{"id":130,"date":"2024-12-24T04:42:32","date_gmt":"2024-12-24T02:42:32","guid":{"rendered":"http:\/\/mcms.tem.uoc.gr\/?page_id=130"},"modified":"2024-12-26T09:28:18","modified_gmt":"2024-12-26T07:28:18","slug":"publications","status":"publish","type":"page","link":"https:\/\/macomms.tem.uoc.gr\/index.php\/publications\/","title":{"rendered":"Selected Publications"},"content":{"rendered":"\n

Publications in Refereed Journals<\/h2>\n\n\n\n
    \n
  1. A. F. Behbahani, S.M. Vaez Allaei, G.H. Motlagh, H. Eslami and V. Harmandaris, \u201cStructure and dynamics of stereo\u2010regular poly(methyl\u2010methacrylate) melts through atomistic molecular dynamics simulations\u201d, Soft Matter, 2018, 14, 1449\u20101464. https:\/\/doi.org\/10.1039\/C7SM02008B<\/a><\/li>\n\n\n\n
  2. A. Tsourtis, V. Harmandaris, D. Tsagkarogiannis, \u201cParameterization of Coarse\u2010grained Molecular Interactions through Potential of Mean Force Calculations and Cluster Expansions Techniques\u201d, Entropy, 2017, 19, 395, doi:10.3390\/e19080395.<\/li>\n\n\n\n
  3. A. Rissanou, H. Papananou, V. Petrakis, M. Doxastakis, K. Andrikopoulos, G. Voyiatzis, K.Chrissopoulou, V. Harmandaris, S. Anastasiadis, \u201cStructural and Conformational Properties of Poly(ethylene oxide)\/Silica Nanocomposites: Effect of Confinement\u201d, Macromolecules, 2017, 50, 6273\u20106284; Doi:10.1021\/acs.macromol.7b00811. http:\/\/dx.doi.org\/10.1021\/acs.macromol.7b00811<\/a><\/li>\n\n\n\n
  4. M. Gulde, A. Rissanou, V. Harmandaris, M. M\u00fcller, S. Sch\u00e4fer, C. Ropers \u201cStructure and dynamics of monolayer polymer crystallites on graphene\u201d, Nano Letters, 2016, 16, 6994\u20137000; doi:10.1021\/acs.nanolett.6b03079, http:\/\/pubs.acs.org\/doi\/abs\/10.1021\/acs.nanolett.6b03079<\/a><\/li>\n\n\n\n
  5. E. Kalligiannaki, A. Chazirakis, A. Tsourtis, M. Katsoulakis, P. Plechac, V. Harmandaris, \u201cParametrizing coarse grained models for molecular systems at equilibrium\u201d, Europ.Phys. J. Special Topics, 2016, 225, 1347\u20131372. doi: 10.1140\/epjst\/e2016\u201060145\u2010x. http:\/\/link.springer.com\/article\/10.1140\/epjst\/e2016\u201060145\u2010x<\/a><\/li>\n\n\n\n
  6. V. Harmandaris, E. Kalligiannaki, M. Katsoulakis, P. Plechac, \u201cPath\u2010space variational inference for non\u2010equilibrium coarse\u2010grained systems\u201d, J. Comp. Phys., 2016, 314, 355\u2013383. Doi:10.1016\/j.jcp.2016.03.021 https:\/\/doi.org\/10.1016\/j.jcp.2016.03.021<\/a><\/li>\n\n\n\n
  7. P. Ba\u010dov\u00e1, A. Rissanou, V. Harmandaris, \u201cEdge\u2010functionalized Graphene as a nanofiller: Molecular Dynamics Simulation Study\u201d, Macromolecules, 2015, 48, 9024\u20139038, http:\/\/pubs.acs.org\/doi\/10.1021\/acs.macromol.5b01782<\/a>.<\/li>\n\n\n\n
  8. E. Kalligiannaki, V. Harmandaris, M. Katsoulakis, P. Plechac \u201cThe geometry of generalized force matching and related information metrics in coarse\u2010graining of molecular systems\u201d, J. Chem. Phys., 2015, 143, 084105. http:\/\/dx.doi.org\/10.1063\/1.4928857<\/a><\/li>\n\n\n\n
  9. A. Tsourtis, Y. Pantazis, M. Katsoulakis, V. Harmandaris, \u201cParametric Sensitivity Analysis for Stochastic Molecular Systems using Information Theoretic Metrics\u201d, J. Chem. Phys., 2015, 143, 014116. https:\/\/doi.org\/10.1063\/1.4922924<\/a><\/li>\n\n\n\n
  10. A. Rissanou, V. Harmandaris, \u201cStructural and Dynamical Properties of Polystyrene Thin Films\u201d, Macromolecules, 2015, 48, 2761\u20132772. Doi:10.1021\/ma502524e<\/li>\n\n\n\n
  11. A. Rissanou, A. Power, V. Harmandaris, \u201cProperties of Polyethylene\/Graphene Nanocomposites through Molecular Dynamics Simulations\u201d, Polymers, 2015, 7, 390\u2010417; https:\/\/doi.org\/10.3390\/polym7030390<\/a><\/li>\n\n\n\n
  12. H. J. Butt, H. Duran, W. Egger, F. Faupel, V. Harmandaris, S. Harms, K. Johnston, K.Kremer, Y. Lin, L. Lue, C. Ohrt, K. Raetzke, L. Ravelli, W. Steffen, and S. D. B. Vianna, \u201cInterphase of a polymer at a solid interface\u201d, Macromolecules, 2014, 47, 8459\u20108465.6<\/li>\n\n\n\n
