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The chemistry of environmental engineering : materials, processing and applications / / Johannes Karl Fink
The chemistry of environmental engineering : materials, processing and applications / / Johannes Karl Fink
Autore Fink Johannes Karl
Pubbl/distr/stampa Hoboken, New Jersey : , : Wiley, , 2020
Descrizione fisica 1 online resource (335 pages)
Disciplina 668.9
Soggetto topico Polymers
Polymerization
Polymer engineering
ISBN 1-119-70783-8
1-119-70786-2
1-119-70784-6
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Special polymers -- Special properties of polymers -- Processing methods -- Recycling -- Wastewater treatment -- Pesticides -- Electrical uses -- Food engineering -- Medical uses.
Record Nr. UNINA-9910810953903321
Fink Johannes Karl  
Hoboken, New Jersey : , : Wiley, , 2020
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Autore Askadskiĭ A. A (Andreĭ Aleksandrovich)
Pubbl/distr/stampa Cambridge [England], : Cambridge International Science Pub., 2003
Descrizione fisica 1 online resource (711 p.)
Disciplina 668.9
Soggetto topico Polymers - Mathematical models
Plastics
Soggetto genere / forma Electronic books.
ISBN 1-280-22604-8
9786610226047
1-904602-32-0
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto PREFACE; INTRODUCTION; Chapter I. Brief information on types of polymers and their chemical structure; Chapter II. Packing of macromolecules and polymer density; II.1. Increments method and basic physical assumptions; II.2. Relationship between free volume of polymers, coefficient of molecular packing and porous structure; Chapter III. Temperature coefficient of volumetric expansion; Chapter IV. Glass transition temperature of polymers; IV.1. Thermomechanical and other methods of evaluation of the glass transition temperature of polymers; IV.2. Mechanism of glass transition
IV.3. Calculation of the glass transition temperature of linear polymersIV.4. Influence of plasticization on the glass transition temperature of polymers; IV.5. Calculation of the glass transition temperature of polymer networks; Chapter V. Temperature of transition into the viscous flow state for amorphous polymers; V.1 Estimation of temperature of transition into the viscous flow state of polymers; V.2 Dependence of Newtonian viscosity on molecular mass of polymer in a wide range of its change; Chapter VI. Melting point of polymers
Chapter VII. Temperature of onset of intense thermal degradation of polymersChapter VIII. Optical and opto-mechanical properties of polymers; VIII.1 Refractive index; VIII.2 Stress-optical coefficient; Chapter IX. Dielectric constant of polymers and organic solvents; Chapter X. Equilibrium rubbery modulus for polymer networks; X.1 Calculations of the equilibrium modulus; Chapter XI. Description of relaxation processes in polymers; XI.1 Stress relaxation; XI.2 Sorption and swelling processes; Chapter XII. Solubility of polymers
XII.1 Specific cohesive energy of organic liquids and polymers Hildebrand solubility parameterXII.2 Solubility criterion; XII.3 Influence of molecular mass and degree of macromolecule orientation on solubility; Chapter XIII. Surface properties of organic liquids and polymers; XIII.1. Surface tension of organic liquids; XIII.2. Surface tension of polymers; Chapter XIV. Miscibility of polymers; Chapter XVI. Thermophysical properties of polymers; XVI.1 Heat capacity; XVI.2 Thermal diffusivity and heat conductivity
Chapter XVII. Molecular design and computer synthesis of polymers with predetermined propertiesAppendix 1. Examples of solution of direct problems of polymer synthesis; Appendix 2. Examples of solving the reverse problem of polymer synthesis; Appendix 3. The example of solving the complex problem ... analysis of the chemical structure of phenol formaldehyde resin; Appendix 4. Application of the approach to multicomponent copolymers; Appendix 5. Influence of strong intermolecular interaction occurring between two dissimilar polymers on their miscibility
Appendix 6. On formation of super-molecular structures in amorphous polymers
Record Nr. UNINA-9910449850803321
Askadskiĭ A. A (Andreĭ Aleksandrovich)  
Cambridge [England], : Cambridge International Science Pub., 2003
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Autore Askadskiĭ A. A (Andreĭ Aleksandrovich)
Pubbl/distr/stampa Cambridge [England], : Cambridge International Science Pub., 2003
Descrizione fisica 1 online resource (711 p.)
