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Gregor Deichmann

3PUBLICATIONS

1CO-AUTHORS

Computational chemistryCondensed matter modelling and density functional theoryStatistical mechanics in chemistry

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Publications (3)

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|Jan 12, 2019

Conditional Reversible Work Coarse-Grained Models with Explicit Electrostatics-An Application to Butylmethylimidazolium Ionic Liquids.

Gregor Deichmann, Nico F A van der Vegt

|Dec 20, 2018

Phase Equilibria Modeling with Systematically Coarse-Grained Models-A Comparative Study on State Point Transferability.

Gregor Deichmann, Marco Dallavalle, David Rosenberger

|Nov 22, 2017

Conditional Reversible Work Coarse-Grained Models of Molecular Liquids with Coulomb Electrostatics - A Proof of Concept Study on Weakly Polar Organic Molecules.

Gregor Deichmann, Nico F A van der Vegt

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Frequent Collaborators

3 joint publications

Nico F A van der Vegt

Frequent Collaborators

3 joint publications

Nico F A van der Vegt

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