estimation for Complex Ionic Salts from Density Measurements
  57. Lattice Energies and Unit Cell Volumes of Complex Ionic Solids
  58. Thermochemical Radii of Complex Ions
  59. Relationships among Ionic Lattice Energies, Molecular (Formula Unit) Volumes, and Thermochemical Radii
  60. Representing Numbers in the Computer: A Laboratory Exercise
  61. Transferable potentials for the Ti–O system
  62. Modelling phase changes in the potassium titanyl phosphate system
  63. CAI for Chemistry
  64. Packing Molecules and Ions into Crystals
  65. Lattice Energies of Crystals with Multiple Ions: A Generalized Kapustinskii Equation
  66. Kinetics by thermometry: an aldol condensation reaction
  67. Computation of low-energy crystalline arrangements of cellulose triacetate
  68. Analyzing first-order kinetics
  69. Empirical energy parameters for structural modelling of alkali metal thiocyanate crystals in a standard formalism
  70. Useful papers on Ruchardt's method
  71. Studies in hydrogen bonding: modeling of water in crystalline hydrates
  72. Order, chaos, and all that!
  73. Empirical energy parameters for structural modeling of alkali halide crystals in standard formalisms
  74. Ruchardt's method for measuring the ratio of heat capacities of gases: A laboratory experiment in physical chemistry
  75. Diffraction at your finger tips
  76. Structure of cellulose. 2. Low-energy crystalline arrangements
  77. Fourier transforms for chemists. Part 3. Fourier transforms in data treatment
  78. Fourier transforms for chemists. Part 2. Fourier transforms in chemistry and spectroscopy
  79. Fourier transforms for chemists. Part 1. Introduction to the Fourier transform
  80. Studies in hydrogen bonding: simulation of the crystalline solids of ice, ammonia, and ammonia hydrate
  81. Studies in hydrogen bonding: the enthalpy of hydrogen bond formation of ethanol in carbon tetrachloride solutions
  82. Binding isotherms by continuous-flow dynamic dialysis
  83. Demonstrations of signal-to-noise enhancement: Digital filtering
  84. Studies in hydrogen bonding: the octamers of water
  85. Numerical optimization on a microcomputer
  86. An automated continuous-flow dynamic dialysis technique for investigating protein-ligand binding
  87. ChemInform Abstract: STUDIES IN HYDROGEN-BONDING: ASSOCIATION IN METHYLAMINE USING AN EMPIRICAL POTENTIAL
  88. Studies in hydrogen bonding: Association within mixed dimers of water, methanol, ammonia, and methylamine using the empirical potentialEPEN
  89. Studies in hydrogen bonding: Association within small clusters of water, methanol, and ammonia molecules using Jorgensen's intermolecular pair potentials
  90. Studies in hydrogen-bonding: Association in methylamine using an empirical potential
  91. Studies in hydrogen bonding: Association in ammonia using an empirical potential
  92. Studies in hydrogen bonding: Association in methanol using an empirical potential
  93. High temperature thermal properties of KH2PO4: Phase transitions and decompositions
  94. How sweet it is!
  95. Rates of bimolecular heterogeneous reactions following the Langmuir-Hinshelwood mechanism
  96. Dielectric studies of molecular association. A model for the association of ethanol in dilute solution
  97. An appreciation of experimental factors in time-domain spectroscopy
  98. Dielectric studies of molecular association. Concentration dependence of the dipole moment of 2,3,4-trimethyl-3-pentanol in solution
  99. Active, modular, digital data-collection system
  100. ChemInform Abstract: DIELECTRIC STUDIES OF MOLECULAR ASSOCIATION. CONCENTRATION DEPENDENCE OF THE DIPOLE MOMENT OF 2-, 3-, AND 4-OCTANOL IN SOLUTION
  101. ChemInform Abstract: DIELECTRUC STUDIES OF MOLECULAR ASSOCIATION, CONCENTRATION DEPENDENCE OF DIPOLE MOMENT OF 1-OCTANOL IN SOLUTION
  102. Dielectric studies of molecular association. Concentration dependence of dipole moment of 1-octanol in solution
  103. Glass pendulum
  104. Contour maps and three-dimensional representations with a line printer
  105. Relaxation Behavior of Aliphatic Alcohols in n‐Heptane Solution
  106. Teaching symmetry: The use of decorations
  107. Dielectric behavior and proton conduction in solids. I. Borax
  108. The nonequilibrium thermodynamics of chemical processes