All Stories

  1. Numerical algorithms for solving self-consistent field theory reversely for block copolymer systems

    Article • The Journal of Chemical Physics, December 2018, American Institute of Physics

    Marcus Müller

  2. Free-energy calculation methods for collective phenomena in membranes

    Article • Journal of Physics D Applied Physics, July 2015, Institute of Physics Publishing

    Marcus Müller

  3. Defects in the Self-Assembly of Block Copolymers and Their Relevance for Directed Self-Assembly

    Article • Annual Review of Chemical and Biomolecular Engineering, July 2015, Annual Reviews

    Marcus Müller

  4. Process-directed self-assembly of block copolymers: a computer simulation study

    Article • Journal of Physics Condensed Matter, April 2015, Institute of Physics Publishing

    Marcus Müller

  5. Coarse-grained simulation of dynamin-mediated fission

    Article • Soft Matter, January 2015, Royal Society of Chemistry

    Marcus Müller

  6. Interfaces and Interphases in Dense, Polydisperse Living Polymer Systems: A Comparison Between Computer Simulation and Self-Consistent Field Theory

    Article • Soft Materials, November 2014, Taylor & Francis

    Marcus Müller

  7. Rigorous simulation and optimization of the lithography/directed self-assembly co-process

    Article • March 2014, SPIE

    Marcus Müller

  8. Computing how copolymers form nanoscale structures

    Article • SPIE Newsroom, March 2014, SPIE

    Marcus Müller

  9. Conformational Properties of Semiflexible Chains at Nematic Ordering Transitions in Thin Films: A Monte Carlo Simulation

    Article • Macromolecules, January 2014, American Chemical Society (ACS)

    Marcus Müller

  10. Directed transport of polymer drops on vibrating superhydrophobic substrates: a molecular dynamics study

    Article • Soft Matter, January 2014, Royal Society of Chemistry

    Marcus Müller

  11. Directing the Self-Assembly of Block Copolymers into A Metastable Complex Network Phase via A Deep and Rapid Quench

    Article • Physical Review Letters, December 2013, American Physical Society (APS)

    Marcus Müller

  12. Dynamical Simulations of Coarse Grain Polymeric Systems: Rouse and Entangled Dynamics

    Article • Macromolecules, August 2013, American Chemical Society (ACS)

    Marcus Müller

  13. Computational Approaches for the Dynamics of Structure Formation in Self-Assembling Polymeric Materials

    Article • Annual Review of Materials Science, July 2013, Annual Reviews

    Marcus Müller

  14. Mechanisms of Vesicle Spreading on Surfaces: Coarse-Grained Simulations

    Article • Langmuir, March 2013, American Chemical Society (ACS)

    Marcus Müller

  15. Correlation between surface topography and slippage: a Molecular Dynamics study

    Article • Soft Matter, January 2013, Royal Society of Chemistry

    Marcus Müller

  16. Fusion Proteins - Different Tools for Different Jobs?

    Article • Biophysical Journal, January 2013, Elsevier

    Marcus Müller

  17. Theoretically informed entangled polymer simulations: linear and non-linear rheology of melts

    Article • Soft Matter, January 2013, Royal Society of Chemistry

    Marcus Müller

  18. Exploring thermodynamic stability of the stalk fusion-intermediate with three-dimensional self-consistent field theory calculations

    Article • Soft Matter, January 2013, Royal Society of Chemistry

    Marcus Müller, Dr Kostas Ch Daoulas

  19. Random Block Copolymers: Structure, Dynamics, and Mechanical Properties in the Bulk and at Selective Substrates

    Article • Macromolecules, December 2012, American Chemical Society (ACS)

    Marcus Müller

  20. Translationally Invariant Slip-Spring Model for Entangled Polymer Dynamics

    Article • Physical Review Letters, October 2012, American Physical Society (APS)

    Marcus Müller

  21. Nonequilibrium Simulations of Lamellae Forming Block Copolymers under Steady Shear: A Comparison of Dissipative Particle Dynamics and Brownian Dynamics

