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Zhang, Jianguo ; Milzetti, Jasmin ; Leroy, Frederic ; Mueller-Plathe, Florian :
Formation of coffee-stain patterns at the nanoscale: The role of nanoparticle solubility and solvent evaporation rate.
[Online-Edition: http://dx.doi.org/10.1063/1.4978284]
In: Journal of Chemical Physics, 146 (11) ISSN 0021-9606
[Artikel], (2017)

Eslami, Hossein ; Khanjari, Neda ; Mueller-Plathe, Florian :
A Local Order Parameter-Based Method for Simulation of Free Energy Barriers in Crystal Nucleation.
[Online-Edition: http://dx.doi.org/10.1021/acs.jctc.6b01034]
In: Journal of Chemical Theory and Computation, 13 (3) pp. 1307-1316. ISSN 1549-9618
[Artikel], (2017)

Liu, Shengyuan ; Pfaller, Sebastian ; Rahimi, Mohammad ; Possart, Gunnar ; Steinmann, Paul ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Uniaxial deformation of polystyrene-silica nanocomposites studied by hybrid molecular dynamics-finite element simulations.
[Online-Edition: http://dx.doi.org/10.1016/j.commatsci.2016.11.031]
In: Computational Materials Science, 129 pp. 1-12. ISSN 0927-0256
[Artikel], (2017)

Yang, Yong-Biao ; Rahimi, Mahshid ; Singh, Jayant K. ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Adsorption and Condensation of SO2 in Double-Walled Carbon Nanotube Arrays Studied by Monte Carlo Simulations and Simple Analytical Models.
[Online-Edition: http://dx.doi.org/10.1021/acs.jpcc.5b08910]
In: Journal of Physical Chemistry C, 120 (14) pp. 7510-7521. ISSN 1932-7447
[Artikel], (2016)

Yang, Hua ; Zhang, Jianguo ; Mueller-Plathe, Florian :
Extending reverse nonequilibrium molecular dynamics to the calculation of mutual diffusion coefficients in molecular fluid mixtures.
[Online-Edition: http://dx.doi.org/10.1080/08927022.2015.1114178]
In: Molecular Simulation, 42 (16) pp. 1379-1384. ISSN 0892-7022
[Artikel], (2016)

De Nicola, Antonio ; Kawakatsu, Toshihiro ; Mueller-Plathe, Florian ; Milano, Giuseppe :
Fast relaxation of coarse-grained models of polymer interphases by hybrid particle-field molecular dynamics: Polystyrene-silica nanocomposites as an example.
[Online-Edition: http://dx.doi.org/10.1140/epjst/e2016-60127-0]
In: European Physical Journal-Special Topics, 225 (8-9) pp. 1817-1841. ISSN 1951-6355
[Artikel], (2016)

Metya, Atanu K. ; Singh, Jayant K. ; Mueller-Plathe, Florian :
Ice nucleation on nanotextured surfaces: the influence of surface fraction, pillar height and wetting states.
[Online-Edition: http://dx.doi.org/10.1039/c6cp04382h]
In: Physical Chemistry Chemical Physics, 18 (38) pp. 26796-26806. ISSN 1463-9076
[Artikel], (2016)

Gao, Yangyang ; Mueller-Plathe, Florian :
Increasing the Thermal Conductivity of Graphene-Polyamide-6,6 Nanocomposites by Surface-Grafted Polymer Chains: Calculation with Molecular Dynamics and Effective-Medium Approximation.
[Online-Edition: http://dx.doi.org/10.1021/acs.jpcb.5b08398]
In: Journal of Physical Chemistry B, 120 (7) pp. 1336-1346. ISSN 1520-6106
[Artikel], (2016)

Voyiatzis, Evangelos ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Influence of nanoparticle inclusion on the cavity size distribution and accessible volume in polystyrene - Silica nanocomposites.
[Online-Edition: http://dx.doi.org/10.1016/j.polymer.2016.08.042]
In: Polymer, 101 pp. 107-118. ISSN 0032-3861
[Artikel], (2016)

