[Conference Presentation]
Transportation Fuels from Renewable Hydrogen and Green Carbon Dioxide - A Technical, Economic, and Environmental Evaluation
In: AIChE Annual Meeting Minneapolis 2017-10-29 - 2017-11-03, 2017

Bongartz, Dominik (Corresponding author)
Burre, Jannik
Deutz, Sarah
Doré, Larissa
Eichler, Katharina
et al.

[Journal Article]
Development and Application of a Coarse-Grained Model for PNIPAM by Iterative Boltzmann Inversion and Its Combination with Lattice Boltzmann Hydrodynamics
In: The journal of physical chemistry / B, 121 (45), 10394-10406, 2017
[DOI: 10.1021/acs.jpcb.7b07818]

Botan, Vitalie
Ustach, Vincent D.
Leonhard, Kai (Corresponding author)
Faller, Roland (Corresponding author)

[Book, Proceedings]
26. Aachener Kolloquium Fahrzeug- und Motorentechnik : October 9th-11th, 2017 Eurogress Aachen, Germany, 2017

Eckstein, Lutz (Editor)
Pischinger, Stefan (Editor)
Hammermüller, Benedikt (Contributor)
Wolsfeld, Rainer (Contributor)

[Contribution to a book, Contribution to a conference proceedings]
Hybrid Air-Conditioning for Electric Vehicles by Combining a Heating and a Desiccant System
In: 26. Aachener Kolloquium Fahrzeug- und Motorentechnik 2017 : October 9th-11th, 2017 Eurogress Aachen, Germany = 26th Aachen Colloquium Automobile and Engine Technology 2017 / scientific management: Univ.-Prof. Dr.-Ing. Lutz Eckstein, Univ.-Prof. Dr.-Ing. Stefan Pischinger; organizational management: Benedikt Hammermüller, M.SC., Dipl.-Ing. Rainer Wolsfeld ; ika, Institute for Automotive Engineering, RWTH Aachen University, vka, Institute for Combustion Engines, RWTH Aachen University. - 2, 1189-1204, 2017

Bau, Uwe
Schreiber, Heike
Lanzerath, Franz
Bardow, André

[Conference Presentation]
Effiziente Charakterisierung von Dampf-flüssig-Gleichgewichten mittels Raman-Spektroskopie
In: Thermodynamik-Kolloquium Dresden 2017-09-27 - 2017-09-29, 2017

Liebergesell, Bastian
Flake, Carsten
Brands, Thorsten
Koß, Hans-Jürgen
Bardow, André

[Contribution to a book, Contribution to a conference proceedings]
Integrated process and solvent design using COSMO-RS for the production of CO from CO2 and H2
In: 27th European Symposium on Computer Aided Process Engineering / edited by Antonio Espuña, Moisès Graells and Luis Puigjaner (Chemical Engineering Department, Technical University of Catalonia, Barcelona, Spain). - Part B, 1765-1770, 2017
[DOI: 10.1016/B978-0-444-63965-3.50296-8]

Scheffczyk, Jan David
Schäfer, Pascal
Jens, Christian M.
Leonhard, Kai
Bardow, André

[Journal Article]
When 2nd generation biofuel meets water - The water solubility and phase stability issue
In: Fuel : the science and technology of fuel and energy, 209, 615-623, 2017
[DOI: 10.1016/j.fuel.2017.07.110]

Dechambre, Dominique
Thien, Julia Jutta
Bardow, André (Corresponding author)

[Abstract, Contribution to a conference proceedings]
Assessing Statistical Uncertainties of Rare Events in Reactive Molecular Dynamics Simulations
In: [4th International Conference on Computational Engineering, ICCE 2017, 2017-09-28 - 2017-09-29, Darmstadt, Germany], 54-54, 2017

Kröger, Leif Christian (Corresponding author)
Kopp, Wassja Alexander
Döntgen, Malte
Firaha, Dzmitry
Leonhard, Kai (Corresponding author)