  13. V. Harmandaris, \u201cQuantitative study of equilibrium and non\u2010equilibrium polymer dynamics through systematic hierarchical coarse\u2010graining simulations\u201d, Korea\u2010Aust.Rheol. J., 2014, 26, 15\u201028. https:\/\/doi.org\/10.1007\/s13367-014-0003-7<\/a><\/li>\n\n\n\n
  14. A. Rissanou, V. Harmandaris, \u201cDynamics of various polymer\/graphene interfacial systems through atomistic molecular dynamics simulations\u201d, Soft Matter, 2014, 10, 2876\u20102888.<\/li>\n\n\n\n
  15. K. Johnston, V. Harmandaris, \u201cHierarchical multiscale modeling of polymer\u2212solid interfaces: Atomistic to coarse\u2010grained description and structural and conformational properties of polystyrene\u2212gold systems\u201d, Macromolecules, 2013, 46, 5741\u22125750.<\/li>\n\n\n\n
  16. V. Harmandaris, M. Doxastakis \u201cMolecular dynamics of polyisoprene\/polystyrene oligomer blends: The role of self\u2010concentration and fluctuations on blend dynamics\u201d, J.Chem. Phys., 2013, 139, 034904.<\/li>\n\n\n\n
  17. A. Rissanou, V. Harmandaris, \u201cA molecular dynamics study of polymer\/graphene nanocomposites\u201d, Macromolecular Symposia, 2013, 331\u2010332, 43\u201349.<\/li>\n\n\n\n
  18. K. Johnston, V. Harmandaris, \u201cHierarchical simulations of hybrid polymer\/solid materials\u201d, Soft Matter, 2013, 9, 6696\u20106710 (Review article, Themed Issue on Emerging Investigators).<\/li>\n\n\n\n
  19. V. Harmandaris, G. Floudas, K. Kremer, \u201cDynamic heterogeneity in fully miscible blends of polystyrene with oligostyrene\u201d, Phys. Rev. Let. 2013, 110, 165701.<\/li>\n\n\n\n
  20. A. Rissanou, V. Harmandaris, \u201cStructure and dynamics of poly(methylmethacrylate)\/graphene systems through Atomistic molecular dynamics Simulations\u201d, Journal of Nanoparticle Research 2013, 15, 1589.<\/li>\n\n\n\n
  21. A. Rissanou, E. Georgilis, M. Kasotaskis, A. Mitraki, V.A. Harmandaris, \u201cEffect of solvent on the self\u2010assembly of dialanine and diphenylalanine peptides\u201d, J. Phys. Chem. B 2013, 117, 3962\u20103975.<\/li>\n\n\n\n
  22. K. Johnston, V. Harmandaris, \u201cProperties of short polystyrene chains confined between two gold surfaces through a combined density functional theory and classical molecular dynamics approach\u201d, Soft Matter, 2012, 8, 6320\u20106332.<\/li>\n\n\n\n
  23. K. Johnston, V. Harmandaris, \u201cProperties of benzene confined between two Au(111) surfaces using a combined density functional theory and classical molecular dynamics approach\u201d, J. Phys. Chem. C 2011, 115, 14707\u201014717.<\/li>\n\n\n\n
  24. D. Fritz, K. Koschke, V. Harmandaris, N.F.A. van der Vegt and K. Kremer, \u201cMultiscale modeling of soft matter: scaling of dynamics\u201d, Phys. Chem. Chem. Phys., 2011, 13, 10412\u201010420.<\/li>\n\n\n\n
  25. V. Harmandaris, G. Floudas, K. Kremer, \u201cTemperature and pressure dependence of polystyrene dynamics through molecular dynamics simulations and experiments\u201d, Macromolecules 2011, 44, 393\u2010402.<\/li>\n\n\n\n
  26. C. Baig, V. Harmandaris \u201cQuantitative Analysis on the Validity of a Coarse\u2010Grained Model for Nonequilibrium Polymeric Liquids under Flow\u201d, Macromolecules, 2010, 43, 3156\u20103160.<\/li>\n\n\n\n
  27. D. Fritz, V. Harmandaris, K. Kremer, N. van der Vegt, \u201cCoarse\u2010Grained polymer melts based on isolated atomistic chains: Simulation of polystyrene of different tacticities, Macromolecules, 2009, 42, 7579\u20107588.<\/li>\n\n\n\n
  28. V. Harmandaris, K. Kremer, \u201cPredicting polymer dynamics at multiple length and time scales\u201d, Soft Matter, 2009, 5, 3920\u20103926.<\/li>\n\n\n\n
  29. T. Cherdhirankorn, V. Harmandaris, A. Juhari, P. Voudouris, G. Fytas, K. Kremer, K.Koynov, \u201cFluorescence correlation spectroscopy study of molecular probe diffusion in polymer melts\u201d, Macromolecules 2009, 42, 4858\u20104866.<\/li>\n\n\n\n
