[Journal Article]
Ab Initio Calculations of Thermochemical Properties of Methanol Clusters
In: The journal of physical chemistry / A, Molecules, spectroscopy, kinetics, environment & general theory, 117 (7), 1569-1582, 2013
[DOI: 10.1021/jp308908j]

Umer, Muhammad
Leonhard, Kai (Corresponding author)

[Contribution to a book, Journal Article]
Chiral separation by combining pertraction and preferential crystallization
In: Chemical engineering and processing, 67 (SI), 80-88, 2012
[DOI: 10.1016/j.cep.2012.09.002]

Robl, Simone (Corresponding author)
Gou, Linzhu
Gere, Annamaria
Sordo, Magdalena
Lorenz, Heike
et al.

[Journal Article]
Automated superstructure-based synthesis and optimization of distributed energy supply systems
In: Energy : the international journal, 50 (1), 374-388, 2013
[DOI: 10.1016/j.energy.2012.10.045]

Voll, Philip
Klaffke, Carsten
Hennen, Maike Renate
Bardow, André (Corresponding author)

[Poster]
Ab-initio Calculations : a Source of PC-SAFT Parameters
In: Industrial Use of Molecular Thermodynamics 2012 Lyon 2012-03-19 - 2012-03-20, 2012

Leonhard, Kai
Umer, M.
Albers, K.
Sadowski, G.

[Poster]
First steps towards a quantitative modeling of the solvent influence on lignin fractionation
In: Green Solvents for Synthesis Boppard 2012-10-08 - 2012-10-10, 2012

Yamin, Peyman
Leonhard, Kai

[Conference Presentation]
An Experimental and Kinetic Modelling Study of Butyl Formate Combustion
In: 5. TMFB International Workshop Aachen 2012-06-06 - 2012-06-14, 2012

Vranckx, S.
Lee, C.
Fernandes, R.
Uygun, Y.
Olivier, H.
et al.

[Conference Presentation]
Ab-initio Rechnungen : eine Quelle für PC-SAFT Parameter
In: Thermodynamik-Kolloquium 2012 Potsdam 2012-10-08 - 2012-10-10, 2012

Leonhard, Kai
Umer, M.
Albers, K.
Sadowski, G.

[Poster]
Diffusionskoeffizienten in Hydrogelen mittels 1D-Ramanspektroskopie
In: ProcessNet-Jahrestagung Karlsruhe 2012-09-10 - 2012-09-13, 2012

Beumers, Peter Christoph
Masuch, Kai
Pauls, Christoph
Bardow, André

[Dissertation / PhD Thesis]
Entwicklung eines Softwarepakets zur Simulation industrieller Produktionsprozesse unter energetischen Gesichtspunkten
In: Berichte aus der Energietechnik, 2012

Kirschbaum, Stefan

[Journal Article]
James E. Funk (November 8, 1932-May 13, 2012)
In: International journal of hydrogen energy, 37 (20), 14983-14983, 2012
[DOI: 10.1016/j.ijhydene.2012.07.116]

Knoche, Karl-Friedrich

[Journal Article]
Fick Diffusion Coefficients in Ternary Liquid Systems from Equilibrium Molecular Dynamics Simulations
In: Industrial & engineering chemistry research : I & EC research, 51 (30), 10247-10258, 2012
[DOI: 10.1021/ie301009v]

Liu, Xin
Martin-Calvo, Ana
McGarrity, Erin
Schnell, Sondre K.
Calero, Sofia
et al.

[Journal Article]
A new way for energy supplying in the beer industry
In: Journal of environmental protection and ecology, 13 (4), 2331-2337, 2012

Diaconu, A.
Russ, W.
Klitzing, B.
Ionel, I.