[Contribution to a conference proceedings]
Bestimmung des statistischen Fehlers von seltenen Ereignissen in reaktiven molekulardynamischen Simulationen
In: [Thermodynamik-Kolloquium 2017, 2017-09-27 - 2017-09-29, Dresden, Germany], 2017

Kröger, Leif Christian
Kopp, Wassja Alexander
Döntgen, Malte
Leonhard, Kai (Corresponding author)

[Journal Article]
Mechanism of the Unusual Wetting of a Surface Fine Crevice Structure Created by Laser Irradiation
In: Materials transactions, 58 (8), 1227-1230, 2017
[DOI: 10.2320/matertrans.M2017115]

Siboniso, Vilakazi
Yeon, Jaebong
Grozescu, Christian
Goto, Hiroki
Nakamoto, Masashi
et al.

[Contribution to a book, Contribution to a conference proceedings]
Integrated design of ORC process and working fluid using PC-SAFT and Modelica
In: 4th International Seminar on ORC Power Systems September 13-15th 2017, Politecnico Di Milano Bovisa Campus Milano, Italy / Edited by Vincenzo Dossena, Alberto Guardone and Marco Astolfi, 97-104, 2017
[DOI: 10.1016/j.egypro.2017.09.169]

Tillmanns, Dominik
Gertig, Christoph Udo
Schilling, Johannes
Gibelhaus, Andrej
Bau, Uwe
et al.

[Contribution to a book, Contribution to a conference proceedings]
Integrating working fluid design into the thermo-economic design of ORC processes using PC-SAFT
In: 4th International Seminar on ORC Power Systems September 13-15th 2017, Politecnico Di Milano Bovisa Campus Milano, Italy / Edited by Vincenzo Dossena, Alberto Guardone and Marco Astolfi, 121-128, 2017
[DOI: 10.1016/j.egypro.2017.09.179]

Schilling, Johannes
Tillmanns, Dominik
Lampe, Matthias
Hopp, Madlen
Gross, Joachim
et al.

[Contribution to a book, Contribution to a conference proceedings]
Integrated design of ORC process and working fluid using process flowsheeting software and PC-SAFT
In: 4th International Seminar on ORC Power Systems September 13-15th 2017, Politecnico Di Milano Bovisa Campus Milano, Italy / Edited by Vincenzo Dossena, Alberto Guardone and Marco Astolfi, 129-136, 2017
[DOI: 10.1016/j.egypro.2017.09.184]

Schilling, Johannes
Gross, Joachim
Bardow, André (Corresponding author)

[Book, Dissertation / PhD Thesis]
Experiments and Validated Models for Adsorption Thermal Energy Storage in Industrial and Residential Applications
In: Aachener Beiträge zur technischen Thermodynamik 10, 2017
[DOI: 10.18154/RWTH-2017-08146]

Schreiber, Heike

[Journal Article]
A new QSPR-based prediction model for biofuel lubricity
In: Tribology international, 115, 274-284, 2017
[DOI: 10.1016/j.triboint.2017.05.005]

Weinebeck, Alexander
Kaminski, Sebastian
Murrenhoff, Hubertus
Leonhard, Kai (Corresponding author)

[Journal Article]
Dynamic optimisation of adsorber-bed designs ensuring optimal control
In: Applied thermal engineering, 125, 1565-1576, 2017
[DOI: 10.1016/j.applthermaleng.2017.07.073]

Bau, Uwe
Hoseinpoori, Pooya
Graf, Stefan Wilhelm
Schreiber, Heike
Lanzerath, Franz
et al.