Disciplina 668.9
Soggetto topico Polymers - Mathematical models
Plastics
ISBN 1-280-22604-8
9786610226047
1-904602-32-0
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto PREFACE; INTRODUCTION; Chapter I. Brief information on types of polymers and their chemical structure; Chapter II. Packing of macromolecules and polymer density; II.1. Increments method and basic physical assumptions; II.2. Relationship between free volume of polymers, coefficient of molecular packing and porous structure; Chapter III. Temperature coefficient of volumetric expansion; Chapter IV. Glass transition temperature of polymers; IV.1. Thermomechanical and other methods of evaluation of the glass transition temperature of polymers; IV.2. Mechanism of glass transition
IV.3. Calculation of the glass transition temperature of linear polymersIV.4. Influence of plasticization on the glass transition temperature of polymers; IV.5. Calculation of the glass transition temperature of polymer networks; Chapter V. Temperature of transition into the viscous flow state for amorphous polymers; V.1 Estimation of temperature of transition into the viscous flow state of polymers; V.2 Dependence of Newtonian viscosity on molecular mass of polymer in a wide range of its change; Chapter VI. Melting point of polymers
Chapter VII. Temperature of onset of intense thermal degradation of polymersChapter VIII. Optical and opto-mechanical properties of polymers; VIII.1 Refractive index; VIII.2 Stress-optical coefficient; Chapter IX. Dielectric constant of polymers and organic solvents; Chapter X. Equilibrium rubbery modulus for polymer networks; X.1 Calculations of the equilibrium modulus; Chapter XI. Description of relaxation processes in polymers; XI.1 Stress relaxation; XI.2 Sorption and swelling processes; Chapter XII. Solubility of polymers
XII.1 Specific cohesive energy of organic liquids and polymers Hildebrand solubility parameterXII.2 Solubility criterion; XII.3 Influence of molecular mass and degree of macromolecule orientation on solubility; Chapter XIII. Surface properties of organic liquids and polymers; XIII.1. Surface tension of organic liquids; XIII.2. Surface tension of polymers; Chapter XIV. Miscibility of polymers; Chapter XVI. Thermophysical properties of polymers; XVI.1 Heat capacity; XVI.2 Thermal diffusivity and heat conductivity
Chapter XVII. Molecular design and computer synthesis of polymers with predetermined propertiesAppendix 1. Examples of solution of direct problems of polymer synthesis; Appendix 2. Examples of solving the reverse problem of polymer synthesis; Appendix 3. The example of solving the complex problem ... analysis of the chemical structure of phenol formaldehyde resin; Appendix 4. Application of the approach to multicomponent copolymers; Appendix 5. Influence of strong intermolecular interaction occurring between two dissimilar polymers on their miscibility
Appendix 6. On formation of super-molecular structures in amorphous polymers
Record Nr. UNINA-9910777064003321
Askadskiĭ A. A (Andreĭ Aleksandrovich)  
Cambridge [England], : Cambridge International Science Pub., 2003
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Computational materials science of polymers [[electronic resource] /] / Andrey Aleksandrovich Askadskii
Autore Askadskiĭ A. A (Andreĭ Aleksandrovich)
Pubbl/distr/stampa Cambridge [England], : Cambridge International Science Pub., 2003
Descrizione fisica 1 online resource (711 p.)
