Thermodynamic Modeling and Materials Data Engineering

Front Matter....Pages I-X
The Extended Application of a TENSG, VI. Theoretical Method for Calculation of Gaseous Heat Capacity....Pages 1-10
PVT Measurements of Methanol and its Specific Equation of State....Pages 11-20
Enthalpy of Vaporization of N-Alkanes (from Nonane to Pentadecane). Experimental Results - Correlation....Pages 21-32
Aims and Achievements of the Scientific Group Thermodata Europe....Pages 33-38
First Principles Calculations of Binary Alloy Phase Diagrams....Pages 39-52
Evaluation of Equations of State at High Pressure for Light Hydrocarbons....Pages 53-70
Thermochemical Mimicry....Pages 71-78
Computer-Aided Inorganic Properties Estimation System....Pages 79-84
Estimation of Physical Properties of Organic Compounds. A Comparison of Methods in the Case of Vapor Pressure Estimation....Pages 85-94
Model for the Critical Evaluation of Solubility Data in Salt Systems....Pages 95-108
On the Expert Thermodynamic Analysis of Power Engineering Problems....Pages 109-114
Liquid-Solid Transitions Within Multiple Emulsions. Enthalpy and Temperature Data Applied to Mass Transfer Studies....Pages 115-128
Investigation of the Structural and Acidic Properties of Bulk Offretite Using First Principles Molecular Dynamics....Pages 129-134
Surface Thermodynamics of Solid Materials by Inverse Gas Chromatography....Pages 135-142
Differential Scanning Calorimetry (DSC) and Temperature Dependence of the Electrical Conductivity in the Ternary System: Water + CTAB + Phenol....Pages 143-150
Thermodynamic Models for Monitoring Deoxidation Treatments and Controlling Inclusions in Steels....Pages 151-160
A Technique for Studying the Particle Impact Phenomena in Plasma Spraying....Pages 161-168
The Application of Thermodynamics to the Development of Processes and Materials....Pages 169-182
Materials data for the Era of Agile Manufacturing....Pages 183-188
Materials Data Requirements for Computer Simulation in Design and Manufacture....Pages 189-224
Microcomputer - Aided - Tomography of Composite Materials....Pages 225-232
Modeling of the Viscoelastic Behavior of Non-Homogeneous Materials....Pages 233-242
Modeling Studies of the Uniaxial Creep of a Brittle Matrix Composite....Pages 243-250
The Intelligent Selection of Materials from a Design Specification....Pages 251-254
Phase Diagram Calculations and the Optimization of High Speed Steel Compositions for Economic Powder Metallurgy Processing Routes....Pages 255-262
Thermodynamic Approach to the Design of New Cermets Processed by Liquid Phase Sintering....Pages 263-272
Preparation of Thin Films Using a Sol-Gel Method....Pages 273-282
Aqueous Preparation of Chemically Homogeneous Multicomponent Silicate Precursors....Pages 283-288
Synthesis of Barium Titanate by Reaction of Titanium Salts in Molten Alkali Metal Salts of Oxoacids of Nitrogen....Pages 289-292
New Materials for (Bio)Chemical Recognition....Pages 293-304
Ionic Recognition Using Conducting Ceramics....Pages 305-312
Synthesis of Macrocyclic Lactams in Organized Media....Pages 313-320
Synthesis of Chromium Oxides from Aqueous Solutions....Pages 321-326
Defect Interactions: Electronic Transport and Statistical Thermodynamics in Nonstoichiometric Oxides....Pages 327-334
Mechanical Response of Amorphous Polymers: α + β Mechanical Relaxations, Plastic Deformation, Creep Test and Stress Relaxation....Pages 335-342
Modeling of Anisotropic Coalescence of γ’ in Superalloys....Pages 343-348
Database-Related Standardization to Describe Experimental Results on the Thermophysical Properties of Solids....Pages 349-354
Materials Data for Thin Interlayers by an Inverse Method: The Case of a Constitutive Law of Brazes....Pages 355-362
Relations Between Fractal Models of Some Oxide Surface Shapes and Their Optical Properties....Pages 363-370
Temperature Distributions in Adiabatic Shear Bands in Steel....Pages 371-376
Back Matter....Pages 377-398