[Contribution to a conference proceedings, Poster]
Systematic Model-Based Design of Experiments for the Data-Reduction of Liquid-Liquid Equilibria
In: Thermodynamik-Kolloquium, Potsdam : Oct 8-10, 2012 - together with ESAT, 2012

Dechambre, Dominique
Pauls, Christoph
Leonhard, Kai
Greiner, Lasse
Bardow, André

[Poster]
Rapid determination of multicomponent diffusion using microfluidics
In: 26. European Symposium on applied Thermodynamics (ESAT 2012), Potsdam 7-10 October, 2012

Peters, Christine Jutta
Yalcin, Sinan
Pauls, Christoph
Bardow, André

[Poster]
The Dos and Don’ts of Life Cycle Assessment for Carbon Capture and Utilization
In: CO2 Forum 2012 : Second Edition, Lyon, France, September 27-28, 2012

von der Aßen, Niklas Vincenz
Jung, Johannes
Bardow, André

[Contribution to a book, Contribution to a conference proceedings, Poster]
Sorption Systems Engineering
In: Heat powered cycles 2012 : ECN, Alkmaar, 10-12 September 2012 : conference proceedings / M. Tierney; M. van der Pal; Ian W. Eames, 2012

Schreiber, Heike
Lanzerath, Franz
Erdogan, Meltem
Bardow, André

[Contribution to a conference proceedings, Poster]
Von Quantenmechanik zur Prozessentwicklung : von Holz zum Kraftstoff
In: Posterausstellung der 127. Versammlung der Gesellschaft deutscher Naturforscher und Ärzte (GDNÄ), Göttingen, 14. - 18. September, 2012

Yamin, Peyman

[Poster]
Erste Schritte zur quantitativen Modellierung des Lösungsmitteleinflusses auf die Lignin-Spaltung
In: ProcessNet-Jahrestagung und 30. DECHEMA-Jahrestagung der Biotechnologen 2012 : 10. - 13. September 2012, Kongresszentrum Karlsruhe, 2012

Yamin, Peyman
Leonhard, Kai

[Abstract, Contribution to a conference proceedings]
Integrating cogeneration and heat storage for an energy-efficient industrial batch process
In: 7th International Renewable Energy Storage Conference and Exhibition (IRES 2012) : November bcc Berlin Congress Center November 12-14, 2012, 2012

Schreiber, Heike
Klitzing, Birger
Lanzerath, Franz
Gebhardt, Andreas
Bardow, André

[Poster]
Molecular Modeling for Fuel Design
In: 5. TMFB International Workshop, Cluster of Excellence Tailor-Made Fuels from Biomass Aachen 2012-06-13 - 2012-06-14, 2012

Yamin, Peyman
Kopp, Wassja Alexander
Schwarz, Annett
Umer, Muhammad
Leonhard, Kai

[Contribution to a conference proceedings, Journal Article, Poster]
Molekulare Optimierung von Lösungsmitteln für die Ameisensäure-Synthese zur Speicherung von CO2 und H2
In: Chemie - Ingenieur - Technik : CIT, 84 (8), 1280-1281, 2012
[DOI: 10.1002/cite.201250176]

Bardow, André (Corresponding author)
Jens, Christian
Nowakowski, Kristina
Gertig, Christoph Udo
Leonhard, Kai
et al.

[Contribution to a conference proceedings, Poster]
On strong and poor arguments for carbon capture and utilization: an LCA perspective
In: 6th SETAC World Congress 2012: SETAC Europe 22nd Annual Meeting ; Berlin 20-24 May. - Pt. 2, MO 111, 2012

von der Aßen, Niklas Vincenz
Jung, Johannes
Bardow, André

[Contribution to a conference proceedings, Poster]
GHG emission reductions for utilization of carbon dioxide with hydrogen
In: [1st Conference on CO2 as Feedstock for Chemicals and Polymers, Essen, Germany, October 10-11], 2012

Sternberg, André Dirk
von der Aßen, Niklas Vincenz
Bardow, André

[Abstract, Contribution to a conference proceedings]
Beyond storage efficiencies : Environmental assessment of hydrogen storage and conversion technologies
In: Proceedings of 7th International Renewable Energy Storage Conference and Exhibition (IRES 2012), Berlin, Germany, November 12-14, 2012

Sternberg, André Dirk
Bardow, André

[Conference Presentation]
Rapid Multicomponent Diffusion and Measurements using Microfluidics
In: 3. European Conference on Microfluidics - Microfluidics 2012 - Heidelberg, Germany, December 3-5, 2012

Peters, Christine Jutta
Yalcin, Sinan
Pauls, Christoph
Bardow, André

[Conference Presentation]
Application and Development of the COSMO-RS Model in the TMFB Cluster
In: 5. TMFB International Workshop Aachen 2012-06-13 - 2012-06-14, 2012

