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Karagiannis, Nikolaos n.karayiannis@upm.es

INGENIERÍA QUÍMICA INDUSTRIAL Y DEL MEDIO AMBIENTE / Universidad Politécnica de Madrid

Actividades

Diffusion of small molecules in disordered media: study of the effect of kinetic and spatial heterogeneities

  • Karayiannis, NC
  • Mavrantzas, VG
  • Theodorou, DN;

Chemical Engineering Science (p. 2789-2801) - 1/1/2001

10.1016/s0009-2509(00)00510-8 Ver en origen

  • ISSN 00092509

A novel Monte Carlo scheme for the rapid equilibration of atomistic model polymer systems of precisely defined molecular architecture

  • Karayiannis, NC
  • Mavrantzas, VG
  • Theodorou, DN;

Physical Review Letters - 1/1/2002

10.1103/physrevlett.88.105503 Ver en origen

  • ISSN 00319007

Atomistic Monte Carlo simulation of strictly monodisperse long polyethylene melts through a generalized chain bridging algorithm

  • Karayiannis, NC
  • Giannousaki, AE
  • Mavrantzas, VG
  • Theodorou, DN;

Journal Of Chemical Physics (p. 5465-5479) - 1/1/2002

10.1063/1.1499480 Ver en origen

  • ISSN 00219606

An advanced Monte Carlo method for the equilibration of model long-chain branched polymers with a well-defined molecular architecture: Detailed atomistic simulation of an H-shaped polyethylene melt

  • Karayiannis, NC
  • Giannousaki, AE
  • Mavrantzas, VG;

Journal Of Chemical Physics (p. 2451-2454) - 1/1/2003

10.1063/1.1543580 Ver en origen

  • ISSN 00219606

Self-consistent-field study of compressible semiflexible melts adsorbed on a solid substrate and comparison with atomistic simulations

  • Daoulas, KC
  • Theodorou, DN
  • Harmandaris, VA
  • Karayiannis, NC
  • Mavrantzas, VG;

Macromolecules (p. 7134-7149) - 1/1/2005

10.1021/ma050218b Ver en origen

  • ISSN 00249297

Hierarchical modeling of the dynamics of polymers with a nonlinear molecular architecture: Calculation of branch point friction and chain reptation time of H-shaped polyethylene melts from long molecular dynamics simulations

  • Karayiannis, NC
  • Mavrantzas, VG;

Macromolecules (p. 8583-8596) - 1/1/2005

10.1021/ma050989f Ver en origen

  • ISSN 00249297

Atomistic Molecular Dynamics simulation of short-chain branched polyethylene melts

  • Karayiannis, Nikos Ch.
  • Mavrantzas, Vlasis G.
  • Mouratides, Dimitrios
  • Chiotellis, Elias
  • Kiparissides, Costas;

Computer Aided Chemical Engineering (p. 333-357) - 1/1/2006

  • ISSN 15707946
  • iMarina

Advanced Monte Carlo Methods for the atomistic simulation of polymers with a linear or a non-linear molecular architecture

  • Karayiannis, Nikos Ch.
  • Mavrantzas, Vlasis G.;

Computer Aided Chemical Engineering (p. 31-67) - 1/1/2006

  • ISSN 15707946
  • iMarina

Detailed Atomistic Simulation of the Barrier Properties of Linear and Short-Chain Branched Polyethylene Melts Through a Hierarchical Modeling Approach

  • Gestoso, Patricia
  • Karayiannis, Nikos Ch.;

Computer Aided Chemical Engineering (p. 201-239) - 1/1/2006

  • ISSN 15707946
  • iMarina

Min-map bias Monte Carlo for chain molecules: Biased Monte Carlo sampling based on bijective minimum-to-minimum mapping

  • Laso, Manuel
  • Karayiannis, Nikos Ch.
  • Mueller, Matthias;

Journal Of Chemical Physics - 6/11/2006

10.1063/1.2359442 Ver en origen

  • ISSN 00219606

Este/a investigador/a no tiene libros.

Detailed Atomistic Simulation of the barrier properties of linear and short-chain branched polyethylene melts through a hierarchical modelling approach

  • Patricia Gestoso
  • Nikos Ch. Karayiannis

Computer Aided Chemical Engineering (p. 201-240) - 1/1/2006

  • ISSN 15707946
  • iMarina

Study of diffusion in disordered media. Effect of kinetic and spatial heterogeneties

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas
  • Doros N Theodorou

27/5/1999

  • iMarina

Effects of Jump Rate Distribution and Spatial Heterogeneity on diffusion of small molecules in disordered media

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas
  • Doros N Theodorou

13/11/2000

  • iMarina

Parallel programming in supercomputers through MPI

  • KARAGIANNIS, NIKOLAOS

16/6/2000

  • iMarina

An advanced Monte Carlo method for the fast equilibration of non-linear, H-shaped polyethylene melts