Disciplina 668.9
Soggetto topico Polymers - Mathematical models
Plastics
ISBN 1-280-22604-8
9786610226047
1-904602-32-0
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto PREFACE; INTRODUCTION; Chapter I. Brief information on types of polymers and their chemical structure; Chapter II. Packing of macromolecules and polymer density; II.1. Increments method and basic physical assumptions; II.2. Relationship between free volume of polymers, coefficient of molecular packing and porous structure; Chapter III. Temperature coefficient of volumetric expansion; Chapter IV. Glass transition temperature of polymers; IV.1. Thermomechanical and other methods of evaluation of the glass transition temperature of polymers; IV.2. Mechanism of glass transition
IV.3. Calculation of the glass transition temperature of linear polymersIV.4. Influence of plasticization on the glass transition temperature of polymers; IV.5. Calculation of the glass transition temperature of polymer networks; Chapter V. Temperature of transition into the viscous flow state for amorphous polymers; V.1 Estimation of temperature of transition into the viscous flow state of polymers; V.2 Dependence of Newtonian viscosity on molecular mass of polymer in a wide range of its change; Chapter VI. Melting point of polymers
Chapter VII. Temperature of onset of intense thermal degradation of polymersChapter VIII. Optical and opto-mechanical properties of polymers; VIII.1 Refractive index; VIII.2 Stress-optical coefficient; Chapter IX. Dielectric constant of polymers and organic solvents; Chapter X. Equilibrium rubbery modulus for polymer networks; X.1 Calculations of the equilibrium modulus; Chapter XI. Description of relaxation processes in polymers; XI.1 Stress relaxation; XI.2 Sorption and swelling processes; Chapter XII. Solubility of polymers
XII.1 Specific cohesive energy of organic liquids and polymers Hildebrand solubility parameterXII.2 Solubility criterion; XII.3 Influence of molecular mass and degree of macromolecule orientation on solubility; Chapter XIII. Surface properties of organic liquids and polymers; XIII.1. Surface tension of organic liquids; XIII.2. Surface tension of polymers; Chapter XIV. Miscibility of polymers; Chapter XVI. Thermophysical properties of polymers; XVI.1 Heat capacity; XVI.2 Thermal diffusivity and heat conductivity
Chapter XVII. Molecular design and computer synthesis of polymers with predetermined propertiesAppendix 1. Examples of solution of direct problems of polymer synthesis; Appendix 2. Examples of solving the reverse problem of polymer synthesis; Appendix 3. The example of solving the complex problem ... analysis of the chemical structure of phenol formaldehyde resin; Appendix 4. Application of the approach to multicomponent copolymers; Appendix 5. Influence of strong intermolecular interaction occurring between two dissimilar polymers on their miscibility
Appendix 6. On formation of super-molecular structures in amorphous polymers
Record Nr. UNINA-9910822675203321
Askadskiĭ A. A (Andreĭ Aleksandrovich)  
Cambridge [England], : Cambridge International Science Pub., 2003
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
A concise introduction to additives for thermoplastic polymers [[e-book] /] / Johannes Karl Fink
A concise introduction to additives for thermoplastic polymers [[e-book] /] / Johannes Karl Fink
Autore Fink Johannes Karl
Pubbl/distr/stampa Hoboken, NJ, : Wiley
Descrizione fisica 1 online resource (284 p.)
Disciplina 668.4/23
668.9
Collana Wiley-Scrivener
Soggetto topico Polymers - Additives
Thermoplastics
ISBN 1-282-68401-9
9786612684012
0-470-62424-8
1-61344-163-0