  30. V. Harmandaris, K. Kremer, \u201cDynamics of polystyrene melts through hierarchical multiscale simulations\u201d, Macromolecules 2009, 42, 791\u2010802.<\/li>\n\n\n\n
  31. T. Mulder, V. Harmandaris, A.V. Lyulin, N.F.A. van der Vegt, K. Kremer, M.A.J. Michels, \u201cStructural properties of atactic polystyrene of different thermal history obtained from a multi\u2010scale simulation\u201d, Macromolecules 2009, 42, 384\u2010391.<\/li>\n\n\n\n
  32. T. Mulder, V. Harmandaris, A.V. Lyulin, N.F.A. van der Vegt, M.A.J. Michels, \u201cMolecular simulation via connectivity\u2010altering Monte Carlo and Scale\u2010jumping methods: Application to amorphous polystyrene\u201d, Macrom. Theory Simul. 2008, 17, 393\u2010402.<\/li>\n\n\n\n
  33. T. Mulder, V. Harmandaris, A.V. Lyulin, N.F.A. van der Vegt, B. Vorselaars, M.A.J. Michels, \u201cEquilibration and deformation of amorphous polystyrene: Scale\u2010jumping simulation approach\u201d, Macrom. Theory Simul. 2008, 17, 290\u2010300.<\/li>\n\n\n\n
  34. G. Tsolou, V. Harmandaris, V.G. Mavrantzas, \u201cMolecular dynamics simulation of temperature and pressure effects on the intermediate length scale dynamics and zero shear rate viscosity of cis\u20101,4\u2010polybutadiene: Rouse mode analysis and dynamic structure factor spectra\u201d, J. Non\u2010Newt. Fl. Mech. 2008, 152, 184.<\/li>\n\n\n\n
  35. V. Harmandaris, D. Reith, N.F.A. van der Vegt, K. Kremer, \u201cComparison between coarsegraining models for polymer systems: Two mapping schemes for polystyrene\u201d, Macrom. Chem. and Phys. 2007, 208, 2109.<\/li>\n\n\n\n
  36. V. Harmandaris, N. Adhikari, N.F.A. van der Vegt, K. Kremer, B. Mann, R.Voelkel, C.C.Liew, H. Weiss, \u201cEthylbenzene diffusion in polystyrene: United atom atomistic\/coarse grained simulations and experiments\u201d, Macromolecules, 2007, 40, 7026.<\/li>\n\n\n\n
  37. B. Reynolds, G. Illya, V. Harmandaris, M.M. M\u00fcller, K. Kremer, M. Deserno, \u201cMediated interactions between colloids adsorbed on a biological membrane\u201d, Nature 2007, 447,461. Also in News and Views, Nature 2007,447, 387. Also featured in the Virtual Journal of Biological Physics Research, June 1, 2007 issue.<\/li>\n\n\n\n
  38. O. Alexiadis, V. Harmandaris, V. Mavrantzas, L. de la Sitte, \u201cAtomistic simulation of alkanethiol self\u2010assembled monolayers on different metal surfaces via a quantum firstprinciples parameterization of the sulfur\u2010metal interaction\u201d, J. Phys. Chem. C 2007, 111,6380.<\/li>\n\n\n\n
  39. V. Harmandaris, M. Deserno, \u201cA novel method for measuring the bending rigidity of model lipid membranes by simulating tethers\u201d, J. Chem. Phys. 2006, 125, 204905. Also 8 featured in the Virtual Journal of Biological Physics Research, December 1, 2006 issue.<\/li>\n\n\n\n
  40. V. Harmandaris, N. Adhikari, N.F.A. van der Vegt, K. Kremer \u201cHierarchical modeling of polystyrene: From atomistic to coarse\u2010grained simulations\u201d, Macromolecules 2006, 39, 6708.<\/li>\n\n\n\n
  41. G. Tsolou, V. Harmandaris, V.G. Mavrantzas, \u201cTemperature and pressure effects on local structure and chain packing in cis\u20101,4\u2010polybutadiene from detailed molecular dynamics simulations\u201d, Macrom. Theory Simul. 2006, 15, 381.<\/li>\n\n\n\n
  42. G. Tsolou, V. Harmandaris, V.G. Mavrantzas, \u201cAtomistic molecular dynamics simulation of the temperature and pressure dependences of local and terminal relaxations in cis\u20101,4\u2010polybutadiene\u201d, J. Chem. Phys., 2006, 124, 084906.<\/li>\n\n\n\n
  43. C. Baig, B.J. Edwards, D.J. Keffer, H.D. Cochran, V. Harmandaris \u201cRheological and structural studies of linear polyethylene melts under planar elongational flow using nonequilibrium molecular dynamics simulations\u201d, J. Chem. Phys., 2006, 124, 084902.<\/li>\n\n\n\n
  44. K. Daoulas, D.N. Theodorou, V. Harmandaris, N.G. Karayiannis, V.G. Mavrantzas, \u201cSelfconsistent field study of compressible semiflexible melts adsorbed on a solid substrate and comparison with atomistic simulations\u201d, Macromolecules, 2005, 38, 7134\u20107149.<\/li>\n\n\n\n