    Article • Macromolecules, October 2012, American Chemical Society (ACS)

    Marcus Müller

  22. Geometry-Controlled Interface Localization-Delocalization Transition in Block Copolymers

    Article • Physical Review Letters, August 2012, American Physical Society (APS)

    Marcus Müller

  23. Line-Tension Controlled Mechanism for Influenza Fusion

    Article • PLoS ONE, June 2012, PLOS

    Marcus Müller

  24. Transition Path from Two Apposed Membranes to a Stalk Obtained by a Combination of Particle Simulations and String Method

    Article • Physical Review Letters, May 2012, American Physical Society (APS)

    Marcus Müller

  25. Directed Assembly of Non-equilibrium ABA Triblock Copolymer Morphologies on Nanopatterned Substrates

    Article • ACS Nano, May 2012, American Chemical Society (ACS)

    Marcus Müller

  26. Free Energy of Defects in Ordered Assemblies of Block Copolymer Domains

    Article • ACS Macro Letters, March 2012, American Chemical Society (ACS)

    Marcus Müller

  27. Test of a scaling hypothesis for the structure factor of disordered diblock copolymer melts

    Article • Soft Matter, January 2012, Royal Society of Chemistry

    Marcus Müller

  28. Properties of Random Block Copolymer Morphologies: Molecular Dynamics and Single-Chain-in-Mean-Field Simulations

    Article • Macromolecules, December 2011, American Chemical Society (ACS)

    Marcus Müller

  29. Speeding Up Intrinsically Slow Collective Processes in Particle Simulations by Concurrent Coupling to a Continuum Description

    Article • Physical Review Letters, November 2011, American Physical Society (APS)

    Marcus Müller, Dr Kostas Ch Daoulas

  30. Quasi-Block Copolymers: Design, Synthesis, and Evidence for Their Formation in Solution and in the Melt

    Article • Macromolecules, November 2011, American Chemical Society (ACS)

    Marcus Müller, Dr Kostas Ch Daoulas

  31. Studying Amphiphilic Self-assembly with Soft Coarse-Grained Models

    Article • Journal of Statistical Physics, September 2011, Springer Science + Business Media

    Marcus Müller

  32. Three-phase coexistence with sequence partitioning in symmetric random block copolymers

    Article • Physical Review E, May 2011, American Physical Society (APS)

    Marcus Müller

  33. Publisher’s Note: Curvature-Dependent Elastic Properties of Liquid-Ordered Domains Result in Inverted Domain Sorting on Uniaxially Compressed Vesicles [Phys. Rev. Lett. 106 , 148102 (2011)]

    Article • Physical Review Letters, April 2011, American Physical Society (APS)

    Marcus Müller

  34. Curvature-Dependent Elastic Properties of Liquid-Ordered Domains Result in Inverted Domain Sorting on Uniaxially Compressed Vesicles

    Article • Physical Review Letters, April 2011, American Physical Society (APS)

    Marcus Müller

  35. Polymer–solid contacts described by soft, coarse-grained models

    Article • Physical Chemistry Chemical Physics, January 2011, Royal Society of Chemistry

    Marcus Müller, Dr Kostas Ch Daoulas

  36. An Alternate Path for Fusion and its Exploration by Field-Theoretic Means

    Article • January 2011, Elsevier

    Marcus Müller

  37. Polymer Phase Separation

    Article • December 2010, World Scientific Pub Co Pte Lt

    Marcus Müller

  38. Directed Assembly of Supramolecular Copolymers in Thin Films: Thermodynamic and Kinetic Advantages

    Article • Physical Review Letters, August 2010, American Physical Society (APS)