0-470-62423-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto A Concise Introduction to Additives for Thermoplastic Polymers; Contents; Preface; 1 Introduction; 1.1 Classification; References; 2 Plasticizers; 2.1 Principle of Action; 2.2 Principle of Selection; 2.3 Characterization; 2.4 Risks and Drawbacks; 2.4.1 Leaching; 2.4.2 Inherent Toxicity; 2.5 Classes of Plasticizers; 2.5.1 Phthalate Plasticizers; 2.5.2 Cyclohexanoic Diesters; 2.5.3 Phophate Plasticizers; 2.5.4 Aliphatic Esters; 2.5.5 Polymeric Plasticizers; 2.5.6 Ionic Liquids; 2.6 Specific Examples of Application; 2.6.1 Heat Shrinkable Films; 2.6.2 Adhesive Compositions
2.6.3 Interlayer Films for Safety Glasses2.6.4 Electrolyte Membranes; 2.6.5 Porous Electrodes; 2.6.6 Biodegradable Polymers; 2.6.7 Plasticizers for Energetic Polymers; References; 3 Fillers; 3.1 Surface Modification; 3.1.1 Siloxanes; 3.1.2 Dispersion and Coupling Additives; 3.2 Special Applications; 3.2.1 Flame Retardant Fillers; 3.2.2 Conductive Fillers; 3.2.3 Solder Precoated Fillers; 3.2.4 Nano Clays; 3.2.5 Mixed Matrix Membranes; References; 4 Colorants; 4.1 Physics Behind a Color; 4.1.1 Human Eye; 4.1.2 Tristimulus Values; 4.1.3 Color Spaces; 4.2 Color Index; 4.3 Test Standards
4.4 Pigments4.5 Organic Colorants; References; 5 Optical Brighterners; 5.1 Basic Principles; 5.2 Measurement; 5.3 Inorganic Brighteners; 5.4 Organic Optical Brighteners; 5.4.1 Reactive Optical Brighteners; 5.4.2 Melt Extrusion; 5.4.3 Photographic Supports; References; 6 Antimicrobial Additives; 6.1 Modes of Action; 6.1.1 Types of Irritations; 6.2 Plasticizers; 6.3 Special Formulations; 6.3.1 Contact Lenses; 6.3.2 Food Packaging; 6.3.3 Polymers with Inherent Antimicrobial Properties; References; 7 Flame Retardants; 7.1 Mechanisms of Flame Retardants; 7.1.1 Flame Cooling of Halogens
7.2 Smoke Suppressants7.3 Admixed Additives; 7.4 Bonded Additives; 7.4.1 Examples of Polymers; References; 8 Lubricants; 8.1 Principle of Action; 8.2 Methods of Incorporation; 8.2.1 Conventional Method; 8.2.2 Separate Delivery of the Lubricant; 8.3 Types of Lubricants; 8.3.1 Alcohols; 8.3.2 Fatty Acids, Esters and Amides; 8.3.3 Waxes; 8.3.4 Polymeric Lubricants; 8.4 Special Applications; 8.4.1 PVC; 8.4.2 Chlorinated PVC; 8.4.3 Electically Conductive Polymers; References; 9 Antistatic Additives; 9.1 Types of Additives; 9.2 Areas of Application; 9.3 Additives in Detail
9.3.1 Conventional Additives9.3.2 Polymeric Additives; 9.3.3 External Antistatic Additives; 9.3.4 Intrinsically Antistatic Compositions; 9.3.5 Conductive Fillers; References; 10 Slip Agents; 10.1 Basic Principles of Action; 10.2 Compounds; 10.3 Special Formulations; 10.3.1 Poly(ethylene terephthalate); 10.3.2 Formulations for Poly(ethylene); References; 11 Surface Improvers; 11.1 Additives; 11.1.1 Fluorocarbon Compounds; 11.1.2 Acrylics; 11.1.3 Modified Pigments; 11.1.4 Organic Salts; References; 12 Nucleating Agents; 12.1 Crystalline Polymers; 12.1.1 Crystal Structures
12.1.2 Modification of Properties by Crystallinity
Record Nr. UNINA-9910139473103321
Fink Johannes Karl  
Hoboken, NJ, : Wiley
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
A concise introduction to additives for thermoplastic polymers [[e-book] /] / Johannes Karl Fink
A concise introduction to additives for thermoplastic polymers [[e-book] /] / Johannes Karl Fink
Autore Fink Johannes Karl
Pubbl/distr/stampa Hoboken, NJ, : Wiley
Descrizione fisica 1 online resource (284 p.)
Disciplina 668.4/23
668.9
Collana Wiley-Scrivener
Soggetto topico Polymers - Additives
Thermoplastics
ISBN 1-282-68401-9
9786612684012
0-470-62424-8
1-61344-163-0
0-470-62423-X
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto A Concise Introduction to Additives for Thermoplastic Polymers; Contents; Preface; 1 Introduction; 1.1 Classification; References; 2 Plasticizers; 2.1 Principle of Action; 2.2 Principle of Selection; 2.3 Characterization; 2.4 Risks and Drawbacks; 2.4.1 Leaching; 2.4.2 Inherent Toxicity; 2.5 Classes of Plasticizers; 2.5.1 Phthalate Plasticizers; 2.5.2 Cyclohexanoic Diesters; 2.5.3 Phophate Plasticizers; 2.5.4 Aliphatic Esters; 2.5.5 Polymeric Plasticizers; 2.5.6 Ionic Liquids; 2.6 Specific Examples of Application; 2.6.1 Heat Shrinkable Films; 2.6.2 Adhesive Compositions