  45. V. Harmandaris, K. Daoulas, V.G. Mavrantzas, \u201cMolecular dynamics simulation of a polymer melt\/solid interface: Local dynamics and chain mobility in a thin film of polyethylene melt adsorbed on graphite\u201d, Macromolecules, 2005, 38, 5796\u20105809.<\/li>\n\n\n\n
  46. K. Daoulas, V. Harmandaris, V.G. Mavrantzas, \u201cDetailed atomistic simulation of a polymer melt \/ solid interface: Structure, density and conformation of a thin polyethylene melt film adsorbed on graphite\u201d, Macromolecules, 2005, 38, 5780\u20105795.<\/li>\n\n\n\n
  47. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, M. Kr\u00f6ger, J. Ram\u00edrez, H.C. \u00d6ttinger, D. Vlassopoulos, \u201cDynamic crossover from Rouse to entangled polymer melt regime: Signals from long, detailed atomistic molecular dynamics simulations, supported by rheological experiments\u201d, Macromolecules, 2003, 36, 1376\u20101387.<\/li>\n\n\n\n
  48. V. Harmandaris, D. Angelopoulou, V.G. Mavrantzas, D.N. Theodorou, \u201cAtomistic molecular dynamics simulation of diffusion in binary n\u2010alkane\/polyethylene melts\u201d, J.Chem. Phys., 2002, 116, 7656\u20107665.<\/li>\n\n\n\n
  49. V. Harmandaris, M. Doxastakis, V.G. Mavrantzas, D.N. Theodorou, \u201cDetailed molecular dynamics simulation of the self\u2010diffusion of n\u2010alkane and cis\u20101,4 polyisoprene oligomer melts\u201d, J. Chem. Phys., 2002, 116, 436\u2010446.<\/li>\n\n\n\n
  50. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, “Atomistic molecular dynamics simulations of stress relaxation upon cessation of steady\u2010state uniaxial elongational flow”, Macromolecules, 2000, 33, 8062\u20108076.<\/li>\n\n\n\n
  51. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, “Atomistic molecular dynamics simulations of polydisperse linear polyethylene melts”, Macromolecules, 1998, 31, 7934\u20107943.<\/li>\n<\/ol>\n\n\n\n

    Publications in Conference Proceedings<\/h2>\n\n\n\n
      \n
    1. Kalligiannaki, V. Harmandaris, M. Katsoulakis, P. Plechac \u201cFrom Atomistic to Systematic Coarse\u2010graining of Molecular Systems\u201d, Proceedings, 2nd ECCOMAS, Thematic Conference on International Conference on Uncertainty Quantification in Computational Sciences and Engineering (UNCECOMP), Rhodes, Greece, June 15\u201017, 2017.<\/li>\n\n\n\n
    2. A. Rissanou, A. Power, P. Ba\u010dov\u00e1, V. Harmandaris, \u201cAtomistic Molecular Dynamics Simulations of Polymer\/Graphene Nanostructured Systems\u201d, Materials Today:Proceedings, 11th Panhellenic Scientific Chemical Engineering International Conference, Salonica, Greece, May 25\u201027, 2017.<\/li>\n\n\n\n
    3. A. Tsourtis, E. Kalligiannaki, V. Harmandaris, \u201cParametrizing coarse grained models for molecular systems at equilibrium\u201d, Proceedings, 11th Hellenic Polymer Society International Conference, Heraklion, Greece, November 03\u201005, 2016.<\/li>\n\n\n\n
    4. P. Ba\u010dov\u00e1, A. Rissanou, V. Harmandaris, \u201cGraphene based Polymer Nanostructured Materials through Molecular Simulations\u201d, Proceedings, 11th Hellenic Polymer Society International Conference, Heraklion, Greece, November 03\u201005, 2016.<\/li>\n\n\n\n
    5. A. Rissanou, P. Ba\u010dov\u00e1, V. Harmandaris, \u201cProperties of Nanographene in Polymer Nanocomposites through All\u2010atom Simulations\u201d, Proceedings, 11th Hellenic Polymer Society International Conference, Heraklion, Greece, November 03\u201005, 2016.<\/li>\n\n\n\n
    6. V. Petrakis, A. Rissanou, V. Harmandaris, H. Papananou, K. Chrissopoulou, S.Anastasiadis, \u201cStructural and Conformational Properties of Poly\u2010(ethylene oxide)\/Silica Nanocomposites through Simulations and Experiments\u201d, Proceedings, 11th Hellenic Polymer Society International Conference, Heraklion, Greece, November 03\u201005, 2016.<\/li>\n\n\n\n
    7. A. Power, V. Harmandaris \u201cDetailed Atomistic Molecular Dynamics Simulations of Hybrid Polymer \/Core\u2010Shell Nanoparticle Systems\u201d, Proceedings, 11th Hellenic Polymer Society International Conference, Heraklion, Greece, November 03\u201005, 2016.<\/li>\n\n\n\n
