Herr Prof. Dr.-Ing.

Joachim Groß

Studiendekan der Verfahrenstechnik, Institutsleiter
Institut für Technische Thermodynamik und Thermische Verfahrenstechnik

Kontakt

+49 711 685-66105

Pfaffenwaldring 9
70569 Stuttgart
Deutschland
Raum: 1.342

  1. 2018

    1. Rehner, P., & Groß, J. (2018). Surface tension of droplets and Tolman lengths of real substances and mixtures from density functional theory. The Journal of Chemical Physics, 148(16), 164703. https://doi.org/10.1063/1.5020421
  2. 2017

    1. Hopp, M., & Gross, J. (2017). Thermal Conductivity of Real Substances from Excess Entropy Scaling    Using PCP-SAFT. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 56(15), 4527–4538. https://doi.org/10.1021/acs.iecr.6b04289
    2. Westen, T. van, & Groß, J. (2017). A critical evaluation of perturbation theories by Monte Carlo simulation of the first four perturbation terms in a Helmholtz energy expansion for the Lennard-Jones fluid. JOURNAL OF CHEMICAL PHYSICS, 147(1). https://doi.org/10.1063/1.4991008
    3. Schilling, J., Lampe, M., Gross, J., & Bardow, A. (2017). 1-stage CoMT-CAMD: An approach for integrated design of ORC process and working fluid using PC-SAFT. CHEMICAL ENGINEERING SCIENCE, 159, 217–230. https://doi.org/10.1016/j.ces.2016.04.048
    4. Terzis, A., Roumeli, E., Weishaupt, K., Brack, S., Aslannejad, H., Groß, J., … Weigand, B. (2017). Heat release at the wetting front during capillary filling of cellulosic micro-substrates. JOURNAL OF COLLOID AND INTERFACE SCIENCE, 504, 751–757. https://doi.org/10.1016/j.jcis.2017.06.027
    5. Sauer, E., & Gross, J. (2017). Classical Density Functional Theory for Liquid-Fluid Interfaces and Confined Systems: A Functional for the Perturbed-Chain Polar Statistical Associating Fluid Theory Equation of State. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 56(14), 4119–4135. https://doi.org/10.1021/acs.iecr.6b04551
    6. Mairhofer, J., & Gross, J. (2017a). Modeling of interfacial properties of multicomponent systems using density gradient theory and PCP-SAFT. FLUID PHASE EQUILIBRIA, 439, 31–42. https://doi.org/10.1016/j.fluid.2017.02.009
    7. Mairhofer, J., & Gross, J. (2017b). Numerical aspects of classical density functional. theory for one-dimensional vapor-liquid interfaces. FLUID PHASE EQUILIBRIA, 444, 1–12. https://doi.org/10.1016/j.fluid.2017.03.023
    8. Bauer, G., Gribova, N., Lange, A., Holm, C., & Groß, J. (2017). Three-body effects in triplets of capped gold nanocrystals. MOLECULAR PHYSICS, 115(9–12, SI), 1031–1040. https://doi.org/10.1080/00268976.2016.1213909
  3. 2016

    1. van Westen, T., Vlugt, T. J. H., & Groß, J. (2016). On the vapor-liquid equilibrium of attractive chain fluids with variable    degree of molecular flexibility (vol 142, 224504, 2015). JOURNAL OF CHEMICAL PHYSICS, 145(23). https://doi.org/10.1063/1.4971164
    2. Lötgering-Lin, O., Schoeniger, A., Nowak, W., & Groß, J. (2016). Bayesian Model Selection Helps To Choose Objectively between    Thermodynamic Models: A Demonstration of Selecting a Viscosity Model    Based on Entropy Scaling. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 55(38), 10191–10207. https://doi.org/10.1021/acs.iecr.6b02671
    3. Drunsel, F., & Groß, J. (2016b). Theory of model electrolyte solutions: Assessing the short- and    long-ranged contributions by molecular simulations. FLUID PHASE EQUILIBRIA, 430, 195–206. https://doi.org/10.1016/j.fluid.2016.09.026
    4. Weidler, D., & Groß, J. (2016). Transferable Anisotropic United-Atom Force Field Based on the Mie    Potential for Phase Equilibria: Aldehydes, Ketones, and Small Cyclic    Alkanes. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 55(46), 12123–12132. https://doi.org/10.1021/acs.iecr.6b02182
    5. Stavrou, M., Bardow, A., & Groß, J. (2016). Estimation of the binary interaction parameter k(ij) of the PC-SAFT    Equation of State based on pure component parameters using a QSPR method. FLUID PHASE EQUILIBRIA, 416(SI), 138–149. https://doi.org/10.1016/j.fluid.2015.12.016
    6. Zmpitas, W., & Groß, J. (2016a). A new equation of state for linear hard chains: Analysis of a    third-order expansion of Wertheim’s Thermodynamic Perturbation Theory. FLUID PHASE EQUILIBRIA, 416(SI), 18–26. https://doi.org/10.1016/j.fluid.2015.11.017
    7. Drunsel, F., & Groß, J. (2016a). Chemical potential of model electrolyte solutions consisting of hard    sphere ions and hard dipoles from molecular simulations. FLUID PHASE EQUILIBRIA, 429, 205–213. https://doi.org/10.1016/j.fluid.2016.08.039
    8. Zmpitas, W., & Groß, J. (2016b). Detailed pedagogical review and analysis of Wertheim’s thermodynamic    perturbation theory. FLUID PHASE EQUILIBRIA, 428(SI), 121–152. https://doi.org/10.1016/j.fluid.2016.07.033
  4. 2015