2.6.3 Interlayer Films for Safety Glasses2.6.4 Electrolyte Membranes; 2.6.5 Porous Electrodes; 2.6.6 Biodegradable Polymers; 2.6.7 Plasticizers for Energetic Polymers; References; 3 Fillers; 3.1 Surface Modification; 3.1.1 Siloxanes; 3.1.2 Dispersion and Coupling Additives; 3.2 Special Applications; 3.2.1 Flame Retardant Fillers; 3.2.2 Conductive Fillers; 3.2.3 Solder Precoated Fillers; 3.2.4 Nano Clays; 3.2.5 Mixed Matrix Membranes; References; 4 Colorants; 4.1 Physics Behind a Color; 4.1.1 Human Eye; 4.1.2 Tristimulus Values; 4.1.3 Color Spaces; 4.2 Color Index; 4.3 Test Standards
4.4 Pigments4.5 Organic Colorants; References; 5 Optical Brighterners; 5.1 Basic Principles; 5.2 Measurement; 5.3 Inorganic Brighteners; 5.4 Organic Optical Brighteners; 5.4.1 Reactive Optical Brighteners; 5.4.2 Melt Extrusion; 5.4.3 Photographic Supports; References; 6 Antimicrobial Additives; 6.1 Modes of Action; 6.1.1 Types of Irritations; 6.2 Plasticizers; 6.3 Special Formulations; 6.3.1 Contact Lenses; 6.3.2 Food Packaging; 6.3.3 Polymers with Inherent Antimicrobial Properties; References; 7 Flame Retardants; 7.1 Mechanisms of Flame Retardants; 7.1.1 Flame Cooling of Halogens
7.2 Smoke Suppressants7.3 Admixed Additives; 7.4 Bonded Additives; 7.4.1 Examples of Polymers; References; 8 Lubricants; 8.1 Principle of Action; 8.2 Methods of Incorporation; 8.2.1 Conventional Method; 8.2.2 Separate Delivery of the Lubricant; 8.3 Types of Lubricants; 8.3.1 Alcohols; 8.3.2 Fatty Acids, Esters and Amides; 8.3.3 Waxes; 8.3.4 Polymeric Lubricants; 8.4 Special Applications; 8.4.1 PVC; 8.4.2 Chlorinated PVC; 8.4.3 Electically Conductive Polymers; References; 9 Antistatic Additives; 9.1 Types of Additives; 9.2 Areas of Application; 9.3 Additives in Detail
9.3.1 Conventional Additives9.3.2 Polymeric Additives; 9.3.3 External Antistatic Additives; 9.3.4 Intrinsically Antistatic Compositions; 9.3.5 Conductive Fillers; References; 10 Slip Agents; 10.1 Basic Principles of Action; 10.2 Compounds; 10.3 Special Formulations; 10.3.1 Poly(ethylene terephthalate); 10.3.2 Formulations for Poly(ethylene); References; 11 Surface Improvers; 11.1 Additives; 11.1.1 Fluorocarbon Compounds; 11.1.2 Acrylics; 11.1.3 Modified Pigments; 11.1.4 Organic Salts; References; 12 Nucleating Agents; 12.1 Crystalline Polymers; 12.1.1 Crystal Structures
12.1.2 Modification of Properties by Crystallinity
Record Nr. UNINA-9910825547203321
Fink Johannes Karl  
Hoboken, NJ, : Wiley
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Confluence of Multidisciplinary Sciences for Polymer Joining [[electronic resource] /] / by S. Arungalai Vendan, M. Natesh, Akhil Garg, Liang Gao
Confluence of Multidisciplinary Sciences for Polymer Joining [[electronic resource] /] / by S. Arungalai Vendan, M. Natesh, Akhil Garg, Liang Gao
Autore Vendan S. Arungalai
Pubbl/distr/stampa Singapore : , : Springer Singapore : , : Imprint : Springer, , 2019
Descrizione fisica 1 online resource (147 pages)
Disciplina 668.9
Soggetto topico Manufactures
Mechanics
Mechanics, Applied
Polymers
Manufacturing, Machines, Tools, Processes
Solid Mechanics
Polymer Sciences
ISBN 981-13-0626-5
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Introduction to Polymer Science -- Contemporary Issues on Thermoplastics Welding -- Polymer Welding Techniques -- Ultrasonic Welding of Polymers -- Characterization Adopted for Polymer Welding -- Case Studies -- Data Acquisition and Optimization Techniquies for USW -- Conclusions -- Appendix.