    Marcus Müller, Dr Kostas Ch Daoulas

  39. Synthetic Hydrophilic Materials with Tunable Strength and a Range of Hydrophobic Interactions

    Article • Advanced Functional Materials, July 2010, Wiley

    Marcus Müller

  40. Computational Approaches for Structure Formation in Multicomponent Polymer Melts

    Article • April 2010, Wiley

    Marcus Müller

  41. Emerging applications of stimuli-responsive polymer materials

    Article • Nature Materials, January 2010, Springer Science + Business Media

    Marcus Müller

  42. Measuring excess free energies of self-assembled membrane structures

    Article • Faraday Discussions, January 2010, Royal Society of Chemistry

    Marcus Müller, Dr Kostas Ch Daoulas

  43. Simulations of theoretically informed coarse grain models of polymeric systems

    Article • Faraday Discussions, January 2010, Royal Society of Chemistry

    Marcus Müller

  44. Monte Carlo Simulation of Coarse Grain Polymeric Systems

    Article • Physical Review Letters, May 2009, American Physical Society (APS)

    Marcus Müller

  45. Comparison of Simulations of Lipid Membranes with Membranes of Block Copolymers

    Article • January 2009, Springer Science + Business Media

    Marcus Müller

  46. Computing free energies of interfaces in self-assembling systems

    Article • Physical Chemistry Chemical Physics, January 2009, Royal Society of Chemistry

    Marcus Müller, Dr Kostas Ch Daoulas

  47. Comparison of Simulations of Lipid Membranes with Membranes of Block Copolymers

    Article • January 2009, Springer Science + Business Media

    Marcus Müller

  48. Interfaces in Organic Field-Effect Transistors

    Article • January 2009, Springer Science + Business Media

    Marcus Müller, Dr Kostas Ch Daoulas

  49. Phase behaviour of quasi-block copolymers: A DFT-based Monte-Carlo study

    Article • Soft Matter, January 2009, Royal Society of Chemistry

    Marcus Müller, Dr Kostas Ch Daoulas

  50. Spinodal decomposition of polymer solutions: A parallelized molecular dynamics simulation

    Article • Physical Review E, September 2008, American Physical Society (APS)

    Marcus Müller

  51. Monte Carlo Simulations of a Coarse Grain Model for Block Copolymers and Nanocomposites

    Article • Macromolecules, June 2008, American Chemical Society (ACS)

    Marcus Müller, Dr Kostas Ch Daoulas

  52. Hierarchical Assembly of Nanoparticle Superstructures from Block Copolymer-Nanoparticle Composites

    Article • Physical Review Letters, April 2008, American Physical Society (APS)

    Marcus Müller, Dr Kostas Ch Daoulas

  53. Rapid Directed Assembly of Block Copolymer Films at Elevated Temperatures

    Article • Macromolecules, April 2008, American Chemical Society (ACS)

    Marcus Müller

  54. Liquid–Liquid and Liquid–Vapor Interfaces in Polymeric Systems

    Article • January 2008, Springer Science + Business Media

    Marcus Müller

  55. Directed Copolymer Assembly on Chemical Substrate Patterns:  A Phenomenological and Single-Chain-in-Mean-Field Simulations Study of the Influence of Roughness in the Substrate Pattern

    Article • Langmuir, December 2007, American Chemical Society (ACS)

    Marcus Müller, Dr Kostas Ch Daoulas

  56. Directed Self-Assembly of Block Copolymers for Nanolithography: Fabrication of Isolated Features and Essential Integrated Circuit Geometries

    Article • ACS Nano, October 2007, American Chemical Society (ACS)

    Marcus Müller, Dr Kostas Ch Daoulas

  57. Properties of the Ising magnet confined in a corner geometry

    Article • Applied Surface Science, October 2007, Elsevier

    Marcus Müller

  58. Monte Carlo simulations of phase transitions of systems in nanoscopic confinement

    Article • Computer Physics Communications, July 2007, Elsevier

    Marcus Müller, Dr. Andrey Ivanov Milchev

  59. Ordering of Diblock Copolymer Materials on Patterned Substrates: a Single Chain in Mean Field Simulation Study

    Article • Macromolecular Symposia, May 2007, Wiley

    Marcus Müller

  60. Properties of the interface in the confined Ising magnet with competing surface fields

    Article • Physica B Condensed Matter, February 2007, Elsevier

    Marcus Müller

  61. Dimensions and Shapes of Block Copolymer Domains Assembled on Lithographically Defined Chemically Patterned Substrates

