검색결과 : 8건
| No. | Article |
|---|---|
| 1 |
Synthesis, Characterization, and Density Functional Theory Analysis of Uranium and Thorium Complexes Containing Nitrogen-Rich 5-Methyltetrazolate Ligands Browne KP, Maerzke KA, Travia NE, Morris DE, Scott BL, Henson NJ, Yang P, Kiplinger JL, Veauthier JM Inorganic Chemistry, 55(10), 4941, 2016 |
| 2 |
Transferable Potentials for Phase Equilibria-Coarse-Grain Description for Linear Alkanes Maerzke KA, Siepmann JI Journal of Physical Chemistry B, 115(13), 3452, 2011 |
| 3 |
Prediction of Hildebrand Solubility Parameters of Acrylate and Methacrylate Monomers and Their Mixtures by Molecular Simulation Lewin JL, Maerzke KA, Schultz NE, Ross RB, Siepmann JI Journal of Applied Polymer Science, 116(1), 1, 2010 |
| 4 |
Effects of an Applied Electric Field on the Vapor-Liquid Equilibria of Water, Methanol, and Dimethyl Ether Maerzke KA, Siepmann JI Journal of Physical Chemistry B, 114(12), 4261, 2010 |
| 5 |
Vapor-liquid phase equilibria of water modelled by a Kim-Gordon potential Maerzke KA, McGrath MJ, Kuo IFW, Tabacchi G, Siepmann JI, Mundy CJ Chemical Physics Letters, 479(1-3), 60, 2009 |
| 6 |
Self-Consistent Polarization Density Functional Theory: Application to Argon Maerzke KA, Murdachaew G, Mundy CJ, Schenter GK, Siepmann JI Journal of Physical Chemistry A, 113(10), 2075, 2009 |
| 7 |
TraPPE-UA Force Field for Acrylates and Monte Carlo Simulations for Their Mixtures with Alkanes and Alcohols Maerzke KA, Schultz NE, Ross RB, Siepmann JI Journal of Physical Chemistry B, 113(18), 6415, 2009 |
| 8 |
Monte Carlo Simulations of Binary Mixtures of Nitrotoluene Isomers with n-Decane Maerzke KA, Siepmann JI Journal of Physical Chemistry B, 113(42), 13752, 2009 |