[Contribution to a book]
Environmental Assessment of CO2 Utilisation
In: CO2 Utilisation Today : Report 2017 / Arno Zimmermann, Marvin Kant, 24-28, 2017
[DOI: 10.18154/RWTH-2017-07608]

Meys, Raoul
Kätelhön, Arne
Bardow, André

[Conference Presentation]
Life Cycle Assessment of CO2-based Polyurethane Elastomers
In: 15. International Conference on Carbon Dioxide Utilisation Shanghai 2017-07-17 - 2017-07-21, 2017

Meys, Raoul
Kätelhön, Arne
Bardow, André

[Journal Article]
The IR-Large-Temperature-Jump method: Determining heat and mass transfer coefficients for adsorptive heat transformers
In: Applied thermal engineering, 126, 630-642, 2017
[DOI: 10.1016/j.applthermaleng.2017.06.054]

Graf, Stefan Wilhelm
Lanzerath, Franz
Bardow, André (Corresponding author)

[Journal Article]
Assessing Statistical Uncertainties of Rare Events in Reactive Molecular Dynamics Simulations
In: Journal of chemical theory and computation : JCTC, 13 (9), 3955-3960, 2017
[DOI: 10.1021/acs.jctc.7b00524]

Kröger, Leif Christian
Kopp, Wassja Alexander
Döntgen, Malte
Leonhard, Kai (Corresponding author)

[Journal Article]
Round Robin Study: Molecular Simulation of Thermodynamic Properties from Models with Internal Degrees of Freedom
In: Journal of chemical theory and computation : JCTC, 13 (9), 4270-4280, 2017
[DOI: 10.1021/acs.jctc.7b00489]

Schappals, Michael
Mecklenfeld, Andreas
Kröger, Leif Christian
Botan, Vitalie
Köster, Andreas
et al.

[Journal Article]
Multicomponent diffusion coefficients from microfluidics using Raman microspectroscopy
In: Lab on a chip, 17 (16), 2768-2776, 2017
[DOI: 10.1039/C7LC00433H]

Peters, Christine Jutta
Wolff, Ludger Wolfgang Michael
Haase, Sandra Christine
Thien, Julia Jutta
Brands, Thorsten
et al.

[Poster]
The environmental footprint captured CO2 as carbon resource
In: Gordon Research Conference on Carbon Capture, Utilization and Storage New London, NH 2017-06-11 - 2017-06-16, 2017

Müller, Leonard Jan
Kätelhön, Arne
von der Aßen, Niklas Vincenz
Bardow, André

[Conference Presentation]
Environmental impact reduction potential from well-to-wheel CO2-based oxymethylene ethers as blending component
In: 5. International Conference Tailor-Made Fuels - From Production to Propulsion Aachen 2017-06-20 - 2017-06-22, 2017

Deutz, Sarah
Bongartz, Dominik
Heuser, Benedikt
Schulze Langenhorst, Luisa
Walters, Marius
et al.

[Poster]
Flame-temperature and CO measurements by spontaneous raman scattering in non-sooting diesel-like jets
In: 5. International Conference 2017 Tailor-Made Fuels - From Production to Propulsion Aachen 2017-06-20 - 2017-06-22, 2017

Raffius, Thomas Michael
Schulz, Christian
Ottenwälder, Tamara Sophia
Grünefeld, Gerd
Koß, Hans-Jürgen
et al.

[Contribution to a conference proceedings]
Time-series aggregation to typical periods with bounded error in objective function for energy systems synthesis
In: [The 30th International Conference On Efficiency, Cost, Optimization, Simulation And Environmental Impact Of Energy Systems, ECOS 2017, 2017-07-02 - 2017-07-06, San Diego, CA, USA], 1-12, 2017

Bahl, Björn
Söhler, Theo
Hennen, Maike Renate
Bardow, André

[Journal Article]
Time-series aggregation for synthesis problems by bounding error in the objective function
In: Energy : the international journal, 135, 900-912, 2017
[DOI: 10.1016/j.energy.2017.06.082]

Bahl, Björn
Kümpel, Alexander
Seele, Hagen
Lampe, Matthias
Bardow, André (Corresponding author)

[Journal Article]
Optimization-based identification and quantification of demand-side management potential for distributed energy supply systems
In: Energy : the international journal, 135, 889-899, 2017
[DOI: 10.1016/j.energy.2017.06.083]

Bahl, Björn
Lampe, Matthias
Voll, Philip
Bardow, André (Corresponding author)

