화학공학소재연구정보센터
검색결과 : 9건
No. Article
1 Thermodynamics of supersaturated steam: Towards an equation of state
Nezbeda I, Moucka F
Fluid Phase Equilibria, 484, 114, 2019
2 Recent progress in the molecular simulation of thermodynamic properties of aqueous electrolyte solutions
Smith WR, Nezbeda I, Kolafa J, Moucka F
Fluid Phase Equilibria, 466, 19, 2018
3 Osmotic pressure of aqueous electrolyte solutions via molecular simulations of chemical potentials: Application to NaCl
Smith WR, Moucka F, Nezbeda I
Fluid Phase Equilibria, 407, 76, 2016
4 Thermodynamics of Small Alkali Metal Halide Cluster Ions: Comparison of Classical Molecular Simulations with Experiment and Quantum Chemistry
Vlcek L, Uhlik F, Moucka F, Nezbeda I, Chialvo AA
Journal of Physical Chemistry A, 119(3), 488, 2015
5 Vapor-Liquid Equilibrium and Polarization Behavior of the GCP Water Model: Gaussian Charge-on-Spring versus Dipole Self-Consistent Field Approaches to Induced Polarization
Chialvo AA, Moucka F, Vlcek L, Nezbeda I
Journal of Physical Chemistry B, 119(15), 5010, 2015
6 Insight into Electrospinning via Molecular Simulations
Jirsak J, Moucka F, Nezbeda I
Industrial & Engineering Chemistry Research, 53(19), 8257, 2014
7 Gibbs ensemble simulation on polarizable models: Vapor-liquid equilibrium in Baranyai-Kiss models of water
Moucka F, Nezbeda I
Fluid Phase Equilibria, 360, 472, 2013
8 Molecular Simulation of Aqueous Electrolyte Solubility. 3. Alkali-Halide Salts and Their Mixtures in Water and in Hydrochloric Acid
Moucka F, Lisal M, Smith WR
Journal of Physical Chemistry B, 116(18), 5468, 2012
9 Molecular Simulation of Aqueous Electrolyte Solubility. 2. Osmotic Ensemble Monte Carlo Methodology for Free Energy and Solubility Calculations and Application to NaCl
Moucka F, Lisal M, Skvor J, Jirsak J, Nezbeda I, Smith WR
Journal of Physical Chemistry B, 115(24), 7849, 2011