    8. A. Rissanou, P. Ba\u010dov\u00e1, V. Harmandaris, \u201cAtomistic Simulation of Graphene\u2010Based Polymer Nanocompositess\u201d, Proceedings, 8th International Conference Times of Polymers and Conferences (TOP), Ischia, Italy, June 19\u201023, 2016.<\/li>\n\n\n\n
    9. E. Kalligiannaki, V. Harmandaris, M. Katsoulakis, P. Plechac \u201cCoarse\u2010graining Nonequilibrium systems and path space information theory\u201d, Proceedings, European Community on Computational Methods in Applied Sciences (ECCOMAS) Congress 2016, Crete, Greece, June 5\u201010, 2016.<\/li>\n\n\n\n
    10. V. Harmandaris, \u201cFrom Atomistic to Systematic Coarse\u2010Grained Models for Molecular Systems\u201d, Proceedings, SIAM Conference on Mathematical Aspects of Materials Science MS: Numerical Methods in Multiscale Materials Modelling, Philadelphia, 07\u201012th May, 2016.<\/li>\n\n\n\n
    11. P. Ba\u010dov\u00e1, A. Rissanou, V. Harmandaris, \u201cStudy of functionalized\u2010graphene based polymer nanocomposites through atomistic simulations\u201d, Proceedings, 20th International Conference on Composite Materials, Copenhagen, 19\u201024th July, 2015.<\/li>\n\n\n\n
    12. A. Rissanou, P. Ba\u010dov\u00e1, V. Harmandaris, \u201cStudy of the dynamics of polymer\/graphene nanocomposites through detailed atomistic simulations\u201d, Proceedings, 8th GRACM International Congress on Computational Mechanics, Volos, 12\u201015 July 2015.<\/li>\n\n\n\n
    13. E. Kalligiannaki, V. Harmandaris, M. Katsoulakis, P. Plechac \u201cOptimizing Coarse\u2010grained Models for Equilibrium and Non\u2010equilibrium Molecular Systems: Force matching and Dynamical Force Matching\u201d, Proceedings, 7th International Workshop on non\u2010Equilibrium Thermodynamics and Complex Fluids (IWNET 2015), Hilvarenbeek, Netherlands, July 5\u201010, 2015.<\/li>\n\n\n\n
    14. V. Harmandaris, A. Rissanou, P. Ba\u010dov\u00e1, \u201cDynamics of Graphene based Polymer Nanocomposites through Molecular Simulations\u201d, Proceedings, Rheology Symposium in honor of Prof. Roger I. Tanner, Samos, 29 June \u2013 02 July 2015.<\/li>\n\n\n\n
    15. A. Rissanou, P. Ba\u010dov\u00e1, V. Harmandaris, \u201cStudy of the Dynamics of Hybrid Polymer\/Graphene Systems through All\u2010atom Molecular Dynamics Simulations\u201d, Proceedings, 10th Panhellenic Scientific Chemical Engineering Conference, Patras, Greece, June 4\u20106, 2015.<\/li>\n\n\n\n
    16. A.J. Power, V. Harmandaris, \u201cStructure and Dynamics of Hybrid Polymer\/Gold Nanoparticle Systems through Atomistic Molecular Dynamics Simulations\u201d, Proceedings, 10th Panhellenic Scientific Chemical Engineering Conference, Patras, Greece, June 4\u20106, 2015.<\/li>\n\n\n\n
    17. P. Ba\u010dov\u00e1, A. Rissanou, V. Harmandaris, \u201cDetailed Molecular Simulations of Functionalized Graphene Based Polymer Nanocomposites\u201d, Proceedings, American Physical Society, APS March Meeting, San Antonio, USA, March 02\u201006, 2015.<\/li>\n\n\n\n
    18. A. Rissanou, V. Harmandaris, \u201cStudy of Polymer\/Graphene Nanocomposites through Atomistic Molecular Dynamics Simulations\u201d, Proceedings, American Physical Society, APS March Meeting, San Antonio, USA, March 02\u201006, 2015.<\/li>\n\n\n\n
    19. M. Doxastakis, V. Harmandaris, \u201cDynamic Heterogeneity in Fully Miscible Polymer Blends through Molecular Simulations\u201d, Proceedings, 10th Hellenic Polymer Society Conference, Patras, Greece, December 04\u201006, 2014.<\/li>\n\n\n\n
    20. A.J. Power, V. Harmandaris \u201cProperties of polymer\/gold nanocomposites through atomistic molecular dynamics simulations\u201d, Proceedings, 10th Hellenic Polymer Society Conference, Patras, Greece, December 04\u201006, 2014.<\/li>\n\n\n\n
