Title | Journal | Journal Categories | Citations | Publication Date |
---|---|---|---|---|
First principles implementation of solvent effects without outlying charge error | The Journal of Chemical Physics |
| 189 | 1997 |
New Model for Calculation of Solvation Free Energies: Correction of Self-Consistent Reaction Field Continuum Dielectric Theory for Short-Range Hydrogen-Bonding Effects | The Journal of Physical Chemistry | 876 | 1996 | |
On the Validity of Electrostatic Linear Response in Polar Solvents | The Journal of Physical Chemistry | 217 | 1996 | |
Treatment of the outlying charge in continuum solvation models | The Journal of Chemical Physics |
| 726 | 1996 |
A Universal Organic Solvation Model | The Journal of Organic Chemistry |
| 83 | 1996 |
Title | Journal | Journal Categories | Citations | Publication Date |
---|---|---|---|---|
Stability of the Protactinium(V) Mono‐Oxo Cation Probed by First‐Principle Calculations | Chemistry – A European Journal |
| 2024 | |
Limiting factors in the accuracy of DFT calculation for redox potentials | Journal of Computational Chemistry |
| 2024 | |
Prediction of Greenhouse Gas Solubility in Eutectic Solvents Using COSMO-RS | International Journal of Thermophysics |
| 2024 | |
Separation of Ethyl Acetate and Ethanol Azeotropic System by Acetate-Based Ionic Liquid | Journal of Solution Chemistry |
| 2024 | |
Unraveling the sorption mechanisms of ciprofloxacin on the surface of zeolite 4A (001) in aqueous medium by DFT and MC approaches | Applied Surface Science Advances |
| 3 | 2024 |