Martin Lisal : rechercher sur Z-Library

LÍSAL, MARTIN, SMITH, WILLIAM R., BUREŠ, MICHAL, VACEK, VÁCLAV, NAVRÁTIL, JIŘÍ

Année:

2008

Langue:

english

Fichier:

PDF, 1.02 MB

english, 2008

REMC computer simulations of the thermodynamic properties of argon and air plasmas

Journal:

Sellers, Michael S., Lísal, Martin, Brennan, John K.

Année:

2002

Langue:

english

Fichier:

PDF, 840 KB

english, 2002

Exponential-six potential scaling for the calculation of free energies in molecular simulations

Journal:

Moreno, Nicolas, Perilla, Jairo E., Colina, Coray M., Lísal, Martin

Année:

2015

Langue:

english

Fichier:

PDF, 597 KB

english, 2015

Mucin aggregation from a rod-like meso-scale model

Journal:

Svoboda, Martin, Brennan, John K., Lísal, Martin

Année:

2015

Langue:

english

Fichier:

PDF, 1.11 MB

english, 2015

Molecular dynamics simulation of carbon dioxide in single-walled carbon nanotubes in the presence of water: structure and diffusion studies

Journal:

Moučka, Filip, Svoboda, Martin, Lisal, Martin

Année:

2015

Langue:

english

Fichier:

PDF, 1.51 MB

english, 2015

Modelling Aqueous Solubility of Sodium Chloride in Clays at Thermodynamic Conditions of Hydraulic Fracturing by Molecular Simulations

Journal:

Physical Chemistry Chemical Physics

Année:

2017

Langue:

english

Fichier:

PDF, 7.21 MB

english, 2017

Adsorption of Amphiphilic Graft Copolymers in Solvents Selective for the Grafts on a Lyophobic Surface: A Coarse-Grained Simulation Study

Posel, Zbysek, Svoboda, Martin, Limpouchová, Zuzana, Lisal, Martin, Prochazka, Karel

Journal:

Physical Chemistry Chemical Physics

Année:

2018

Langue:

english

Fichier:

PDF, 2.49 MB

english, 2018

Concentrated aqueous sodium chloride solution in clays at thermodynamic conditions of hydraulic fracturing: Insight from molecular dynamics simulations

Svoboda, Martin, Lísal, Martin

Journal:

The Journal of Chemical Physics

Année:

2018

Langue:

english

Fichier:

PDF, 7.06 MB

english, 2018

Saturated aqueous NaCl solution and pure water in Na-montmorillonite clay at thermodynamic conditions of hydraulic fracturing: Thermodynamics, structure and diffusion from molecular simulations

Svoboda, Martin, Moučka, Filip, Lísal, Martin

Journal:

Journal of Molecular Liquids

Année:

2018

Langue:

english

Fichier:

PDF, 10.98 MB

english, 2018

A general hydrogen bonding definition based on three-dimensional spatial distribution functions and its extension to quantitative structural analysis of solutions and general intermolecular bonds

Dočkal, Jan, Svoboda, Martin, Lísal, Martin, Moučka, Filip

Journal:

Journal of Molecular Liquids

Année:

2019

Langue:

english

Fichier:

PDF, 28.55 MB

english, 2019

Analysis of Henry’s constant for carbon dioxide in water via Monte Carlo simulation

Martin Lísal, William R. Smith, Karel Aim

Journal:

Martin Lísal, Paolo Cosoli, William R. Smith, Surendra K. Jain, Keith E. Gubbins

Année:

2004

Langue:

english

Fichier:

PDF, 243 KB

english, 2004

Molecular-level simulations of chemical reaction equilibrium for nitric oxide dimerization reaction in disordered nanoporous carbons

Journal:

William R. Smith, Martin Lísal, Ivo Nezbeda

Année:

2008

Langue:

english

Fichier:

