Detailed atomistic Monte Carlo simulation of grafted polymer melts. I. Thermodynamic and conformational properties

Kostas Ch. Daoulas; Andreas F. Terzis; Vlasis G. Mavrantzas

doi:10.1063/1.1478055

Detailed atomistic Monte Carlo simulation of grafted polymer melts. I. Thermodynamic and conformational properties

The Journal of Chemical Physics ◽

10.1063/1.1478055 ◽

2002 ◽

Vol 116 (24) ◽

pp. 11028-11038 ◽

Cited By ~ 28

Author(s):

Kostas Ch. Daoulas ◽

Andreas F. Terzis ◽

Vlasis G. Mavrantzas

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Melts ◽

Grafted Polymer ◽

Conformational Properties

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Detailed atomistic Monte Carlo simulation of grafted polymer melts: II. Orientational order and nuclear magnetic resonance spectra

The Journal of Chemical Physics ◽

10.1063/1.1526466 ◽

2003 ◽

Vol 118 (3) ◽

pp. 1521-1532 ◽

Cited By ~ 3

Author(s):

Kostas Ch. Daoulas ◽

Vlasis G. Mavrantzas ◽

Demetri J. Photinos

Keyword(s):

Nuclear Magnetic Resonance ◽

Monte Carlo Simulation ◽

Monte Carlo ◽

Magnetic Resonance ◽

Polymer Melts ◽

Orientational Order ◽

Grafted Polymer ◽

Nuclear Magnetic Resonance Spectra ◽

Magnetic Resonance Spectra ◽

Nuclear Magnetic

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Structure and dynamics of grafted polymer layers: A Monte Carlo simulation

The Journal of Chemical Physics ◽

10.1063/1.461158 ◽

1991 ◽

Vol 95 (12) ◽

pp. 9288-9299 ◽

Cited By ~ 165

Author(s):

Pik‐Yin Lai ◽

Kurt Binder

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Layers ◽

Grafted Polymer ◽

Structure And Dynamics

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Monte Carlo simulation of a grafted polymer chain confined in a tube

The Journal of Chemical Physics ◽

10.1063/1.480704 ◽

2000 ◽

Vol 112 (3) ◽

pp. 1565-1573 ◽

Cited By ~ 26

Author(s):

P. Sotta ◽

A. Lesne ◽

J. M. Victor

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Chain ◽

Grafted Polymer

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ATOMISTIC MONTE CARLO SIMULATION STUDIES OF POLYMER MELTS GRAFTED ON SOLID SUBSTRATES

Computational Methods in Sciences and Engineering 2003 ◽

10.1142/9789812704658_0029 ◽

2003 ◽

Author(s):

K. DAOULAS ◽

V.G. MAVRANTZAS

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Melts ◽

Simulation Studies ◽

Solid Substrates

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A concerted rotation algorithm for atomistic Monte Carlo simulation of polymer melts and glasses

Molecular Physics ◽

10.1080/00268979300100641 ◽

1993 ◽

Vol 78 (4) ◽

pp. 961-996 ◽

Cited By ~ 199

Author(s):

L.R. Dodd ◽

T.D. Boone ◽

D.N. Theodorou

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Melts ◽

Concerted Rotation

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Grafted polymer layers under variable solvent conditions: A Monte Carlo simulation

Makromolekulare Chemie Macromolecular Symposia ◽

10.1002/masy.19930650121 ◽

1993 ◽

Vol 65 (1) ◽

pp. 189-198 ◽

Cited By ~ 7

Author(s):

Pik-Yin Lai ◽

Kurt Binder

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Layers ◽

Grafted Polymer

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Monte Carlo simulation of the glass transition in two‐ and three‐dimensional polymer melts: Influence of the spatial dimension

The Journal of Chemical Physics ◽

10.1063/1.467782 ◽

1994 ◽

Vol 101 (2) ◽

pp. 1616-1624 ◽

Cited By ~ 10

Author(s):

B. Lobe ◽

J. Baschnagel

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Glass Transition ◽

Polymer Melts ◽

Three Dimensional ◽

Spatial Dimension

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Dynamic Properties of Polymer Melts above the Glass Transition: Monte Carlo Simulation Results

ACS Symposium Series - Structure and Properties of Glassy Polymers ◽

10.1021/bk-1998-0710.ch004 ◽

1999 ◽

pp. 53-77

Author(s):

Jörg Baschnagel

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Glass Transition ◽

Polymer Melts ◽

Dynamic Properties ◽

Simulation Results

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Monte-Carlo Simulation of 3-Dimensional Glassy Polymer Melts: Reptation Versus Single Monomer Dynamics

Journal de Physique II ◽

10.1051/jp2:1995228 ◽

1995 ◽

Vol 5 (7) ◽

pp. 1035-1052 ◽

Cited By ~ 11

Author(s):

M. Wolfgardt ◽

J. Baschnagel ◽

K. Binder

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Polymer Melts ◽

Glassy Polymer ◽

3 Dimensional

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Monte Carlo simulation of the glass transition in polymer melts: extended mode-coupling analysis

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/7/34/002 ◽

1995 ◽

Vol 7 (34) ◽

pp. 6761-6780 ◽

Cited By ~ 22

Author(s):

J Baschnagel ◽

M Fuchs

Keyword(s):

Monte Carlo Simulation ◽

Monte Carlo ◽

Glass Transition ◽

Mode Coupling ◽

Polymer Melts ◽

Coupling Analysis

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