PSC working paper series:
Gespeichert in:
| Späterer Titel: | Population Center Working Papers (PSC/PARC) |
|---|---|
| Format: | Elektronisch Schriftenreihe |
| Sprache: | English |
| Veröffentlicht: |
Philadelphia, PA
[Population Studies Center]
2015
|
| Schlagworte: | |
| Online-Zugang: | Volltext Inhaltsverzeichnis |
| Veröffentlicht: | 2006, 1 [?]-2015, 5 |
| Beschreibung: | Gesehen am 04.09.2018 |
| Beschreibung: | Online-Ressource |
Internformat
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Datensatz im Suchindex
| _version_ | 1813695131197374464 |
|---|---|
| adam_text |
CONTENTS
1 INTRODUCTION 1
1.1 POLYMERS: A BRIEF REVIEW 2
1.2 BLOCK COPOLYMERS: MELT PHASE BEHAVIOR 4
1.2.1 STRONG SEGREGATION LIMIT THEORY 5
1.2.2 WEAK SEGREGATION LIMIT THEORY 6
1.3 COPOLYMER FILMS AND EFFECT OF NANOINCLUSIONS 7
1.4 THESIS OVERVIEW 11
2 MOLECULAR DYNAMICS SIMULATIONS: A BRIEF OVERVIEW 15
2.1 INTRODUCTION 15
2.2 COARSE GRAINED MD SIMULATION 16
2.2.1 INTERACTION POTENTIAL 17
2.2.2 EQUATIONS OF MOTION 19
2.2.3 INTEGRATING THE EQUATIONS OF MOTION 20
2.3 THERMOSTATING AND BAROSTATING 20
2.3.1 CONSTANT TEMPERATURE SIMULATIONS 21
2.3.2 CONSTANT PRESSURE SIMULATIONS 23
2.4 DESCRIPTION OF SYSTEMS UNDER INVESTIGATION 23
2.4.1 THIN FILM PREPARATION 23
2.4.2 SHEAR OF THIN FILMS 24
3 DIBLOCK-COPOLYMER AND NONSELECTIVE-NANOPARTICLE MIXTURES 29
3.1 INTRODUCTION 29
3.2 MODEL AND SIMULATION DETAILS 30
3.3 ATHERMAL CASE : NANOPARTICLE SEGREGATION AND CLUSTERING 32
3.4 THERMAL CASE : ROLE OF INTERFACES 34
3.4.1 NANOPARTICLE SEGREGATION AND UPTAKE 34
3.4.2 NANOPARTICLE SPATIAL DISTRIBUTION 37
3.5 CHAIN PROPERTIES : EFFECT OF ADDING THERMAL NANOPARTICLES 39
3.5.1 AVERAGE CHAIN SIZE 40
3.5.2 INSTANTANEOUS SHAPE 42
3.6 SUMMARY 46
3.7 APPENDIX 47
3.7.1 A SIMPLE MEAN-FIELD MODEL FOR MIXING NANO-PARTICLES AND STRONGLY
SEG
REGATED COPOLYMERS 47
3.7.2 GYRATION TENSOR AND MEASURES OF SHAPE 49
IX
HTTP://D-NB.INFO/1050943767
CONTENTS
4 DIBLOCK-COPOLYMER AND SELECTIVE-NANOPARTICLE MIXTURES 53
4.1 INTRODUCTION 53
4.2 MODEL AND SIMULATION DETAILS 54
4.3 PHASE DIAGRAM IN CONFINEMENT 55
4.4 NANOPARTICLE INDUCED HORIZONTALLY ORIENTED LAMELLAR STRUCTURE 59
4.4.1 L
V
AND LH PHASES UNDER HEATING-COOLING CYCLES: 63
4.5 DENSITY PROFILE AND CHAIN EXTENSION 66
4.6 SUMMARY 68
5 DIBLOCK-COPOLYMER AND SELECTIVE- NANOPARTICLE MIXTURES IN LAMELLAR
PHASE
: COMMENSURABILITY AND WETTING TRANSITION 71
5.1 INTRODUCTION 71
5.2 NON-SELECTIVE CONFINING WALLS : COMMENSURABILITY AND ROLE OF
NANOPARTICLES . . 72
5.2.1 MEAN-FIELD FREE ENERGY CONSTRUCTION 73
5.2.2 SYSTEM AT A FIXED FILM THICKNESS 77
5.2.3 SYSTEM UNDER THE VARIATION OF FILM THICKNESS 79
5.3 SELECTIVE CONFINING WALLS : NON-WETTING TO WETTING TRANSITION 81
5.3.1 MEAN-FIELD FREE ENERGY 81
5.3.2 NON-WETTING TO WETTING TRANSITION 82
5.4 SUMMARY 83
6 DIBLOCK COPOLYMER THIN FILMS UNDER STATIONARY SHEAR 87
6.1 INTRODUCTION 87
6.2 MODEL AND SIMULATION DETAILS 88
6.3 DIFFUSION IN EQUILIBRIUM 90
6.4 COPOLYMER THIN FILMS UNDER STATIONARY SHEAR 91
6.4.1 LAMELLAR DEFORMATION AND INTERACTION ENERGY 93
6.4.2 FLOW BEHAVIOR: LAMINAR FLOW AND CYCLIC CHAIN MOTION 98
6.4.3 MACROSCOPIC RESPONSE: FRICTION COEFFICIENT AND VISCOSITY 103
6.5 EFFECT OF ADDING NANOPARTICLES 105
6.6 SUMMARY 107
7 SUMMARY AND OUTLOOK 111 |
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| title_fullStr | PSC working paper series Population Studies Center |
| title_full_unstemmed | PSC working paper series Population Studies Center |
| title_new | Population Center Working Papers (PSC/PARC) |
| title_short | PSC working paper series |
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