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas

15/9/2002

  • iMarina

An advanced Monte Carlo Algorithm for the fast equilibration of atomistic models of H-shaped polyethylene melts

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas

16/11/2003

  • iMarina

Study of the segmental dynamics and barrier properties of amorphous PET [poly(ethylene terephthalate)] and PEI [poly(ethylene isophthalate)] through atomistic simulations

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas
  • Doros N Theodorou

16/11/2003

  • iMarina

Detailed atomistic simulation of the conformational and dynamical properties of long, multi-arm, H-shaped Polyethylene melts through an advanced hierarchical scheme

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas

29/5/2004

  • iMarina

Branch point friction and its role in the dynamics of H-shaped polyethylene melts as probed by long molecular dynamics simulations

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas

27/6/2004

  • iMarina

Detailed atomistic simulation of the conformational and dynamic properties of H-shaped polyethylene melts

  • Nikos Ch Karayiannis
  • Vlasis G Mavrantzas

22/8/2004

  • iMarina

Beginning rheology

  • KARAGIANNIS, NIKOLAOS

12/2/2005

  • iMarina

Este/a investigador/a no tiene documentos de trabajo.

Este/a investigador/a no tiene informes técnicos.

"Nanoscale Fabrication Through Copolymer Self Assembly" (P208)

  • KARAGIANNIS, NIKOLAOS (Coordinador/a científico/a)

Ejecución: Desde 27-06-2017

Tipo: Nacional

  • iMarina

Nanohilos basados en GaN para sistemas de información cuántica y circuitos digitales

  • FERNANDO SAAVEDRA, AMALIA LUISA (Participante)
  • HERRANZ FEITO, MIGUEL (Investigador/a)
  • Sanchez Garcia, Miguel Angel (Investigador principal (IP))
  • FOTEINOPOULOU, AIKATERINI (Participante)
  • Gacevic, Zarko (Participante)
  • Calleja Pardo, Enrique (Participante)
  • KARAGIANNIS, NIKOLAOS (Participante)
  • LASO CARBAJO, MANUEL (Participante)
... Ver más Contraer

Ejecución: 01-01-2019 - 31-07-2022

Tipo: Nacional

Importe financiado: 193963,00 Euros.

  • iMarina

GaN-based nanowires as building blocks for quantum information systems and digital electronic circuits (RTI2018-097338-B-I00)

  • FOTEINOPOULOU, AIKATERINI (Investigador/a)
  • Miguel Angel Sanchez Garcia
  • Manuel Laso Carbajo
  • Enrique Calleja Pardo
  • Nikos Karayiannis
  • Zarko Gacevic
  • Aikaterini Foteinopoulou (Investigador principal (IP))
  • KARAGIANNIS, NIKOLAOS (Investigador/a)
... Ver más Contraer

Ejecución: 01-01-2019 - 31-12-2021

Tipo: Nacional

Importe financiado: 160300,00 Euros.

  • iMarina

Massively-Parallel Simulations for Polymer-Based Nanocomposites in the Bulk and Under Confinement (QCM-2010-3-0024))

  • Katerina Foteinopoulou
  • Manuel Laso Carbajo
  • Nikos Ch. Karagiannis (Investigador principal (IP))
  • KARAGIANNIS, NIKOLAOS (Coordinador/a)

Ejecución: 01-07-2019 - 01-01-2020

  • iMarina

Simulación Molecular de Organización Autónoma y Dirigida de Sistemas Basados en Polímeros

  • LASO CARBAJO, MANUEL (Investigador principal (IP))
  • KARAGIANNIS, NIKOLAOS (Investigador principal (IP))
  • BADIAS HERBERA, ALBERTO (Participante)
  • FOTEINOPOULOU, AIKATERINI (Participante)

Ejecución: 01-09-2022 - 31-08-2025

Tipo: Nacional

  • iMarina

Polymers Confined Between Plates: A Modeling Study Based on the Concept of Self-Avoiding Random Walks

  • Manuel Laso Carbajo (Codirector)
  • KARAGIANNIS, NIKOLAOS (Director) Doctorando: Oscar Parreño Agullo

9/10/2019

  • iMarina

Molecular simulation and structural identification of athermal polymers in the bulk and under confinement

  • KARAGIANNIS, NIKOLAOS (Director) Doctorando: Ramos Fuertes, Pablo Miguel

26/9/2022

  • iMarina

Monte Carlo simulations of crystal polymorphism in polymer-based systems

  • KARAGIANNIS, NIKOLAOS (Director) Doctorando: Herranz Feito, Miguel

3/3/2023

  • iMarina

Este/a investigador/a no tiene patentes o licencias de software.

Última actualización de los datos: 5/03/24 19:12