Isele-Holder, Rolf E.
Yamin, Peyman
Schwarz, Annett
Ismail, Ahmed E.
Leonhard, Kai

[Contribution to a book, Contribution to a conference proceedings]
Assessing the environmental potential of carbon dioxide utilization : a graphical targeting approach
In: 11th International Symposium on Process Systems Engineering : [PSE 2012 ; 15 - 19 July 2012, Singapore] / ed. by Iftekhar A. Karimi; Rajagopalan Srinivasan. - Pt. B, 1407-1411, 2012

Dumont, Marie-Noëlle
von der Aßen, Niklas Vincenz
Sternberg, André Dirk
Bardow, André

[Contribution to a book, Contribution to a conference proceedings]
Synthesis and Optimization of Distributed Energy Supply Systems using Automated Superstructure and Model Generation
In: 11th International Symposium on Process Systems Engineering, 1712-1716, 2012
[DOI: 10.1016/B978-0-444-59506-5.50173-5]

Voll, Philip
Klaffke, Carsten
Hennen, Maike Renate
Kirschbaum, Stefan
Bardow, André

[Contribution to a book, Contribution to a conference proceedings]
Simultaneous process and working fluid optimisation for Organic Rankine Cycles (ORC) using PC-SAFT
In: 22nd European Symposium on Computer Aided Process Engineering / ed. by Ian David Lockhart Bogle ..., 572-576, 2012
[DOI: 10.1016/B978-0-444-59519-5.50115-5]

Lampe, Matthias
Groß, Joachim
Bardow, André

[Contribution to a conference proceedings]
Automated Superstructure Generation and Optimization of Distributed Energy Supply Systems
In: CAPE Forum 2012 Veszprém, Ungarn 26 - 28 March, 2012

Voll, Philip
Klaffke, Carsten
Hennen, Maike Renate
Bardow, André

[Contribution to a book, Contribution to a conference proceedings]
Automated Superstructure Generation and Optimization of Distributed Energy Supply Systems
In: ECOS 2012 : The 25th International Conference on Efficiency, Cost, Optimization and Simulation of Energy Conversion Systems and Processes (Perugia, June 26th-June 29th, 2012) / E Sciubba ; Giampaolo Manfrida ; Umberto Desideri, 42-54, 2012

Voll, Philip
Klaffke, Carsten
Hennen, Maike Renate
Bardow, André

[Contribution to a conference proceedings]
Ab-initio Rechnungen : eine Quelle für PC-SAFT Parameter
In: VDI-Thermodynamik-Kolloquium 4.10.-6.10. (2011), Frankfurt, 2012

Leonhard, Kai
Umer, Muhammad
Albers, Katja
Sadowski, Gabriele

[Contribution to a conference proceedings, Poster]
Allocation vs. System Expansion : a Systematic Comparative Framework Using Matrix-BasedSensitivity Coefficients
In: Proceedings of EcoBalance 2012, 10th International Conference on EcoBalance, Yokohama, Japan, P-107, 2012

Jung, Johannes
von der Aßen, Niklas Vincenz
Bardow, André

[Journal Article]
Quantitative Fuel-Air-Mixing Measurements in Diesel-Like Sprays Emanating from Convergent and Divergent Multi-Layer Nozzles
In: SAE International journal of engines, 5 (2), 430-445, 2012
[DOI: 10.4271/2012-01-0464]

Brands, Thorsten
Hottenbach, Peter
Koß, Hans-Jürgen
Grünefeld, Gerd
Pischinger, Stefan
et al.

[Journal Article]
Rapid Microfluidic Screening of CO2 Solubility and Diffusion in Pure and Mixed Solvents
In: LAB on a chip, 12 (18), 3387-3391, 2012
[DOI: 10.1039/C2LC40260B]

Lefortier, Stephanie
Hamersma, Peter
Bardow, André
Kreutzer, Michiel T.

