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University of Stuttgart: Stuttgart, DE

(Institute of Thermodynamics and Thermal Process Engineering)
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Johannes Eller

Works (5)

Predicting Solvation Free Energies from the Minnesota Solvation Database Using Classical Density Functional Theory Based on the PC-SAFT Equation of State

The Journal of Physical Chemistry B
2024-04-18 | Journal article
DOI: 10.1021/acs.jpcb.3c07447
Contributors: Benjamin Bursik; Johannes Eller; Joachim Gross
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Modeling Subsurface Hydrogen Storage With Transport Properties From Entropy Scaling Using the PC‐SAFT Equation of State

Water Resources Research
2022-04 | Journal article
DOI: 10.1029/2021WR030885
Contributors: Johannes Eller; Tim Sauerborn; Beatrix Becker; Ivan Buntic; Joachim Gross; Rainer Helmig
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Adsorption of light gases in covalent organic frameworks: comparison of classical density functional theory and grand canonical Monte Carlo simulations

Microporous and Mesoporous Materials
2021-09 | Journal article
DOI: 10.1016/j.micromeso.2021.111263
Contributors: Christopher Kessler; Johannes Eller; Joachim Gross; Niels Hansen
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Predicting solvation free energies in non-polar solvents using classical density functional theory based on the PC-SAFT equation of state

The Journal of Chemical Physics
2021-06-28 | Journal article
DOI: 10.1063/5.0051201
Contributors: Johannes Eller; Tanja Matzerath; Thijs van Westen; Joachim Gross
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Free-Energy-Averaged Potentials for Adsorption in Heterogeneous Slit Pores Using PC-SAFT Classical Density Functional Theory

Langmuir
2021-03-30 | Journal article
DOI: 10.1021/acs.langmuir.0c03287
Contributors: Johannes Eller; Joachim Gross
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