[Journal Article]
Simple two-step assessment of novel adsorbents for drying: The trade-off between adsorber size and drying time
In: Applied thermal engineering, 125, 1075-1082, 2017
[DOI: 10.1016/j.applthermaleng.2017.07.014]

Erdogan, Meltem
Graf, Stefan Wilhelm
Bau, Uwe
Lanzerath, Franz
Bardow, André (Corresponding author)

[Conference Presentation]
Technology Choice Model for Climate Policy Assessment
In: 9. biennial conference of the International Society for Industrial Ecology (ISIE) and the 25th annual conference of the International Symposium on Sustainable Systems and Technology (ISSST) Chicago, IL 2017-06-25 - 2017-06-29, 2017

Kätelhön, Arne
Bardow, André
Suh, Sangwon

[Conference Presentation]
Modeling changes in technology-mixes due to climate policy
In: 25. IIOA Conference Atlantic City 2017-06-19 - 2017-06-23, 2017

Kätelhön, Arne
Bardow, André
Suh, Sangwon

[Journal Article]
From molecules to dollars: integrating molecular design into thermo-economic process design using consistent thermodynamic modeling
In: Molecular systems design & engineering, 2 (3), 301-320, 2017
[DOI: 10.1039/C7ME00026J]

Schilling, Johannes
Tillmanns, Dominik
Lampe, Matthias
Hopp, M.
Gross, J.
et al.

[Contribution to a conference proceedings, Journal Article]
SPREAD - Exploring the decision space in energy systems synthesis
In: Computers & chemical engineering, 106, 297-308, 2017
[DOI: 10.1016/j.compchemeng.2017.06.002]

Hennen, Maike Renate
Lampe, Matthias
Voll, Philip
Bardow, André (Corresponding author)

[Poster]
Fundamental investigation of the oxidation kinetics of dimethoxy methane
In: 5. International Conference 2017 Tailor-Made Fuels - From Production to Propulsion Aachen 2017-06-20 - 2017-06-22, 2017

Jacobs, Sascha (Corresponding author)
Burke, Ultan
Kröger, Leif Christian
Kopp, Wassja Alexander
Döntgen, Malte
et al.

[Poster]
Experimental and theoretical study of the kinetics and reactions mechanism of dimethoxy methane
In: 8. European Combustion Meeting Dubrovnik 2017-04-18 - 2017-04-21, 2017

Jacobs, Sascha (Corresponding author)
Burke, Ultan
Kröger, Leif Christian
Kopp, Wassja Alexander
Döntgen, Malte
et al.

[Conference Presentation]
Experimental and Numerical Kinetics Study of a Novel Biofuel for Spark-ignition Engine Combustion: Cyclopentanol
In: 5. International Conference 2017 Tailor-Made Fuels - From Production to Propulsion Aachen 2017-06-20 - 2017-06-22, 2017

Cai, Liming (Corresponding author)
Ramalingam, Ajoy Kumar
Döntgen, Malte
Kruse, Stephan
Minwegen, Heiko Julian
et al.

[Journal Article]
A milliliter-scale setup for the efficient characterization of isothermal vapor-liquid equilibria using Raman spectroscopy
In: Fluid phase equilibria, 446, 36-45, 2017
[DOI: 10.1016/j.fluid.2017.04.014]

Liebergesell, Bastian
Flake, Carsten
Brands, Thorsten
Koß, Hans-Jürgen
Bardow, André (Corresponding author)

[Contribution to a book, Contribution to a conference proceedings]
Integrated Process and Molecular Design with Modelica Using Continuous-Molecular Targeting
In: Proceedings of the 12th International Modelica Conference : May 15-17, 2017, Clarion Congress Hotel Prague, Czech Republic / the conference is organized by The Czech Society for Cybernetics and Informatics (ČSKI) and Politecnico di Milano in cooperation with the Modelica Association ; editors: Doc. MUDr. Jiří Kofránek, CSc. and Prof. Francesco Casella, 101-110, 2017
[DOI: 10.3384/ecp17132101]

Gertig, Christoph Udo
Tillmanns, Dominik
Schilling, Johannes
Bau, Uwe
Lanzerath, Franz
et al.