Pfaller, Sebastian ; Possart, Gunnar ; Steinmann, Paul ; Rahimi, Mohammad ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Investigation of interphase effects in silica-polystyrene nanocomposites based on a hybrid molecular-dynamics-finite-element simulation framework.
[Online-Edition: http://dx.doi.org/10.1103/PhysRevE.93.052505]
In: Physical Review E, 93 (5) ISSN 2470-0045
[Artikel], (2016)

Masubuchi, Yuichi ; Langeloth, Michael ; Boehm, Michael C. ; Inoue, Tadashi ; Mueller-Plathe, Florian :
A Multichain Slip-Spring Dissipative Particle Dynamics Simulation Method for Entangled Polymer Solutions.
[Online-Edition: http://dx.doi.org/10.1021/acs.macromol.6b01971]
In: Macromolecules, 49 (23) pp. 9186-9191. ISSN 0024-9297
[Artikel], (2016)

Rahimi, Mahshid ; Singh, Jayant K. ; Mueller-Plathe, Florian :
CO2 Adsorption on Charged Carbon Nanotube Arrays: A Possible Functional Material for Electric Swing Adsorption.
[Online-Edition: http://dx.doi.org/10.1021/acs.jpcc.5b02874]
In: Journal of Physical Chemistry C, 119 (27) pp. 15232-15239. ISSN 1932-7447
[Artikel], (2015)

Rahimi, Mahshid ; Babu, Deepu J. ; Singh, Jayant K. ; Yang, Yong-Biao ; Schneider, Joerg J. ; Mueller-Plathe, Florian :
Double-walled carbon nanotube array for CO2 and SO2 adsorption.
[Online-Edition: http://dx.doi.org/10.1063/1.4929609]
In: Journal of Chemical Physics, 143 (12) ISSN 0021-9606
[Artikel], (2015)

Rahimi, Mahshid ; Babu, Deepu J. ; Singh, Jayant K. ; Yang, Yong-Biao ; Schneider, Joerg J. ; Mueller-Plathe, Florian :
Double-walled carbon nanotube array for CO2 and SO2 adsorption (vol 143, 124701, 2015).
[Online-Edition: http://dx.doi.org/10.1063/1.4935057]
In: Journal of Chemical Physics, 143 (16) ISSN 0021-9606
[Artikel], (2015)

Leroy, Frederic ; Mueller-Plathe, Florian :
Dry-Surface Simulation Method for the Determination of the Work of Adhesion of Solid-Liquid Interfaces.
[Online-Edition: http://dx.doi.org/10.1021/acs.langmuir.5b01394]
In: Langmuir, 31 (30) pp. 8335-8345. ISSN 0743-7463
[Artikel], (2015)

Zhang, Jianguo ; Mueller-Plathe, Florian ; Leroy, Frederic :
Pinning of the Contact Line during Evaporation on Heterogeneous Surfaces: Slowdown or Temporary Immobilization? Insights from a Nanoscale Study.
[Online-Edition: http://dx.doi.org/10.1021/acs.langmuir.5b01097]
In: Langmuir, 31 (27) pp. 7544-7552. ISSN 0743-7463
[Artikel], (2015)

Zhang, Kai ; Geissler, Andreas ; Chen, Xuelian ; Rosenfeldt, Sabine ; Yang, Yongbiao ; Foerster, Stephan ; Mueller-Plathe, Florian :
Polymeric Flower-Like Microparticles from Self-Assembled Cellulose Stearoyl Esters.
In: Acs Macro Letters, 4 (2) pp. 214-219. ISSN 2161-1653
[Artikel], (2015)

Liu, Shengyuan ; Gerisch, Alf ; Rahimi, Mohammad ; Lang, Jens ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Robustness of a new molecular dynamics-finite element coupling approach for soft matter systems analyzed by uncertainty quantification.
In: Journal of Chemical Physics, 142 (10) ISSN 0021-9606
[Artikel], (2015)

Sugii, Taisuke ; Ishii, Eiji ; Mueller-Plathe, Florian :
Solubility of Carbon Dioxide in Pentaerythritol Hexanoate: Molecular Dynamics Simulation of a Refrigerant-Lubricant Oil System.
[Online-Edition: http://dx.doi.org/10.1021/acs.jpcb.5b06459]
In: Journal of Physical Chemistry B, 119 (37) pp. 12274-12280. ISSN 1520-6106
[Artikel], (2015)