[Journal Article]
Prediction of phase equilibria in systems containing large flexible molecules using COSMO-RS: State-of-the-problem
In: Fluid phase equilibria, 334, 37-42, 2012
[DOI: 10.1016/j.fluid.2012.07.021]

Mokrushina, Liudmila
Yamin, Peyman
Sponsel, Elke
Arlt, Wolfgang

[Journal Article]
What is Wrong with Quantitative Structure-Property Relations Models Based on Three-Dimensional Descriptors?
In: Journal of chemical information and modeling, 52 (8), 1984-1993, 2012
[DOI: 10.1021/ci300246m]

Hechinger, Manuel
Leonhard, Kai
Marquardt, Wolfgang

[Journal Article]
Comparative LCA of multi-product processes with non-common products : a systematic approach applied to chlorine electrolysis technologies
In: The international journal of life cycle assessment, 18 (4), 828-839, 2012
[DOI: 10.1007/s11367-012-0531-7]

Jung, Johannes
von der Aßen, Niklas Vincenz
Bardow, André (Corresponding author)

[Contribution to a book, Contribution to a conference proceedings, Journal Article]
Superstructure-free Synthesis and Optimization of Distributed Energy Supply Systems
In: Energy : the international journal, 45 (1), 424-435, 2012
[DOI: 10.1016/j.energy.2012.01.041]

Voll, Philip
Lampe, Matthias
Wrobel, Gregor
Bardow, André

[Journal Article]
Druids knowledge in chemical engineering: analysis of the illustrated literature by goscinny and uderzo
In: Chemie - Ingenieur - Technik, 84 (4), 427-431, 2012
[DOI: 10.1002/cite.201200019]

Leuchs, Susanne
Greiner, Lasse
Dechambre, Dominique
Bardow, André

[Journal Article]
Deriving the rosenfeld functional from the virial expansion
In: Physical Review E, 85 (4), 041150, 2012
[DOI: 10.1103/PhysRevE.85.041150]

Korden, Stephan

[Journal Article]
Thermisch-beschichtete Hochleistungsverdampfer für das Kältemittel Wasser
In: KI - Kälte, Luft, Klimatechnik, 48 (4), 14-18, 2012

Lanzerath, Franz
Sluzalek, Robin
Bardow, André

[Journal Article]
Microfluidic diffusion measurements: the optimal H-cell
In: Chemical engineering science = Génie chimique, 72, 45-50, 2012
[DOI: 10.1016/j.ces.2012.01.015]

Häusler, Erik
Domagalski, Piotr
Ottens, Marcel
Bardow, André

[Journal Article]
Efficient technologies for worldwide clean water supply
In: Chemical engineering and processing, 51, 2-17, 2012
[DOI: 10.1016/j.cep.2011.09.011]

Macedonio, Francesca
Drioli, Enrico
Gusev, Andrei A.
Bardow, André
Semiat, Raphael
et al.

[Journal Article]
On The Treatment Of Electrostatic Interactions Of Non-spherical Molecules In Equation Of State Models
In: Soft materials, 10 (1-3, Special Issue), 80-104, 2012
[DOI: 10.1080/1539445X.2011.599701]

Korden, Stephan
van Nhu, Nguyen
Vrabec, Jadran
Groß, Joachim
Leonhard, Kai

[Conference Presentation]
Ab-initio Rechnungen : eine Quelle für PC-SAFT Parameter?
In: Thermodynamik-Kolloquium 2011 Frankfurt am Main 2011-10-04 - 2011-10-06, 2011

Leonhard, Kai
Umer, M.
Albers, K.
Sadowski, G.

[Conference Presentation]
Modeling of Thermodynamic and Kinetic Fuel Properties
In: 4. TMFB International Workshop Aachen 2011-05-24 - 2011-05-26, 2011

Kopp, Wassja Alexander
Leonhard, Kai

[Conference Presentation]
Modellgestützte Analyse der Adsorption in mikroporösen Materialien
In: Jahrestreffen des Fachausschusses Adsorption : Konferenzbeitrag ; 24. - 25. März 2011, Würzburg, 2011

Klitzing, Birger
Schreiber, Heike
Lanzerath, Franz
Bardow, André

[Conference Presentation]
Towards tailored materials for adsorption heat pump applications
In: International Sorption Heat Pump Conference Padua, Italy, April 6-8, 2011

Lanzerath, Franz
Klitzing, Birger
Bardow, André

[Contribution to a book, Contribution to a conference proceedings]
Hydrogen Abstraction From N-Butyl Formate by H-Radicals
In: [7th Mediterranean Combustion Symposium, MCS 7, 2011-09-11 - 2011-09-15, Chia Laguna, Italy], 11 Seiten, 2011

Kopp, Wassja Alexander (Corresponding author)
Leonhard, Kai