Record Nr. UNINA-9910350307303321
Vendan S. Arungalai  
Singapore : , : Springer Singapore : , : Imprint : Springer, , 2019
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Conformational analysis of polymers : methods and techniques for structure-property relationships and molecular design / / Yuji Sasanuma
Conformational analysis of polymers : methods and techniques for structure-property relationships and molecular design / / Yuji Sasanuma
Autore Sasanuma Yuji
Pubbl/distr/stampa Hoboken, New Jersey : , : John Wiley & Sons, Inc., , [2023]
Descrizione fisica 1 online resource (499 pages)
Disciplina 668.9
Soggetto topico Polymers
ISBN 1-119-71665-9
1-119-71659-4
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Cover -- Title Page -- Copyright -- Contents -- Preface -- Acknowledgments -- About the Author -- Acronyms -- Part I Fundamentals of Polymer Physical Chemistry -- Chapter 1 Stereochemistry of Polymers -- 1.1 Configuration -- 1.2 Connection Type of Monomeric Units -- 1.3 Nitrogen Inversion -- 1.4 Conformation -- 1.5 Secondary Structure -- 1.6 Double Helix -- Chapter 2 Models for Polymeric Chains -- 2.1 Spatial Configuration of Polymeric Chain -- 2.2 Freely Jointed Chain -- 2.3 Freely Rotating Chain -- 2.4 Simple Chain with Rotational Barrier -- 2.5 Gaussian Chain -- Chapter 3 Lattice Model -- 3.1 Lattice Model of Small Molecules -- 3.2 Flory-Huggins Theory -- 3.2.1 Entropy of Polymeric Chain -- 3.2.2 Enthalpy of Mixing -- 3.2.3 Chemical Potential -- 3.2.4 Excluded‐Volume Effect I -- 3.2.5 Excluded‐Volume Effect II -- 3.2.6 Phase Equilibrium -- 3.3 Intrinsic Viscosity -- 3.3.1 Stockmayer-Fixman Plot -- Exercise -- Chapter 4 Rubber Elasticity -- 4.1 Thermodynamics of Rubber Elasticity -- 4.2 Adiabatic Stretching: Gough-Joule Effect -- 4.3 Phenomenological Theory: Affine Model -- 4.4 Temperature Dependence of Chain Dimension in Rubber -- Part II Quantum Chemistry -- Chapter 5 Ab Initio Molecular Orbital Theory -- 5.1 Schrödinger Equation -- 5.2 Wave Function -- 5.3 Basis Set -- 5.4 Hartree-Fock Method -- 5.5 Roothaan-Hall Equation -- 5.6 Electron Correlation -- Chapter 6 Density Functional Theory -- 6.1 Exchange and Correlation Functionals -- 6.2 Dispersion‐force Correction -- Chapter 7 Solvent Effect -- Chapter 8 Statistical Thermodynamics for Quantum Chemistry -- 8.1 Translational Motion -- 8.2 Rotational Motion -- 8.3 Vibrational Motion -- 8.4 Electronic Excitation -- 8.5 Thermochemistry -- Chapter 9 NMR Parameters -- 9.1 Chemical Shift -- 9.1.1 Example: Determination of Reaction Process from NMR Chemical Shifts.
9.2 Indirect Spin-Spin Coupling Constant -- 9.2.1 Example 1: Calculation of Vicinal Coupling Constants of Cyclic Compound -- 9.2.2 Example 2: Derivation of Karplus Equation and Its Application -- Chapter 10 Periodic Quantum Chemistry -- 10.1 Direct Lattice and Reciprocal Lattice -- 10.2 Bloch Function -- 10.3 One‐electron Crystal Orbital -- 10.4 Structural Optimization -- 10.5 Crystal Elasticity -- 10.6 Vibrational Calculation -- 10.7 Thermal Chemistry -- 10.8 Cohesive (Interchain Interaction) Energy -- Part III Statistical Mechanics of Chain Molecules: Rotational Isomeric State Scheme -- Chapter 11 Conventional RIS Scheme -- 11.1 Chain Dimension -- Chapter 12 Refined RIS Scheme -- 12.1 RIS Scheme Including Middle‐range Intramolecular Interactions -- Chapter 13 Inversional-Rotational Isomeric State (IRIS) Scheme -- 13.1 Pseudoasymmetry for Polyamines -- 13.2 Inversional-Rotational Isomerization -- 13.3 Statistical Weight Matrices of Meso and Racemo di‐MEDA -- 13.4 Statistical Weight Matrices of PEI -- 13.5 Diad Probability and Bond Conformation -- 13.6 Characteristic Ratio -- 13.7 Orientational Correlation Between Bonds -- 13.8 Solubility of Polyamines -- Chapter 14 RIS Scheme Combined with Stochastic Process -- 14.1 Polymeric Chains with Internally Rotatable Side Chains -- Part IV Experimental Methods -- Chapter 15 Nuclear Magnetic Resonance (NMR) -- 15.1 Conformational Analysis of Isotactic Poly(propylene oxide) -- 15.1.1 1H NMR Vicinal Coupling Constant -- 15.1.2 Ab initio MO Calculation -- 15.1.3 RIS Analysis of Bond Conformations -- 15.1.4 Configuration‐dependent Properties -- 15.2 Carbon‐13 NMR Chemical Shifts of Dimeric Propylene Oxides -- 15.2.1 Theoretical Basis -- 15.2.2 13C NMR Spectra and Assignment -- 15.2.3 Calculation of Chemical Shift by RIS Scheme -- 15.3 Model Compound of Poly(ethylene terephthalate) -- Chapter 16 Scattering Methods.
