화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Is Charge Scaling Really Mandatory when Developing Fixed-Charge Atomistic Force Fields for Deep Eutectic Solvents?
Chaumont A, Engler E, Schurhammer R
Journal of Physical Chemistry B, 124(33), 7239, 2020
2 Distributed Polarizability Models for Imidazolium-Based Ionic Liquids
Millot C, Chaumont A, Engler E, Wipff G
Journal of Physical Chemistry A, 118(38), 8842, 2014
3 Uranyl and strontium salt solvation in room-temperature ionic liquids. A molecular dynamics investigation
Chaumont A, Engler E, Wipff G
Inorganic Chemistry, 42(17), 5348, 2003
4 Hydrophobic ions in TIP5P water and at a water- chloroform interface: The effect of sign inversion investigated by MD and FEP simulations
Schurhammer R, Engler E, Wipff G
Journal of Physical Chemistry B, 105(43), 10700, 2001
5 Demixing of binary water-chloroform mixtures containing ionophoric solutes and ion recognition at a liquid-liquid interface: A molecular dynamics study
Muzet N, Engler E, Wipff G
Journal of Physical Chemistry B, 102(52), 10772, 1998
6 Migration of ionophores and salts through a water chloroform liquid liquid interface: Molecular dynamics-potential of mean force investigations
Lauterbach M, Engler E, Muzet N, Troxler L, Wipff G
Journal of Physical Chemistry B, 102(1), 245, 1998