[Poster]
Dissociation cascades of oxymethylene ethers
In: 8. European Combustion Meeting Dubrovnik 2017-04-18 - 2017-04-21, 2017

Döntgen, Malte
Wächter, Daniel
Kröger, Leif Christian
Kopp, Wassja Alexander
Leonhard, Kai (Corresponding author)

[Poster]
Hydrogen Abstraction and Subsequent beta-Scission of Dimethoxymethane
In: 8. European Combustion Meeting Dubrovnik 2017-04-18 - 2017-04-21, 2017

Kröger, Leif Christian
Kopp, Wassja Alexander
Döntgen, Malte
Jacobs, Sascha
Burke, Ultan
et al.

[Book, Dissertation / PhD Thesis]
Reaction models from reactive molecular dynamics and high-level kinetics predictions
In: Aachener Beiträge zur technischen Thermodynamik 9, 2017

Döntgen, Malte

[Journal Article]
Life cycle assessment of CO 2 -based C1-chemicals
In: Green chemistry : GC, TBD, 1-44, 2017
[DOI: 10.1039/C6GC02852G]

Sternberg, André Dirk
Jens, Christian M.
Bardow, André (Corresponding author)

[Journal Article]
Discussion of the Separation of Chemical and Relaxational Kinetics of Chemically Activated Intermediates in Master Equation Simulations
In: The journal of physical chemistry / A, 121 (8), 1563-1570, 2017
[DOI: 10.1021/acs.jpca.6b12927]

Döntgen, Malte (Corresponding author)
Leonhard, Kai

[Journal Article]
Towards low carbon business park energy systems: A holistic techno-economic optimisation model
In: Energy : the international journal, 125, 747-770, 2017
[DOI: 10.1016/j.energy.2017.02.081]

Timmerman, Jonas (Corresponding author)
Hennen, Maike Renate
Bardow, André
Lodewijks, Pieter
Vandevelde, Lieven
et al.

[Journal Article]
Improved Property Predictions by Combination of Predictive Models
In: Industrial & engineering chemistry, 56 (11), 3098-3106, 2017
[DOI: 10.1021/acs.iecr.6b03125]

Kaminski, Sebastian
Kirgios, Evagelos
Bardow, André
Leonhard, Kai (Corresponding author)

[Journal Article]
Refrigeration below zero °C: Adsorption chillers using water with ethylene glycol as antifreeze
In: International journal of refrigeration, 77, 39-47, 2017
[DOI: 10.1016/j.ijrefrig.2017.02.025]

Seiler, Jan Michael
Hackmann, Jonas
Lanzerath, Franz
Bardow, André (Corresponding author)

[Journal Article]
Prediction of Chain Propagation Rate Constants of Polymerization Reactions in Aqueous NIPAM/BIS and VCL/BIS Systems
In: The journal of physical chemistry / B, 121 (13), 2887-2895, 2017
[DOI: 10.1021/acs.jpcb.6b09147]

Kröger, Leif Christian
Kopp, Wassja Alexander
Leonhard, Kai (Corresponding author)

[Contribution to a book, Journal Article]
Editorial to iCAMD special issue
In: Chemical engineering science, 159, 1-2, 2017
[DOI: 10.1016/j.ces.2016.12.038]

Adjiman, Claire
Bardow, André

[Journal Article]
Experimental and numerical study of a novel biofuel: 2-Butyltetrahydrofuran
In: Combustion and flame, 178, 257-267, 2017
[DOI: 10.1016/j.combustflame.2016.12.021]

Cai, Liming (Corresponding author)
Minwegen, Heiko Julian
Beeckmann, Joachim
Burke, Ultan
Tripathi, Rupali
et al.

[Book]
iCAMD - Integrating Computer-Aided Molecular Design into Product and Process Design
In: Chemical engineering science, 159, 230 Seiten, 2016

Adjiman, Claire (Editor)
Bardow, André (Editor)