16.1 Static Light Scattering (SLS) -- 16.1.1 Instrumentation and Sample Preparation for SLS -- 16.1.2 Application of SLS: Chain Dimensions of Polysilanes in the Θ State -- 16.2 Dynamic Light Scattering (DLS) -- 16.2.1 Application of DLS: Size Distribution of Polystyrene Latex Particles -- 16.2.2 Application of SLS and DLS to Poly(N‐methylethylene imine) Solutions -- 16.3 Small‐angle Neutron Scattering (SANS) -- 16.3.1 Application of SANS to Amorphous PET -- Part V Applications: Conformational Analysis and Elucidation of Structure-Property Relationships of Polymers -- Chapter 17 Polyethers -- 17.1 Poly(methylene oxide) (PMO) -- 17.2 Poly(ethylene oxide) (PEO) -- 17.3 Poly(propylene oxide) (PPO) -- 17.4 Poly(trimethylene oxide) (PTrMO) -- 17.5 Poly(tetramethylene oxide) (PTetMO) -- Chapter 18 Polyamines -- 18.1 Poly(ethylene imine) (PEI) -- 18.2 Poly(N‐methylethylene imine) (PMEI) -- 18.3 Poly(trimethylene imine) (PTMI) and Poly(N‐methyltrimethylene imine) (PMTMI) -- Chapter 19 Polyphosphines -- 19.1 Possibility of Phosphorus Inversion -- 19.2 Intramolecular Interactions Related to Phosphorus -- 19.3 RIS Calculation -- 19.4 Functions and Stability -- Chapter 20 Polysulfides -- 20.1 Poly(methylene sulfide) (PMS) -- 20.1.1 Crystal Structure of PMS -- 20.2 Poly(ethylene sulfide) (PES) -- 20.3 Poly(propylene sulfide) (PPS) -- 20.4 Poly(trimethylene sulfide) (PTrMS) -- Chapter 21 Polyselenides -- 21.1 Poly(methylene selenide) (PMSe) -- 21.1.1 Crystal Structure of PMSe -- 21.2 Poly(ethylene selenide) (PESe) -- 21.3 Poly(trimethylene selenide) (PTrMSe) -- 21.4 Summary -- Chapter 22 Alternating Copolymers Including Ethylene‐imine, Ethylene‐oxide, and Ethylene‐sulfide Units -- 22.1 Synthesis of P(EI‐ES) -- Chapter 23 Aromatic Polyester (PET, PTT, and PBT) -- 23.1 Correction for MP2 Energy of π-π Interaction -- 23.2 Dipole Moment and Molar Kerr Constant.
