화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 Calculation of free energies and chemical potentials for gas hydrates using Monte Carlo simulations
Wierzchowski SJ, Monson PA
Journal of Physical Chemistry B, 111(25), 7274, 2007
2 Calculating the phase behavior of gas-hydrate-forming systems from molecular models
Wierzchowski SJ, Monson PA
Industrial & Engineering Chemistry Research, 45(1), 424, 2006
3 Trimer based polarization as a multibody molecular model. Application to hydrogen fluoride
Wierzchowski SJ, Kofke DA
Journal of the American Chemical Society, 127(2), 690, 2005
4 Liquid-phase activity coefficients for saturated HF/H2O mixtures with vapor-phase nonidealities described by molecular simulation
Wierzchowski SJ, Kofke DA
Industrial & Engineering Chemistry Research, 43(1), 218, 2004
5 Hydrogen fluoride phase behavior and molecular structure: Ab initio derived potential models
Wierzchowski SJ, Kofke DA
Journal of Chemical Physics, 119(12), 6092, 2003
6 Hydrogen fluoride phase behavior and molecular structure: A QM/MM potential model approach
Wierzchowski SJ, Kofke DA, Gao JL
Journal of Chemical Physics, 119(14), 7365, 2003
7 Fugacity coefficients of saturated water from molecular simulation
Wierzchowski SJ, Kofke DA
Journal of Physical Chemistry B, 107(46), 12808, 2003