    Article • Macromolecules, December 2006, American Chemical Society (ACS)

    Marcus Müller

  62. Memory of Surface Patterns in Mixed Polymer Brushes:  Simulation and Experiment

    Article • Langmuir, December 2006, American Chemical Society (ACS)

    Marcus Müller

  63. Directed assembly of copolymer materials on patterned substrates: Balance of simple symmetries in complex structures

    Article • Journal of Polymer Science Part B Polymer Physics, August 2006, Wiley

    Marcus Müller, Dr Kostas Ch Daoulas

  64. Simulation estimates of cloud points of polydisperse fluids

    Article • Physical Review E, April 2006, American Physical Society (APS)

    Marcus Müller

  65. Interplay Between Wetting and Phase Behavior in Binary Polymer Films and Wedges: Monte Carlo Simulations and Mean Field Calculations

    Article • International Journal of Thermophysics, March 2006, Springer Science + Business Media

    Marcus Müller

  66. Study of the dynamic growth of wetting layers in the confined Ising model with competing surface fields

    Article • Journal of Physics Condensed Matter, February 2006, Institute of Physics Publishing

    Marcus Müller

  67. How Well Can Coarse-Grained Models of Real Polymers Describe Their Structure? The Case of Polybutadiene

    Article • Journal of Chemical Theory and Computation, February 2006, American Chemical Society (ACS)

    Marcus Müller

  68. Fabrication of Complex Three-Dimensional Nanostructures from Self-Assembling Block Copolymer Materials on Two-Dimensional Chemically Patterned Templates with Mismatched Symmetry

    Article • Physical Review Letters, January 2006, American Physical Society (APS)

    Marcus Müller, Dr Kostas Ch Daoulas

  69. Observation of autophobic dewetting on polymer brushes from computer simulation

    Article • Journal of Physics Condensed Matter, October 2005, Institute of Physics Publishing

    Luis G, MacDowell, Marcus Müller

  70. Mechanism and kinetics of ordering in diblock copolymer thin films on chemically nanopatterned substrates

    Article • Journal of Polymer Science Part B Polymer Physics, October 2005, Wiley

    Marcus Müller

  71. Study of the confined Ising magnet with long-range competing boundary fields

    Article • Journal of Physics Condensed Matter, July 2005, Institute of Physics Publishing

    Marcus Müller

  72. Equilibrium Phase Behavior of Polybutadiene/Polyisoprene Films:  Binodals and Spinodals

    Article • Macromolecules, May 2005, American Chemical Society (ACS)

    Marcus Müller

  73. Polymer + Solvent Systems: Phase Diagrams, Interface Free Energies, and Nucleation

    Article • January 2005, Springer Science + Business Media

    Luis G, MacDowell, Marcus Müller

  74. The Bond Fluctuation Model and Other Lattice Models

    Article • January 2005, Springer Science + Business Media

    Marcus Müller

  75. The Bond Fluctuation Model and Other Lattice Models

    Article • January 2005, Springer Science + Business Media

    Marcus Müller

  76. Artificial multiple criticality and phase equilibria: an investigation of the PC-SAFT approach

    Article • Physical Chemistry Chemical Physics, January 2005, Royal Society of Chemistry

    Marcus Müller

  77. Phase Behavior of Ultrathin Polymer Mixtures

    Article • Macromolecules, August 2004, American Chemical Society (ACS)

    Marcus Müller

  78. Mixed Polymer Brushes: Switching of Surface Behavior and Chemical Patterning at the Nanoscale

    Article • July 2004, Wiley

    Marcus Müller

  79. Study of the dynamical approach to the interface localization–delocalization transition of the confined Ising model

    Article • Journal of Physics Condensed Matter, May 2004, Institute of Physics Publishing