    21. V.S. Petrakis, A.N. Rissanou, V. Harmandaris, K. Chrisopoulou, S. Anastasiadis \u201cAtomistic molecular dynamics simulation study of a hybrid poly (ethylene oxide) \/ silica nanoparticle system\u201d, Proceedings, 10th Hellenic Polymer Society Conference, Patras, Greece, December 04\u201006, 2014.<\/li>\n\n\n\n
    22. A. Rissanou, V. Harmandaris, \u201cA Molecular Dynamics Study of Graphene based Polymer Nanocomposites\u201d, Proceedings, 16th European Conference on Composite Materials, ECCM, Seville, Spain, June 21\u201027, 2014.<\/li>\n\n\n\n
    23. V. Harmandaris, K. Johnston \u201cHierarchical Modeling of Polymer\/Solid Interfaces: From Ab\u2010initio Calculations to Atomistic up to Coarse\u2010grained Simulations\u201d, Proceedings, American Physical Society, APS March Meeting, Denver, Colorado, USA, March 03\u201007, 2014.<\/li>\n\n\n\n
    24. V. Harmandaris, \u201cModeling of hybrid polymer\/solid interfacial systems\u201d, Proceedings, 246th ACS National Meeting & Exposition, Indianapolis, USA, September 08\u201012, 2013.<\/li>\n\n\n\n
    25. V. Harmandaris, \u201cHierarchical Multi\u2010scale Simulations of Polymer\/Metal Interfaces\u201d, Proceedings, 7th International Discussion Meeting on Relaxations in Complex Systems, Barcelona, Spain, July 21\u201027, 2013.<\/li>\n\n\n\n
    26. A. Rissanou, V. Harmandaris, \u201cProperties of polystyrene\/graphene systems through detailed atomistic simulations\u201d, Proceedings, GrapHEL, A European Conference\/Workshop on the Synthesis, Characterization and Applications of Graphene, Mykonos, Greece, September 27\u201030, 2012.<\/li>\n\n\n\n
    27. V. Harmandaris, C. Baig \u201cHierarchical modeling of polymers under non\u2010equilibrium conditions: from atomistic to coarse\u2010grained models\u201d, Proceedings, XVIth International Congress on Rheology, Lisbon, Portugal, August 5\u201010, 2012.<\/li>\n\n\n\n
    28. V. Harmandaris, \u201cHierarchical modeling of polymer\/solid interfacial systems: From abinitio, to atomistic up to coarse\u2010grained simulations\u201d, Proceedings, XI International Conference on Nanostructured Materials, Rhodes, Greece, August, 26\u201031, 2012.<\/li>\n\n\n\n
    29. K. Johnston, K. Kremer, V. Harmandaris, \u201cConfined polystyrene films between gold surfaces\u201d, Proceedings, American Physical Society, APS March Meeting, Boston, Massachusetts, USA, February 27\u2010March 2, 2012.<\/li>\n\n\n\n
    30. V. Harmandaris, \u201cMulti\u2010scale simulations of fluid\/solid hybrid composite systems\u201d, Proceedings, 18th International Conference on composite materials, Busan, Jeju Island, Korea, August, 20\u201026, 2011.<\/li>\n\n\n\n
    31. V. Harmandaris, \u201cStructure and dynamics of non\u2010equilibrium polymer melts through hierarchical multi\u2010scale dynamic simulations\u201d, Proceedings, 6th Hellenic Society Rheology 2011, Athens, Greece, July 27\u201030, 2011.<\/li>\n\n\n\n
    32. V. Harmandaris, \u201cA novel method for measuring the bending and the Gaussian rigidity of multi\u2010component membranes by simulating tethers\u201d, Proceedings, International Soft Matter Conference 2010, ISMC, Granada, Spain, July 04\u201008, 2010.<\/li>\n\n\n\n
    33. V. Harmandaris, \u201cMultiscale modeling of polymers under equilibrium and nonequilibrium conditions: from atomistic to coarse\u2010grained models\u201d, Proceedings, International Soft Matter Conference 2010, ISMC, Granada, Spain, July 04\u201008, 2010.<\/li>\n\n\n\n
    34. V. Harmandaris and K. Kremer, \u201cPolymer\/Solid Interfaces Through Multi\u2010scale Simulations\u201d, Proceedings, 17th Conference on Composite Materials, ICCM, Edinburgh, Scotland, July 27\u201031, 2009.<\/li>\n\n\n\n
    35. Won Bo Lee, V. Harmandaris, D. Fritz, K. Kremer, \u201cDynamics of polystyrene (PS) melts: multi\u2010scale molecular dynamic approach\u201d, Proceedings, American Physical Society, APS March Meeting, Pittsburgh, Pennsylvania, USA, March 16\u201020, 2009.<\/li>\n\n\n\n
    36. V. Harmandaris and K. Kremer, \u201cDynamics of entangled polystyrene through hierarchical multi\u2010scale simulations\u201d, Proceedings, 7th Hellenic Polymer Conference, Ioannina, Greece, September 28\u2010Octomber 01, 2008.<\/li>\n\n\n\n