Voyiatzis, Evangelos ; Boehm, Michael C. ; Mueller-Plathe, Florian :
A geometric approach to identify cavities in particle systems.
[Online-Edition: http://dx.doi.org/10.1016/j.cpc.2015.06.011]
In: Computer Physics Communications, 196 pp. 247-254. ISSN 0010-4655
[Artikel], (2015)

Langeloth, Michael ; Sugii, Taisuke ; Boehm, Michael C. ; Mueller-Plathe, Florian :
The glass transition in cured epoxy thermosets: A comparative molecular dynamics study in coarse-grained and atomistic resolution.
[Online-Edition: http://dx.doi.org/10.1063/1.4937627]
In: Journal of Chemical Physics, 143 (24) ISSN 0021-9606
[Artikel], (2015)

Yang, Hua ; Zhang, Jianguo ; Mueller-Plathe, Florian ; Yang, Yongbiao :
A reverse nonequilibrium molecular dynamics method for calculating the mutual diffusion coefficient for binary fluids.
In: Chemical Engineering Science, 130 pp. 1-7. ISSN 0009-2509
[Artikel], (2015)

Riccardi, Enrico ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Molecular dynamics approach to locally resolve elastic constants in nanocomposites and thin films: Mechanical description of solid-soft matter interphases via Young's modulus, Poisson's ratio and shear modulus.
In: European Physical Journal E, 37
[Artikel], (2014)

Korbus, Michael ; Balasubramanian, Ganesh ; Mueller-Plathe, Florian ; Kolmar, Harald ; Meyer-Almes, Franz-Josef :
Azobenzene switch with a long-lived cis-state to photocontrol the enzyme activity of a histone deacetylase-like amidohydrolase.
In: Biological Chemistry, 395 pp. 401-412.
[Artikel], (2014)

Butler, Simon N. ; Mueller-Plathe, Florian :
Nanostructures of ionic liquids do not break up under shear: A molecular dynamics study.
In: Journal of Molecular Liquids, 192 pp. 114-117.
[Artikel], (2014)

Singh, Jayant K. ; Mueller-Plathe, Florian :
On the characterization of crystallization and ice adhesion on smooth and rough surfaces using molecular dynamics.
In: Applied Physics Letters, 104
[Artikel], (2014)

Voyiatzis, Evangelos ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Excess entropy scaling for the segmental and global dynamics of polyethylene melts.
In: Physical Chemistry Chemical Physics, 16 pp. 24301-24311.
[Artikel], (2014)

Langeloth, Michael ; Sugii, Taisuke ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Formation of the Interphase of a Cured Epoxy Resin Near a Metal Surface: Reactive Coarse-Grained Molecular Dynamics Simulations.
In: Soft Materials, 12 S71-S79. ISSN 1539-445X
[Artikel], (2014)

Voyiatzis, Evangelos ; Rahimi, Mohammad ; Mueller-Plathe, Florian ; Boehm, Michael C. :
How Thick Is the Polymer Interphase in Nanocomposites? Probing It by Local Stress Anisotropy and Gas Solubility.
In: Macromolecules, 47 (22) pp. 7878-7889. ISSN 0024-9297
[Artikel], (2014)

Ramirez, Rafael ; Singh, Jayant K. ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Ice and water droplets on graphite: A comparison of quantum and classical simulations.
In: Journal of Chemical Physics, 141 (20) ISSN 0021-9606
[Artikel], (2014)

Langeloth, Michael ; Masubuchi, Yuichi ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Reptation and constraint release dynamics in bidisperse polymer melts.
In: Journal of Chemical Physics, 141 (19) ISSN 0021-9606
[Artikel], (2014)

Davydov, Denis ; Voyiatzis, Evangelos ; Chatzigeorgiou, George ; Liu, Shengyuan ; Steinmann, Paul ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Size Effects in a Silica-Polystyrene Nanocomposite: Molecular Dynamics and Surface-enhanced Continuum Approaches.
In: Soft Materials, 12 S142-S151. ISSN 1539-445X
[Artikel], (2014)