    1. Lange, A., Danecker, F., Bauer, G., Gribova, N., & Gross, J. (2015). Different ways of looking at the force between two nanocrystals. JOURNAL OF CHEMICAL PHYSICS, 143(24). https://doi.org/10.1063/1.4937395
    2. Hemmen, A., Panagiotopoulos, A. Z., & Gross, J. (2015). Grand Canonical Monte Carlo Simulations Guided by an Analytic Equation    of State-Transferable Anisotropic Mie Potentials for Ethers. JOURNAL OF PHYSICAL CHEMISTRY B, 119(23), 7087–7099. https://doi.org/10.1021/acs.jpcb.5b01806
    3. Bauer, G., Lange, A., Gribova, N., Holm, C., & Groß, J. (2015). Effective potentials between gold nano crystals - functional dependence    on temperature. MOLECULAR SIMULATION, 41(14), 1153–1158. https://doi.org/10.1080/08927022.2014.951521
    4. Klink, C., Waibel, C., & Gross, J. (2015). Analysis of Interfacial Transport Resistivities of Pure Components and    Mixtures Based on Density Functional Theory. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 54(45), 11483–11492. https://doi.org/10.1021/acs.iecr.5b03270
    5. van Westen, T., Vlugt, T. J. H., & Gross, J. (2015). On the vapor-liquid equilibrium of attractive chain fluids with variable    degree of molecular flexibility. JOURNAL OF CHEMICAL PHYSICS, 142(22). https://doi.org/10.1063/1.4922264
    6. van Westen, T., Oyarzun, B., Vlugt, T. J. H., & Gross, J. (2015). An analytical equation of state for describing isotropic-nematic phase    equilibria of Lennard-Jones chain fluids with variable degree of    molecular flexibility. JOURNAL OF CHEMICAL PHYSICS, 142(24). https://doi.org/10.1063/1.4922921
    7. Hemmen, A., & Gross, J. (2015). Transferable Anisotropic United-Atom Force Field Based on the Mie    Potential for Phase Equilibrium Calculations: n-Alkanes and n-Olefins. JOURNAL OF PHYSICAL CHEMISTRY B, 119(35), 11695–11707. https://doi.org/10.1021/acs.jpcb.5b01354
    8. Lampe, M., Stavrou, M., Schilling, J., Sauer, E., Gross, J., & Bardow, A. (2015). Computer-aided molecular design in the continuous-molecular targeting    framework using group-contribution PC-SAFT. COMPUTERS & CHEMICAL ENGINEERING, 81(SI), 278–287. https://doi.org/10.1016/j.compchemeng.2015.04.008
    9. Loetgering-Lin, O., & Gross, J. (2015). Group Contribution Method for Viscosities Based on Entropy Scaling Using    the Perturbed-Chain Polar Statistical Associating Fluid Theory. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 54(32), 7942–7952. https://doi.org/10.1021/acs.iecr.5b01698
    10. Klink, C., Plankova, B., & Gross, J. (2015). Density Functional Theory for Liquid-Liquid Interfaces of Mixtures Using    the Perturbed-Chain Polar Statistical Associating Fluid Theory Equation    of State. INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 54(16), 4633–4642. https://doi.org/10.1021/acs.iecr.5b00445
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