| 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 |
Formation of Aqueous Biphasic Systems with an Ionic Liquid Induced by Metallic Salts: Nanoscopic Views from Molecular Dynamics Simulations
Schurhammer R, Wipff G
Journal of Physical Chemistry B, 122(44), 10143, 2018 |
| 3 |
Liquid-Liquid Extraction of Pertechnetic Add (Tc-VII) by Tri-n-butyl Phosphate: Where Is the Proton? A Molecular Dynamics Investigation
Schurhammer R, Wipff G
Journal of Physical Chemistry B, 115(10), 2338, 2011 |
| 4 |
Solvation of uranium hexachloro complexes in room-temperature ionic liquids. A molecular dynamics investigation in two liquids
Schurhammer R, Wipff G
Journal of Physical Chemistry B, 111(18), 4659, 2007 |
| 5 |
Surfactant behavior of "ellipsoidal" dicarbollide anions: A molecular dynamics study
Chevrot G, Schurhammer R, Wipff G
Journal of Physical Chemistry B, 110(19), 9488, 2006 |
| 6 |
Photophysical and structural impact of phosphorylated anions associated to lanthanide complexes in water
Charbonniere LJ, Schurhammer R, Mameri S, Wipff G, Ziessel RF
Inorganic Chemistry, 44(20), 7151, 2005 |
| 7 |
Effect of the TBP and water on the complexation of uranyl nitrate and the dissolution of nitric acid into supercritical CO2 - A theoretical study
Schurhammer R, Wipff G
Journal of Physical Chemistry A, 109(23), 5208, 2005 |
| 8 |
Ab initio molecular dynamics of liquid 1,3-dimethylimidazolium chloride
Buhl M, Chaumont A, Schurhammer R, Wipff G
Journal of Physical Chemistry B, 109(39), 18591, 2005 |
| 9 |
Aqueous interfaces with hydrophobic room-temperature ionic liquids: A molecular dynamics study
Chaumont A, Schurhammer R, Wipff G
Journal of Physical Chemistry B, 109(40), 18964, 2005 |
| 10 |
Hydronium ion complex of 18-crown-6: Theory confirms three "normal" linear hydrogen bonds
Buhl M, Ludwig R, Schurhammer R, Wipff G
Journal of Physical Chemistry A, 108(51), 11463, 2004 |