Mueller-Plathe, Florian :
Special Issue Polymer Interfaces and Interphases.
In: Soft Materials, 12 S1-S3. ISSN 1539-445X
[Artikel], (2014)

Zhang, Zidan ; Wang, Long ; Wang, Zilu ; He, Xuehao ; Chen, Yu ; Mueller-Plathe, Florian ; Boehm, Michael C. :
A coarse-grained molecular dynamics - reactive Monte Carlo approach to simulate hyperbranched polycondensation.
In: Rsc Advances, 4 pp. 56625-56636.
[Artikel], (2014)

Voyiatzis, Evangelos ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Do Transport Properties of Entangled Linear Polymers Scale with Excess Entropy?
In: Macromolecules, 46 pp. 8710-8723.
[Artikel], (2013)

Eslami, Hossein ; Rahimi, Mohammad ; Mueller-Plathe, Florian :
Molecular Dynamics Simulation of a Silica Nanoparticle in Oligomeric Poly(methyl methacrylate): A Model System for Studying the lnterphase Thickness in a Polymer-Nanocomposite via Different Properties.
In: Macromolecules, 46 pp. 8680-8692.
[Artikel], (2013)

Mueller-Plathe, Florian :
Multiscale simulation of soft matter: Possibilities and challenges.
In: Abstracts of Papers of the American Chemical Society, 246
[Artikel], (2013)

Eslami, Hossein ; Kesik, Melis ; Karimi-Varzaneh, Hossein Ali ; Mueller-Plathe, Florian :
Sorption and diffusion of carbon dioxide and nitrogen in poly(methyl methacrylate).
In: Journal of Chemical Physics, 139
[Artikel], (2013)

Zhang, Jianguo ; Leroy, Frederic ; Mueller-Plathe, Florian :
Evaporation of Nanodroplets on Heated Substrates: A Molecular Dynamics Simulation Study.
In: Langmuir, 29 pp. 9770-9782.
[Artikel], (2013)

Rahimi, Mahshid ; Singh, Jayant K. ; Babu, Deepu J. ; Schneider, Joerg J. ; Mueller-Plathe, Florian :
Understanding Carbon Dioxide Adsorption in Carbon Nanotube Arrays: Molecular Simulation and Adsorption Measurements.
In: Journal of Physical Chemistry C, 117 pp. 13492-13501.
[Artikel], (2013)

Eslami, Hossein ; Mueller-Plathe, Florian :
How Thick is the Interphase in an Ultrathin Polymer Film? Coarse-Grained Molecular Dynamics Simulations of Polyamide-6,6 on Graphene.
In: Journal of Physical Chemistry C, 117 pp. 5249-5257.
[Artikel], (2013)

Langeloth, Michael ; Masubuchi, Yuichi ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Recovering the reptation dynamics of polymer melts in dissipative particle dynamics simulations via slip-springs.
In: Journal of Chemical Physics, 138
[Artikel], (2013)

Balasubramanian, Ganesh ; Schulte, Joachim ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Structural and thermochemical properties of a photoresponsive spiropyran and merocyanine pair: Basis set and solvent dependence in density functional predictions.
In: Chemical Physics Letters, 554 pp. 60-66.
[Artikel], (2012)

Leroy, Frederic ; Mueller-Plathe, Florian :
Can Continuum Thermodynamics Characterize Wenzel Wetting States of Water at the Nanometer Scale?
In: Journal of Chemical Theory and Computation, 8 pp. 3724-3732.
[Artikel], (2012)

Riccardi, Enrico ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Molecular dynamics method to locally resolve Poisson's ratio: Mechanical description of the solid-soft-matter interphase.
In: Physical Review E, 86
[Artikel], (2012)

Rahimi, Mohammad ; Iriarte-Carretero, Irene ; Ghanbari, Azadeh ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Mechanical behavior and interphase structure in a silica-polystyrene nanocomposite under uniaxial deformation.
In: Nanotechnology, 23
[Artikel], (2012)

Butler, Simon N. ; Mueller-Plathe, Florian :
A Molecular Dynamics Study of Viscosity in Ionic Liquids Directed by Quantitative Structure-Property Relationships.
In: ChemPhysChem, 13 pp. 1791-1801.
[Artikel], (2012)