PDF, 1.76 MB

english, 2008

Molecular-level Monte Carlo simulation at fixed entropy

Journal:

Chemical Physics Letters

Année:

2006

Langue:

english

Fichier:

PDF, 144 KB

english, 2006

Monte Carlo adiabatic simulation of equilibrium reacting systems: The ammonia synthesis reaction

Martin Lísal, Magdalena Bendová, William R. Smith

Journal:

Zbyšek Posel, Martin Lísal, John K. Brennan

Année:

2005

Langue:

english

Fichier:

PDF, 261 KB

english, 2005

Interplay between microscopic and macroscopic phase separations in ternary polymer melts: Insight from mesoscale modelling

Journal:

Martin Lísal, William R. Smith, Ivo Nezbeda

Année:

2009

Langue:

english

Fichier:

PDF, 5.08 MB

english, 2009

Accurate vapour–liquid equilibrium calculations for complex systems using the reaction Gibbs ensemble Monte Carlo simulation method

Journal:

Martin Lísal, Carol K Hall, Keith E Gubbins, Athanassios Z Panagiotopoulos

Année:

2001

Langue:

english

Fichier:

PDF, 222 KB

english, 2001

Micellar behavior in supercritical solvent–surfactant systems from lattice Monte Carlo simulations

Journal:

Martin Lísal, William R. Smith, Karel Aim

Année:

2002

Langue:

english

Fichier:

PDF, 173 KB

english, 2002

Analysis of Henry’s constant for carbon dioxide in water via Monte Carlo simulation

Journal:

Kristin Patterson, Martin Lisal, Coray M. Colina

Année:

2005

Langue:

english

Fichier:

PDF, 244 KB

english, 2005

Adsorption behavior of model proteins on surfaces

Journal:

Lísal, Martin, Smith, William R., Kolafa, Jiří

Année:

2011

Langue:

english

Fichier:

PDF, 428 KB

english, 2011

Molecular Simulations of Aqueous Electrolyte Solubility: 1. The Expanded-Ensemble Osmotic Molecular Dynamics Method for the Solution Phase

Journal:

Moučka, Filip, Lísal, Martin, Smith, William R.

Année:

2005

Langue:

english

Fichier:

PDF, 144 KB

english, 2005

Molecular Simulation of Aqueous Electrolyte Solubility. 3. Alkali-Halide Salts and Their Mixtures in Water and in Hydrochloric Acid

Journal:

Posocco, Paola, Posel, Zbyšek, Fermeglia, Maurizio, Lísal, Martin, Pricl, Sabrina

Année:

2012

Langue:

english

Fichier:

PDF, 3.23 MB

english, 2012

A molecular simulation approach to the prediction of the morphology of self-assembled nanoparticles in diblock copolymers

Journal:

Journal of Materials Chemistry

Année:

2010

Langue:

english

Fichier:

PDF, 566 KB

english, 2010

Towards molecular dynamics simulations of chiral room-temperature ionic liquids

Lísal, Martin, Chval, Zdeněk, Storch, Jan, Izák, Pavel

Journal:

Journal of Molecular Liquids

Année:

2014

Langue:

english

Fichier:

PDF, 1.18 MB

english, 2014

Air–liquid interfaces of imidazolium-based [TF2N−] ionic liquids: insight from molecular dynamics simulations

Lísal, Martin, Posel, Zbyšek, Izák, Pavel

Journal:

Physical Chemistry Chemical Physics

Année:

2012

Langue:

english

Fichier:

PDF, 3.57 MB

english, 2012

Parallel implementation of isothermal and isoenergetic Dissipative Particle Dynamics using Shardlow-like splitting algorithms

Larentzos, James P., Brennan, John K., Moore, Joshua D., Lísal, Martin, Mattson, William D.

