Publications

Salting-out effects by pressure-corrected 3D-RISM

Misin Maksim, Vainikka Petteri A., Fedorov Maxim V., Palmer David S.

Journal of Chemical Physics, (2016)

Predicting solvation free energies using parameter-free solvent models

Misin Maksim, Palmer David S., Fedorov Maxim V.

Journal of Physical Chemistry B, (2016)

http://dx.doi.org/10.1021/acs.jpcb.6b05352

Molecular simulation methods to compute intrinsic aqueous solubility of crystalline drug-like molecules

Palmer D. S., Fedorov M.V.

Computational Pharmaceutical Solid State ChemistryComputational Pharmaceutical Solid State Chemistry, (2016)

Quantifying mineral surface energy by scanning force microscopy

Sauerer Bastian, Stukan Mikhail, Abdallah Wael, Derkani Maryam H., Fedorov Maxim, Buiting Jan, Zhang Zhenyu

Journal of Colloid and Interface Science Vol 472, pp. 237-246, (2016)

http://dx.doi.org/10.1016/j.jcis.2016.03.049

Hydration free energies of molecular ions from theory and simulation

Misin Maksim, Fedorov Maxim, Palmer David

Journal of Physical Chemistry B Vol 120, pp. 975-983, (2016)

http://dx.doi.org/10.1021/acs.jpcb.5b10809

Molecular origin of high free energy barriers for alkali metal ion transfer through ionic liquid–graphene electrode interfaces

Ivanistsev Vladislav, Méndez-Morales Trinidad, Lynden-Bell Ruth M., Varela Luis M., Cabeza Oscar, Gallego Luis J., Varela Luis M., Fedorov Maxim V.

Physical Chemistry Chemical Physics Vol 18, pp. 1302-1310, (2016)

http://dx.doi.org/10.1039/c5cp05973a

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Professional activities

PHD External Examiner University of Lille 1 (France)

External Examiner

9/12/2011

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Projects

Epsrc Doctoral Training Grant | Orr, Rosemary

Fedorov, Maxim (Principal Investigator) Hunt, Neil (Co-investigator) Orr, Rosemary (Research Co-investigator)

Period 01-Oct-2012 - 16-Mar-2018

Understanding the colloidal interactions at rock/oil interface via combination of direct measurements and large-scale molecular simulation

Fedorov, Maxim (Co-investigator)

Period 01-Jan-2015 - 30-Jun-2018

Schlumberger grant "Experimental and theoretical approaches for interfacial properties"

Fedorov, Maxim (Principal Investigator)

Period 15-Sep-2014 - 31-Dec-2014

Large-scale simulations of petrophysically relevant aqueous brine solutions

Fedorov, Maxim (Principal Investigator)

Period 01-Sep-2013 - 30-Sep-2015

SME Engagement Springboard for Archie-West

Mulheran, Paul (Principal Investigator) Fedorov, Maxim (Co-investigator)

Period 21-Jan-2014 - 20-Jan-2015

Ultrafast Laser Facility for Advanced Spectroscopy Applications

McKee, David (Principal Investigator) Ackemann, Thorsten (Co-investigator) Fedorov, Maxim (Co-investigator) Hoskisson, Paul (Co-investigator) Hunt, Neil (Co-investigator) Tucker, Nicholas (Co-investigator)

Equipment sharing grant, £36,0000

Period 01-Jan-2012 - 30-Jun-2012

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