Farah, Karim ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Classical Reactive Molecular Dynamics Implementations: State of the Art.
In: ChemPhysChem, 13 pp. 1127-1151.
[Artikel], (2012)

Ndoro, Tinashe V. M. ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Interface and Interphase Dynamics of Polystyrene Chains near Grafted and Ungrafted Silica Nanoparticles.
In: Macromolecules, 45 pp. 171-179.
[Artikel], (2012)

Ghanbari, Azadeh ; Ndoro, Tinashe V. M. ; Leroy, Frederic ; Rahimi, Mohammad ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Interphase Structure in Silica-Polystyrene Nanocomposites: A Coarse-Grained Molecular Dynamics Study.
In: Macromolecules, 45 pp. 572-584.
[Artikel], (2012)

Karimi-Varzaneh, Hossein Ali ; Mueller-Plathe, Florian :
Coarse-Grained Modeling for Macromolecular Chemistry.
In: Multiscale Molecular Methods in Applied Chemistry. Topics in Current Chemistry, 307. , pp. 295-321.
[Buchkapitel], (2012)

Algaer, Elena A. ; Mueller-Plathe, Florian :
Molecular dynamics calculations of the thermal conductivity of molecular liquids, polymers, and carbon nanotubes.
In: Soft Materials, 10 pp. 42-80.
[Artikel], (2012)

Farah, Karim ; Langeloth, Michael ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Surface-Induced Interphases During Curing Processes Between Bi- and Pentafunctional Components: Reactive Coarse-Grained Molecular Dynamics Simulations.
In: Journal of Adhesion, 88 pp. 903-923.
[Artikel], (2012)

Alaghemandi, Mohammad ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Thermal conductivity of carbon nanotube-polyamide-6,6 nanocomposites: Reverse non-equilibrium molecular dynamics simulations.
In: Journal of Chemical Physics, 135
[Artikel], (2011)

Farah, Karim ; Leroy, Frederic ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Interphase Formation during Curing: Reactive Coarse Grained Molecular Dynamics Simulations.
In: Journal of Physical Chemistry C, 115 pp. 16451-16460.
[Artikel], (2011)

Eslami, Hossein ; Mueller-Plathe, Florian :
Molecular Dynamics Simulation of Water Influence on Local Structure of Nanoconfined Polyamide-6,6.
In: Journal of Physical Chemistry B, 115 pp. 9720-9731.
[Artikel], (2011)

Ghanbari, Azadeh ; Boehm, Michael C. ; Mueller-Plathe, Florian :
A Simple Reverse Mapping Procedure for Coarse-Grained Polymer Models with Rigid Side Groups.
In: Macromolecules, 44 pp. 5520-5526.
[Artikel], (2011)

Karimi-Varzaneh, Hossein Ali ; Qian, Hu-Jun ; Chen, Xiaoyu ; Carbone, Paola ; Mueller-Plathe, Florian :
IBIsCO: A Molecular Dynamics Simulation Package for Coarse-Grained Simulation.
In: Journal of Computational Chemistry, 32 pp. 1475-1487.
[Artikel], (2011)

Eslami, Hossein ; Karimi-Varzaneh, Hossein Ali ; Mueller-Plathe, Florian :
Coarse-Grained Computer Simulation of Nanoconfined Polyamide-6,6.
In: Macromolecules, 44 pp. 3117-3128.
[Artikel], (2011)

Ndoro, Tinashe V. M. ; Voyiatzis, Evangelos ; Ghanbari, Azadeh ; Theodorou, Doros N. ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Interface of Grafted and Ungrafted Silica Nanoparticles with a Polystyrene Matrix: Atomistic Molecular Dynamics Simulations.
In: Macromolecules, 44 pp. 2316-2327.
[Artikel], (2011)

Rahimi, Mohammad ; Karimi-Varzaneh, Hossein Ali ; Boehm, Michael C. ; Mueller-Plathe, Florian ; Pfaller, Sebastian ; Possart, Gunnar ; Steinmann, Paul :
Nonperiodic stochastic boundary conditions for molecular dynamics simulations of materials embedded into a continuum mechanics domain.
In: Journal of Chemical Physics, 134
[Artikel], (2011)