Journal:

Computer Physics Communications

Année:

2014

Langue:

english

Fichier:

PDF, 1.19 MB

english, 2014

Coarse-Grain Model Simulations of Nonequilibrium Dynamics in Heterogeneous Materials

Brennan, John K., Lísal, Martin, Moore, Joshua D., Izvekov, Sergei, Schweigert, Igor V., Larentzos, James P.

Journal:

The Journal of Physical Chemistry Letters

Année:

2014

Langue:

english

Fichier:

PDF, 656 KB

english, 2014

Effect of short- and long-range forces on the properties of fluids. III. Dipolar and quadrupolar fluids

KOLAFA, JIŘÍ, NEZBEDA, IVO, LÍSAL, MARTIN

Journal:

Lísal, Martin, Nezbeda, Ivo, Smith, William R.

Année:

2001

Langue:

english

Fichier:

PDF, 1.58 MB

english, 2001

Vapor−Liquid Equilibria in Five-Site (TIP5P) Models of Water

Journal:

Lísal, Martin, Brennan, John K.

Année:

2004

Langue:

english

Fichier:

PDF, 40 KB

english, 2004

Alignment of Lamellar Diblock Copolymer Phases under Shear: Insight from Dissipative Particle Dynamics Simulations

Journal:

Langmuir

Année:

2007

Langue:

english

Fichier:

PDF, 10.52 MB

english, 2007

CECAM Workshop: ‘Dissipative particle dynamics: addressing deficiencies and establishing new frontiers’ (16–18 July 2008, Lausanne, Switzerland)

Brennan, John K., Lísal, Martin

Journal:

LÍSAL, MARTIN, NEZBEDA, IVO

Année:

2009

Langue:

english

Fichier:

PDF, 247 KB

english, 2009

Pure fluids of homonuclear and heteronuclear square-well diatomics I. Computer simulation study

Journal:

Lísal, Martin, Nezbeda, Ivo, Ungerer, Philippe, Teuler, Jean-Marie, Rousseau, Bernard

Année:

1999

Langue:

english

Fichier:

PDF, 832 KB

english, 1999

Low-Temperature Vapor−Liquid Equilibria from Parallelized Molecular Dynamics Simulations. Application to 1- and 2-Methylnaphthalene

Journal:

Kolafa, Jiří, Lísal, Martin

Année:

2006

Langue:

english

Fichier:

PDF, 105 KB

english, 2006

Time-Reversible Velocity Predictors for Verlet Integration with Velocity-Dependent Right-Hand Side

Journal:

Journal of Chemical Theory and Computation

Année:

2011

Langue:

english

Fichier:

PDF, 2.01 MB

english, 2011

Accurate Computer Simulation of Phase Equilibrium for Complex Fluid Mixtures. Application to Binaries Involving Isobutene, Methanol, Methyl tert -Butyl Ether, and n -Butane

Lísal, Martin, Smith, William R., Nezbeda, Ivo

Journal:

Šindelka, Karel, Limpouchová, Zuzana, Lísal, Martin, Procházka, Karel

Année:

1999

Langue:

english

Fichier:

PDF, 109 KB

english, 1999

Dissipative Particle Dynamics Study of Electrostatic Self-Assembly in Aqueous Mixtures of Copolymers Containing One Neutral Water-Soluble Block and One Either Positively or Negatively Charged Polyelectrolyte Block

Journal:

Macromolecules

Année:

2014

Langue:

english

Fichier:

PDF, 715 KB

english, 2014

Reaction ensemble molecular dynamics: Direct simulation of the dynamic equilibrium properties of chemically reacting mixtures

Brennan, John K., Lísal, Martin, Gubbins, Keith E., Rice, Betsy M.