    37. V. Harmandaris and K. Kremer, \u201cStructure and Dynamics of Polymers Through Hierarchical Dynamic Simulations\u201d, Proceedings, XXIV Panhellenic Conference on Solid State Physics and Materials Science, Heraklion, Greece, September 21\u201024, 2008.<\/li>\n\n\n\n
    38. N. van der Vegt, V. Harmandaris, B. Hess, K. Kremer, T.A. Ozal, C. Peter, \u201cMultiscale simulations of polymer permeation\u201d, Proceedings, AIChE Summer Meeting, New Orleans, April 6\u201010, 2008.<\/li>\n\n\n\n
    39. D. Fritz, V. Harmandaris, D. Reith, N.F.A. van der Vegt, K. Kremer \u201cStructure and dynamics of coarse grained polystyrene melts\u201d, Proceedings, German Physical Society (DPG), Berlin, Germany, February 25\u201029, 2008.<\/li>\n\n\n\n
    40. B. Reynolds, G. Illya, V. Harmandaris, M.M. M\u00fcller, K. Kremer, M. Deserno, \u201cMediated interactions between colloids adsorbed on a biological membrane\u201d, Proceedings, Biophysical Society Annual Meeting, Long Beach, California, February 2\u20106, 2008.<\/li>\n\n\n\n
    41. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cAtomistic Molecular Dynamics Simulation of the Self\u2010Diffusion of n\u2010Alkane Melts and of Binary n\u2010alkane Blends\u201d, Proceedings, AIChE Annual Meeting, San Francisco, November 16\u201021, 2003.<\/li>\n\n\n\n
    42. D. Reith, V. Harmandaris, N.F.A. van der Vegt, K. Kremer \u201cHierarchical modeling of PS: from atomistic to coarse\u2010grained simulations\u201d, Proceedings, AIChE Annual Meeting, Salt Lake City, November 4\u20109, 2007.<\/li>\n\n\n\n
    43. D. Reith, V. Harmandaris, N.F.A. van der Vegt, K. Kremer \u201cStructural and dynamical properties of Polystyrene determined by coarse\u2010graining MD simulations\u201d, Proceedings, SOCOBIM, Terrasini, Italy, July 15\u201019, 2007.<\/li>\n\n\n\n
    44. V. Harmandaris \u201cCoarse graining simulations of polymers: II) Dynamics and biological applications\u201d, Proceedings, Workshop on Mathematical and Computational Methods for Accelerated Molecular, Stochastic and Hybrid Simulation, Heraklion, Creta, Greece, June 25\u201027, 2007.<\/li>\n\n\n\n
    45. V. Harmandaris \u201cCoarse graining simulations of polymers: I) Methods and applications\u201d, Proceedings, Workshop on Mathematical and Computational Methods for Accelerated Molecular, Stochastic and Hybrid Simulation, Heraklion, Creta, Greece, June 25\u201027, 2007.<\/li>\n\n\n\n
    46. V. Harmandaris, M. Deserno, \u201cStudying the Curvature Elasticity of biomembranes through numerical simulations\u201d, Proceedings, German Physical Society (DPG), Dresden, Germany, March 27 \u2013 31, 2007.<\/li>\n\n\n\n
    47. V. Harmandaris, M. Deserno. \u201cA novel method for measuring the bending rigidity of model lipid membranes by simulating tethers\u201d, Proceedings, 4th International Workshop on non\u2010Equilibrium Thermodynamics and Complex Fluids, Rhodes, Greece, September 3\u201017, 2006.<\/li>\n\n\n\n
    48. V. Harmandaris, N.F.A. van der Vegt, K. Kremer \u201cHierarchical modeling of PS: From atomistic to coarse\u2010grained simulations\u201d, Proceedings, 4th International Workshop on non\u2010Equilibrium Thermodynamics and Complex Fluids, Rhodes, Greece, September 3\u20107, 2006.<\/li>\n\n\n\n
    49. V. Harmandaris, M. Deserno, \u201cStudying the curvature elasticity of biomembranes through numerical simulations\u201d, Proceedings, German Physical Society (DPG), Dresden, Germany, March 27 \u2013 31, 2006.<\/li>\n\n\n\n
    50. V. Harmandaris, \u201cPolymer dynamics at interfaces: What atomistic simulations can tell us\u201d, Proceedings, J\u00fclich Soft Matter Days 2005, Bonn, Germany, November 01 \u2013 04, 2005.<\/li>\n\n\n\n
    51. V. Harmandaris, K. Daoulas, V.G. Mavrantzas, \u201cDynamics of thin polymer melt films near at a solid attractive surface through atomistic molecular dynamics simulations\u201d, Proceedings, European Polymer Congress 2005, Moscow, Russia, June 26 \u2013 July 1, 2005.<\/li>\n\n\n\n
    52. V. Harmandaris, K. Daoulas, V.G. Mavrantzas, \u201cAtomistic simulation of the structure and dynamics of the polyethylene\/graphite interface\u201d, Proceedings, 3rd International Conference for Computational Modeling and Simulation of Materials (CIMTEC), Acireale, Italy, May 30 \u2013 June 4, 2004.<\/li>\n\n\n\n
    53. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cMolecular dynamics simulation of the viscoelastic properties of long polymer melts: From Rouse to reptation theory\u201d, Proceedings, AIChE Annual Meeting, San Francisco, November 16\u201021, 2003.<\/li>\n\n\n\n
    54. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cMolecular dynamics simulation of the viscoelastic properties of linear polymer melts\u201d, Proceedings, Polymer Processing Society (PPS), Athens, September 14\u201017, 2003.<\/li>\n\n\n\n
    55. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, “Prediction of the viscoelastic properties of polymer from detailed molecular dynamics simulations and comparison against rheological measurements”, Proceedings, 3rd Chemical Engineering Conference for Collaborative Research in Eastern Mediterranean (EMCC\u20103), Thessaloniki, Greece, May 13\u201015, 2003.<\/li>\n\n\n\n
    56. K. Daoulas, V.G. Mavrantzas, V. Harmandaris, A. Foteinopoulou, D.N. Theodorou, \u201cAtomistic Monte Carlo simulations and SCF calculations of polymers at interfaces\u201d, Proceedings, 4th GRACM Congress on Computational Mechanics, Patras, Greece, June 27\u201029, 2002.<\/li>\n\n\n\n
    57. V.G. Mavrantzas, V. Harmandaris, D.N. Theodorou, \u201cHierarchical modeling of the viscoelasticity of linear polymer melts\u201d, Proceedings, 4th GRACM Congress on Computational Mechanics, Patras, Greece, June 27\u201029, 2002.<\/li>\n\n\n\n
    58. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, “Prediction of the viscoelastic properties of high\u2010molecular weight polymer melts through molecular dynamics atomistic simulations”, Proceedings, 3rd Panhellenic Chemical Engineers\u2019 Conference, Athens, Greece, May 31\u2010June 02, 2001.<\/li>\n\n\n\n
    59. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cRheological properties of polymer melts from molecular constitution\u201d, Proceedings, AIChE Annual Meeting, Los Angeles, November 13\u201017, 2000.<\/li>\n\n\n\n
    60. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cPrediction of the linear viscoelastic properties of long\u2010chain polyethylene melts from detailed atomistic simulations on uniaxially stretched melt configurations\u201d, Proceedings, XIII International Congress on Rheology, Cambridge, UK, August 20\u201025, 2000\u201d.<\/li>\n\n\n\n
    61. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, \u201cAtomistic modeling of viscoelastic Properties: Simulation of stress relaxation upon cessation of steady\u2010state elongational flow\u201d, Proceedings, International George Papatheodorou Symposium, Patras, Greece, September 16\u201018, 1999.<\/li>\n\n\n\n
    62. V. Harmandaris, V.G. Mavrantzas, D.N. Theodorou, “Atomistic simulation of the stress relaxation experiment after cessation of steady\u2010state uniaxial elongation”, Proceedings, 2nd Panhellenic Chemical Engineers\u2019 Conference, Salonica, Greece, May 27\u201029, 1999.<\/li>\n\n\n\n
    63. V.G. Mavrantzas, V. Harmandaris, D.N. Theodorou, “Atomistic simulation of the viscoelasticity of linear polyethylene melts”, Proceedings, 1st Hellenic Society of Rheology Meeting, Heraklion, Greece, August 29\u2010September 2, 1998.<\/li>\n\n\n\n
    64. V. Harmandaris, V.G. Mavrantzas, D.N Theodorou, “From chemical structure to polymer processing: Atomistic simulation of the viscoelasticity of linear polyethylene melts”, Proceedings, 4th Panhellenic Conference on Polymers, Patras, Greece, November 20\u201022, 1997.<\/li>\n<\/ol>\n","protected":false},"excerpt":{"rendered":"

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