Kohagen, Miriam ; Brehm, Martin ; Thar, Jens ; Zhao, Wei ; Mueller-Plathe, Florian ; Kirchner, Barbara :
Performance of Quantum Chemically Derived Charges and Persistence of Ion Cages in Ionic Liquids. A Molecular Dynamics Simulations Study of 1-n-Butyl-3-methylimidazolium Bromide.
In: Journal of Physical Chemistry B, 115 pp. 693-702.
[Artikel], (2011)

Alaghemandi, Mohammad ; Schulte, Joachim ; Leroy, Frederic ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Correlation between Thermal Conductivity and Bond Length Alternation in Carbon Nanotubes: A Combined Reverse Nonequilibrium Molecular Dynamics-Crystal Orbital Analysis.
In: Journal of Computational Chemistry, 32 pp. 121-133.
[Artikel], (2011)

Leroy, Frederic ; Mueller-Plathe, Florian :
Rationalization of the Behavior of Solid-Liquid Surface Free Energy of Water in Cassie and Wenzel Wetting States on Rugged Solid Surfaces at the Nanometer Scale.
In: Langmuir, 27 pp. 637-645.
[Artikel], (2011)

Farah, Karim ; Fogarty, Aoife Catherine ; Boehm, Michael Christian ; Mueller-Plathe, Florian :
Temperature dependence of coarse-grained potentials for liquid hexane.
In: Physical Chemistry Chemical Physics, 13 pp. 2894-2902.
[Artikel], (2011)

Farah, Karim ; Karimi-Varzaneh, Hossein A. ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Reactive Molecular Dynamics with Material-Specific Coarse-Grained Potentials: Growth of Polystyrene Chains from Styrene Monomers.
In: Journal of Physical Chemistry B, 114 pp. 13656-13666.
[Artikel], (2010)

Sarangi, Soumya S. ; Zhao, Wei ; Mueller-Plathe, Florian ; Balasubramanian, Sundaram :
Correlation between Dynamic Heterogeneity and Local Structure in a Room-Temperature Ionic Liquid: A Molecular Dynamics Study of bmim PF6.
In: ChemPhysChem, 11 pp. 2001-2010.
[Artikel], (2010)

Heggen, Berit ; Zhao, Wei ; Leroy, Frederic ; Dammers, Anton J. ; Mueller-Plathe, Florian :
Interfacial Properties of an Ionic Liquid by Molecular Dynamics.
In: Journal of Physical Chemistry B, 114 pp. 6954-6961.
[Artikel], (2010)

Weiss, Volker C. ; Heggen, Berit ; Mueller-Plathe, Florian :
Critical Parameters and Surface Tension of the Room Temperature Ionic Liquid bmim PF6 : A Corresponding-States Analysis of Experimental and New Simulation Data.
In: Journal of Physical Chemistry C, 114 pp. 3599-3608.
[Artikel], (2010)

Alaghemandi, Mohammad ; Leroy, Frederic ; Mueller-Plathe, Florian ; Boehm, Michael C. :
Thermal rectification in nanosized model systems: A molecular dynamics approach.
In: Physical Review B, 81
[Artikel], (2010)

Alaghemandi, Mohammad ; Leroy, Frederic ; Algaer, Elena ; Boehm, Michael C. ; Mueller-Plathe, Florian :
Thermal rectification in mass-graded nanotubes: a model approach in the framework of reverse non-equilibrium molecular dynamics simulations.
In: Nanotechnology, 21
[Artikel], (2010)

Carbone, Paola ; Karimi-Varzaneh, Hossein Ali ; Mueller-Plathe, Florian :
Fine-graining without coarse-graining: an easy and fast way to equilibrate dense polymer melts.
In: Faraday Discussions, 144 pp. 25-42.
[Artikel], (2010)

Karimi-Varzaneh, Hossein Ali ; Mueller-Plathe, Florian ; Balasubramanian, Sundaram ; Carbone, Paola :
Studying long-time dynamics of imidazolium-based ionic liquids with a systematically coarse-grained model.
In: Physical Chemistry Chemical Physics, 12 pp. 4714-4724.
[Artikel], (2010)

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