    Marcus Müller

  80. Phase separation kinetics in compressible polymer solutions: computer simulation of the early stages

    Article • New Journal of Physics, January 2004, Institute of Physics Publishing

    Marcus Müller, Luis G, MacDowell

  81. Simulation of Transport in Partially Miscible Binary Fluids: Combination of Semigrandcanonical Monte Carlo and Molecular Dynamics Methods

    Article • January 2004, Springer Science + Business Media

    Marcus Müller

  82. Phase Transformation

    Article • October 2003, Wiley

    Marcus Müller

  83. Bidisperse Mixed Brushes:  Synthesis and Study of Segregation in Selective Solvent

    Article • Macromolecules, August 2003, American Chemical Society (ACS)

    Marcus Müller

  84. Two-Level Structured Self-Adaptive Surfaces with Reversibly Tunable Properties

    Article • Journal of the American Chemical Society, March 2003, American Chemical Society (ACS)

    Marcus Müller

  85. Interplay between wetting and miscibility in thin binary polymer films

    Article • Computer Physics Communications, August 2002, Elsevier

    Marcus Müller

  86. FLAT HISTOGRAM METHOD OF WANG–LANDAU AND N-FOLD WAY

    Article • International Journal of Modern Physics C, May 2002, World Scientific Pub Co Pte Lt

    Marcus Müller

  87. Mesoscopic and continuum models

    Article • October 2001, Taylor & Francis

    Marcus Müller

  88. Spinodal decomposition in a binary polymer mixture: Dynamic self-consistent-field theory and Monte Carlo simulations

    Article • September 2001, American Physical Society (APS)

    Marcus Müller

  89. Symmetric binary polymer blends confined in thin films between competing walls: Interplay between finite size and wetting behavior

    Article • Physical Chemistry Chemical Physics, January 2001, Royal Society of Chemistry

    Marcus Müller

  90. COMPUTER SIMULATION OF PROFILES OF INTERFACES BETWEEN COEXISTING PHASES: DO WE UNDERSTAND THEIR FINITE SIZE EFFECTS?

    Article • International Journal of Modern Physics C, September 2000, World Scientific Pub Co Pte Lt

    Marcus Müller

  91. Monte Carlo investigations of phase transitions: status and perspectives

    Article • Physica A Statistical Mechanics and its Applications, June 2000, Elsevier

    Marcus Müller

  92. Interfaces between coexisting phases in polymer mixtures: What can we learn from Monte Carlo simulations?

    Article • Macromolecular Symposia, April 1999, Wiley

    Marcus Müller

  93. MONTE CARLO SIMULATIONS OF INTERFACES IN POLYMER BLENDS

    Article • March 1999, World Scientific Pub Co Pte Lt

    Marcus Müller

  94. Interfaces in partly compatible polymer mixtures: a Monte-Carlo simulation approach

    Article • Physica A Statistical Mechanics and its Applications, January 1998, Elsevier

    Marcus Müller

  95. Anomalous size-dependence of interfacial profiles between coexisting phases of polymer mixtures in thin-film geometry: A Monte Carlo simulation

    Article • The Journal of Chemical Physics, November 1997, American Institute of Physics

    Marcus Müller

  96. Interfaces between coexisting phases of polymer mixtures: Comparison between Monte Carlo simulations and theoretical predictions

    Article • Macromolecular Symposia, February 1997, Wiley

    Marcus Müller

  97. Polymeric Alloys: Model Materials for the Understanding of the Statistical Thermodynamics of Mixtures

    Article • January 1997, Springer Science + Business Media

    Marcus Müller

  98. An algorithm for the semi-grand-canonical simulation of asymmetric polymer mixtures

    Article • Computer Physics Communications, November 1994, Elsevier

    Marcus Müller

  99. Incorporating Fluctuations and Dynamics in Self-Consistent Field Theories for Polymer Blends

    Article • Springer Science + Business Media

    Marcus Müller

  100. Monte Carlo Simulations of Semi-Flexible Polymers

    Article • Springer Science + Business Media

    Marcus Müller