Marc Theiss

Guide to efficient solution of PC-SAFT classical Density Functional Theory in various Coordinate Systems using fast Fourier and similar Transforms

J. Gross, E. Sauer, R. Stierle, 2020 .

A third and fourth order perturbation theory for dipolar hard spheres.

J. Gross, Marc Theiss, 2018, The Journal of chemical physics.

Prediction of Contact Angles and Density Profiles of Sessile Droplets Using Classical Density Functional Theory Based on the PCP-SAFT Equation of State.

J. Gross, B. Weigand, A. Terzis, 2018, Langmuir : the ACS journal of surfaces and colloids.

Perturbation approaches for describing dipolar fluids and electrolyte solutions.

J. Gross, Marc Theiss, 2020, The Journal of chemical physics.

An equation of state for Stockmayer fluids based on a perturbation theory for dipolar hard spheres.

J. Gross, Thijs van Westen, Marc Theiss, 2019, The Journal of chemical physics.

Nonprimitive Model Electrolyte Solutions: Comprehensive Data from Monte Carlo Simulations

J. Gross, Marc Theiss, 2020 .

Dipolar Hard Spheres: Comprehensive Data from Monte Carlo Simulations

J. Gross, Marc Theiss, 2019, Journal of Chemical & Engineering Data.