23.3 Configurational Properties -- 23.4 Crystal Structure -- Chapter 24 Aliphatic Polyesters -- 24.1 Poly(glycolic acid) (PGA) and Poly(2‐hydroxybutyrate) (P2HB) -- 24.1.1 MO Calculation and NMR Experiment -- 24.1.2 RIS Calculation -- 24.1.3 Periodic DFT Calculation on PGA Crystal -- 24.2 Poly(lactic acid) (Poly(lactide), PLA) -- 24.2.1 MO Calculation and NMR Experiment -- 24.2.2 RIS Calculation -- 24.3 Poly((R)‐3‐hydroxybutyrate) (P3HB) -- 24.3.1 NMR Experiment -- 24.3.2 MO Calculation -- 24.3.3 RIS Calculation and Comparison with Experiment -- 24.3.4 Crystal Structure -- 24.4 Poly(ϵ‐caprolactone) (PCL) -- 24.4.1 MO Calculation -- 24.4.2 NMR Experiment -- 24.4.3 RIS Calculation -- 24.4.4 Crystal Structure -- 24.4.5 Crystal Elasticity -- 24.5 Poly(ethylene succinate) (PES) and Poly(butylene succinate) (PBS) -- 24.5.1 NMR Experiment -- 24.5.2 MO Calculation -- 24.5.3 RIS Calculation -- 24.5.4 Crystal Structure -- 24.6 Biodegradability of Polyesters -- Chapter 25 Polycarbonates -- 25.1 Poly(ethylene carbonate) (PEC) and Poly(propylene carbonate) (PPC) -- 25.1.1 NMR Experiment -- 25.1.2 MO Calculation -- 25.1.3 RIS Calculation -- 25.2 Poly(cyclohexene carbonate) (PCHC) -- 25.2.1 MO Calculation -- 25.2.2 NMR Experiment -- 25.2.3 RIS Calculation -- 25.2.4 Coherence Number -- Chapter 26 Nylon 4 -- 26.1 MO Calculation -- 26.2 NMR Experiment -- Chapter 27 Aromatic Polyester, Polythionoester, Polythioester, Polydithioester, Polyamide, and Polythioamide -- 27.1 MO Calculation -- 27.2 Bond Conformation -- 27.3 RIS Calculation, Thermal Properties, and Solubility -- Chapter 28 Polysilanes -- 28.1 Molecular Dynamics -- 28.1.1 General Procedures -- 28.1.2 PDBS and PDHS -- 28.1.3 PMPrS -- 28.2 RIS Calculation -- 28.3 Physical Properties -- Chapter 29 Polyethylene (PE) -- A FORTRAN Computer Program for Refined RIS Calculations on Polyethylene -- B Answers of Problems.
Bibliography -- Index -- EULA.
Record Nr. UNINA-9910684599003321
Sasanuma Yuji  
Hoboken, New Jersey : , : John Wiley & Sons, Inc., , [2023]
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Construction manual for polymers + membranes : materials and semi-finished products, form-finding desing / / Jan Knippers [and three others]
Construction manual for polymers + membranes : materials and semi-finished products, form-finding desing / / Jan Knippers [and three others]
Autore Knippers Jan
Pubbl/distr/stampa Basel ; ; Munich : , : Birkhäuser : , : Detail, , 2011
Descrizione fisica 1 online resource (296 pages) : illustrations
Disciplina 668.9
Collana DETAIL Construction Manuals
Soggetto topico Polymers
Composite materials
Soggetto genere / forma Electronic books.
ISBN 3-0346-0726-1
3-0346-1470-5
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Frontmatter -- Contents -- Preface -- Part A. Polymers and membranes in architecture -- Part B. Materials -- Part C. Semi-finished products -- Part D. Planning and form-finding -- Part E. Building with polymers and membranes -- Part F. Case studies -- Part G. Appendix -- Backmatter
Record Nr. UNINA-9910452516403321
Knippers Jan  
Basel ; ; Munich : , : Birkhäuser : , : Detail, , 2011
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui
Construction manual for polymers + membranes : materials and semi-finished products, form-finding design / / Jan Knippers [and three others]
Construction manual for polymers + membranes : materials and semi-finished products, form-finding design / / Jan Knippers [and three others]
Autore Knippers Jan
Pubbl/distr/stampa Basel ; ; Munich : , : Birkhäuser : , : Detail, , 2011
Descrizione fisica 1 online resource (296 pages) : illustrations
Disciplina 668.9
Collana DETAIL Construction Manuals
Soggetto topico Polymers
Composite materials
ISBN 3-0346-0726-1
3-0346-1470-5
Classificazione ZH 4600
Formato Materiale a stampa
Livello bibliografico Monografia
Lingua di pubblicazione eng
Nota di contenuto Frontmatter -- Contents -- Preface -- Part A. Polymers and membranes in architecture -- Part B. Materials -- Part C. Semi-finished products -- Part D. Planning and form-finding -- Part E. Building with polymers and membranes -- Part F. Case studies -- Part G. Appendix -- Backmatter
Record Nr. UNINA-9910790549403321
Knippers Jan  
Basel ; ; Munich : , : Birkhäuser : , : Detail, , 2011
Materiale a stampa
Lo trovi qui: Univ. Federico II
Opac: Controlla la disponibilità qui