Journal:

Physical Review E

Année:

2004

Langue:

english

Fichier:

PDF, 42 KB

english, 2004

Dissipative Particle Dynamics Study of the pH-Dependent Behavior of Poly(2-vinylpyridine)- block -poly(ethylene oxide) Diblock Copolymer in Aqueous Buffers

Posel, Zbyšek, Limpouchová, Zuzana, Šindelka, Karel, Lísal, Martin, Procházka, Karel

Journal:

Macromolecules

Année:

2014

Langue:

english

Fichier:

PDF, 2.05 MB

english, 2014

Modeling hierarchically structured nanoparticle/diblock copolymer systems

Posel, Zbyšek, Posocco, Paola, Fermeglia, Maurizio, Lísal, Martin, Pricl, Sabrina

Journal:

Soft Matter

Année:

2013

Langue:

english

Fichier:

PDF, 1.12 MB

english, 2013

Correction to Dissipative Particle Dynamics Study of Electrostatic Self-Assembly in Aqueous Mixtures of Copolymers Containing One Neutral Water-Soluble Block and One Either Positively or Negatively Charged Polyelectrolyte Block

Šindelka, Karel, Limpouchová, Zuzana, Lísal, Martin, Procházka, Karel

Journal:

Macromolecules

Année:

2014

Langue:

english

Fichier:

PDF, 110 KB

english, 2014

Direct Evaluation of Solid–Liquid Equilibria by Molecular Dynamics Using Gibbs-Duhem Integration

Lísal, Martin, Vacek, Václav

Journal:

LÍsal, Martin, Hall, Carol K., Gubbins, Keith E., Panagiotopoulos, Athanassios Z.

Année:

1997

Langue:

english

Fichier:

PDF, 775 KB

english, 1997

Formation of Spherical Micelles in a supercritical Solvent: Lattice Monte Carlo Simulation and Multicomponent Solution Model

Journal:

Smith, William R., Lísal, Martin

Année:

2003

Langue:

english

Fichier:

PDF, 448 KB

english, 2003

Direct Monte Carlo simulation methods for nonreacting and reacting systems at fixed total internal energy or enthalpy

Journal:

Physical Review E

Année:

2002

Langue:

english

Fichier:

PDF, 40 KB

english, 2002

An integral equation and Monte Carlo study of homo- and hetero- nuclear square-well diatomic fluids

JIRÁSEK, VÍT, LABÍK, STANISLAV, MALIJEVSKÝ, ANATOL, LÍSAL, MARTIN

Journal:

Posel, Zbyšek, Rousseau, Bernard, Lísal, Martin

Année:

2000

Langue:

english

Fichier:

PDF, 805 KB

english, 2000

Scaling behaviour of different polymer models in dissipative particle dynamics of unentangled melts

Journal:

Lísal, Martin, Aim, Karel, Fischer, Johann

Année:

2014

Langue:

english

Fichier:

PDF, 777 KB

english, 2014

Vapour–Liquid Equilibria of Dipolar Two-Centre Lennard-Jones Fluids from a Physically Based Equation of State and Computer Simulations

Journal:

LÍSAL, MARTIN, SMITH, WILLIAM R., AIM, KAREL

Année:

2000

Langue:

english

Fichier:

PDF, 998 KB

english, 2000

Direct molecular-level Monte Carlo simulation of Joule—Thomson processes

Journal:

Lísal, Martin, Vacek, Václav

Année:

2003

Langue:

english

Fichier:

PDF, 759 KB

english, 2003

Direct Evaluation of Vapour-Liquid Equilibria of Mixtures by Molecular Dynamics Using Gibbs-Duhem Integration

Journal:

Hart, Kyle E., Abbott, Lauren J., Lísal, Martin, Colina, Coray M.

Année:

1996

Langue:

english

Fichier:

PDF, 702 KB

english, 1996

Morphology and molecular bridging in comb- and star-shaped diblock copolymers

Journal:

The Journal of Chemical Physics

Année:

2014

Langue:

english

Fichier:

PDF, 2.78 MB

english, 2014

Effect of short and long range forces on the thermodynamic properties of water. A simple short range reference system

NEZBEDA, IVO, LÍSAL, MARTIN

Journal: