List of works - André Bardow

1-stage CoMT-CAMD: An approach for integrated design of ORC process and working fluid using PC-SAFT

scholarly article by Johannes Schilling et al published February 2017 in Chemical Engineering Science

A climate-optimal supply chain for CO2 capture, utilization, and storage by mineralization

scientific article published on 19 April 2022

Aquatic toxicity of biofuel candidates on Daphnia magna

scientific article published on 09 August 2018

Atom efficiency in small molecule and macromolecule synthesis: general discussion

scientific article published on 01 January 2015

Blend for all or pure for few? Well-to-wheel life cycle assessment of blending electricity-based OME<sub>3–5</sub> with fossil diesel

scientific article published on 21 March 2022

Bridging scales with thermodynamics: from nano to macro

scientific article published on 6 March 2014

CO2 mitigation costs of catalytic methane decomposition

CO2 reduction reactions: general discussion

scientific article published on 01 January 2015

COMANDO: A Next-Generation Open-Source Framework for Energy Systems Optimization

scientific article published in 2021

COSMO-CAMPD: a framework for integrated design of molecules and processes based on COSMO-RS

Calculating Thermodynamic Properties from Fluctuations at Small Scales

scientific article published on 22 September 2011

Capture agents, conversion mechanisms, biotransformations and biomimetics: general discussion

scientific article published on 23 November 2015

Climate change mitigation potential of carbon capture and utilization in the chemical industry

scientific article published on 13 May 2019

Computer-aided Molecular Design of ORC Working Fluids using PC-SAFT

Computer-aided molecular design in the continuous-molecular targeting framework using group-contribution PC-SAFT

Concentration-dependent diffusion coefficients from a single experiment using model-based Raman spectroscopy

article

Continuous Molecular Targeting–Computer-Aided Molecular Design (CoMT–CAMD) for Simultaneous Process and Solvent Design for CO2 Capture

Continuous-Molecular Targeting for Integrated Solvent and Process Design

Converting two wastes to value

scientific article from 2019

Correction to “Fick Diffusion Coefficients of Liquid Mixtures Directly Obtained from Equilibrium Molecular Dynamics”

scientific article published on 11 May 2012

Cost-optimal pathways towards net-zero chemicals and plastics based on a circular carbon economy

scientific article published in 2022

Decarbonizing copper production by power-to-hydrogen: A techno-economic analysis

scientific article published in 2021

Developments in the pre-combustion CO2 capture pilot plant at the Buggenum IGCC

Diffusion Coefficients from Molecular Dynamics Simulations in Binary and Ternary Mixtures

scientific article published in July 2013

Direct determination of the concentration dependence of diffusivities using combined model-based Raman and NMR experiments

Druids' Knowledge in Chemical Engineering: Analysis of the Illustrated Literature by Goscinny and Uderzo

article published in 2012

Dynamic optimisation of adsorber-bed designs ensuring optimal control

Efficient modeling of adsorption chillers: Avoiding discretization by operator splitting

scientific article published in 2022

Enrichment of methanol inside pNIPAM gels in the cononsolvency-induced collapse

scientific article published on 01 October 2019

Environmental potential of carbon dioxide utilization in the polyurethane supply chain.

scientific article published on 18 September 2015

Environmental trade-offs of direct air capture technologies in climate change mitigation toward 2100

scientific article published in 2022

Estimation of the binary interaction parameter kij of the PC-SAFT Equation of State based on pure component parameters using a QSPR method

Fick Diffusion Coefficients in Ternary Liquid Systems from Equilibrium Molecular Dynamics Simulations

Fick Diffusion Coefficients of Liquid Mixtures Directly Obtained From Equilibrium Molecular Dynamics

scientific article published on 10 November 2011

Finite-Size Effects of Binary Mutual Diffusion Coefficients from Molecular Dynamics.

scientific article

From molecules to dollars: integrating molecular design into thermo-economic process design using consistent thermodynamic modeling

article by Johannes Schilling et al published 2017 in Molecular systems design & engineering

Fully automated indirect hard modeling of mixture spectra

High performance, but low cost and environmental impact? Integrated techno-economic and life cycle assessment of polyoxazolidinone as a novel high-performance polymer

scientific article published in 2022

How to apply the Kirkwood–Buff theory to individual species in salt solutions

scientific article published in September 2013

Identification Methods for Reaction Kinetics and Transport

Identification of diffusive transport by means of an incremental approach

Identification of multicomponent mass transfer by means of an incremental approach

Incremental and simultaneous identification of reaction kinetics: methods and comparison

article published in 2004

Industry-Cost-Curve Approach for Modeling the Environmental Impact of Introducing New Technologies in Life Cycle Assessment.

scientific article published on 22 June 2015

Integrated design of ORC process and working fluid using process flowsheeting software and PC-SAFT

Integrated thermo-economic design of ORC process, working fluid and equipment using PC-SAFT

article published in 2017

Integrating working fluid design into the thermo-economic design of ORC processes using PC-SAFT

article by Johannes Schilling et al published September 2017 in Energy Procedia

Integration of process and solvent design towards a novel generation of CO2 absorption capture systems

Life Cycle Assessment for the Design of Chemical Processes, Products, and Supply Chains

scientific article published on 27 March 2020

Life Cycle Assessment of Power-to-Gas: Syngas vs Methane

Life cycle assessment of CO2 capture and utilization: a tutorial review

scientific article published on December 2014

MEXA goes CAMD — Computer-aided molecular design for physical property model building

article

Massive, automated solvent screening for minimum energy demand in hybrid extraction–distillation using COSMO-RS

article

Maxwell-Stefan diffusivities in binary mixtures of ionic liquids with dimethyl sulfoxide (DMSO) and H2O

scientific article published on 15 June 2011

Model-based measurement of diffusion using Raman spectroscopy

article

Multicomponent diffusion coefficients from microfluidics using Raman microspectroscopy

scientific article

Multispeed models in off-lattice Boltzmann simulations

scientific article published on 28 February 2008

Nitrogen-Based Fuels: A Power-to-Fuel-to-Power Analysis

scientific article

OCTP: A Tool for On-the-Fly Calculation of Transport Properties of Fluids with the Order- n Algorithm in LAMMPS

scientific article published on 21 February 2019

One-stage approach for the integrated design of ORC processes and working fluid using PC-SAFT

Physically-based Thermodynamic Models in Integrated Process and Molecular Design

Power-to-What? – Environmental assessment of energy storage systems

Prediction of multicomponent mutual diffusion in liquids: Model discrimination using NMR data

article

Rapid microfluidic screening of CO2 solubility and diffusion in pure and mixed solvents

scientific article published on 10 July 2012

Second-Order Analytical Uncertainty Analysis in Life Cycle Assessment

scientific article published on 27 October 2017

Selecting CO2 Sources for CO2 Utilization by Environmental-Merit-Order Curves

scientific article published on 11 January 2016

Sensitivity-based analysis of the k – ε model for the turbulent flow between two plates

Simultaneous Optimization of Working Fluid and Process for Organic Rankine Cycles Using PC-SAFT

article

Simultaneous process and working fluid optimisation for Organic Rankine Cycles (ORC) using PC-SAFT

article

Stochastic Technology Choice Model for Consequential Life Cycle Assessment.

scientific article published on 16 November 2016

Sustainable Conversion of Carbon Dioxide: An Integrated Review of Catalysis and Life Cycle Assessment

scientific article

Ternary diffusivities by model-based analysis of Raman spectroscopy measurements

article

The trade-off between experimental effort and accuracy for determination of PCP-SAFT parameters

Time-resolved structural evolution during the collapse of responsive hydrogels: The microgel-to-particle transition.

scientific article published on 6 April 2018

Validation of the CO2/N2O Analogy Using Molecular Simulation

Wider Impacts: general discussion

scientific article published on 23 November 2015

List of works by André Bardow

1-stage CoMT-CAMD: An approach for integrated design of ORC process and working fluid using PC-SAFT

A climate-optimal supply chain for CO2 capture, utilization, and storage by mineralization

Aquatic toxicity of biofuel candidates on Daphnia magna

Atom efficiency in small molecule and macromolecule synthesis: general discussion

Blend for all or pure for few? Well-to-wheel life cycle assessment of blending electricity-based OME<sub>3–5</sub> with fossil diesel

Bridging scales with thermodynamics: from nano to macro

CO2 mitigation costs of catalytic methane decomposition

CO2 reduction reactions: general discussion

COMANDO: A Next-Generation Open-Source Framework for Energy Systems Optimization

COSMO-CAMPD: a framework for integrated design of molecules and processes based on COSMO-RS

Calculating Thermodynamic Properties from Fluctuations at Small Scales

Capture agents, conversion mechanisms, biotransformations and biomimetics: general discussion

Climate change mitigation potential of carbon capture and utilization in the chemical industry

Computer-aided Molecular Design of ORC Working Fluids using PC-SAFT

Computer-aided molecular design in the continuous-molecular targeting framework using group-contribution PC-SAFT

Concentration-dependent diffusion coefficients from a single experiment using model-based Raman spectroscopy

Continuous Molecular Targeting–Computer-Aided Molecular Design (CoMT–CAMD) for Simultaneous Process and Solvent Design for CO2 Capture

Continuous-Molecular Targeting for Integrated Solvent and Process Design

Converting two wastes to value

Correction to “Fick Diffusion Coefficients of Liquid Mixtures Directly Obtained from Equilibrium Molecular Dynamics”

Cost-optimal pathways towards net-zero chemicals and plastics based on a circular carbon economy

Decarbonizing copper production by power-to-hydrogen: A techno-economic analysis

Developments in the pre-combustion CO2 capture pilot plant at the Buggenum IGCC

Diffusion Coefficients from Molecular Dynamics Simulations in Binary and Ternary Mixtures

Direct determination of the concentration dependence of diffusivities using combined model-based Raman and NMR experiments

Druids' Knowledge in Chemical Engineering: Analysis of the Illustrated Literature by Goscinny and Uderzo

Dynamic optimisation of adsorber-bed designs ensuring optimal control

Efficient modeling of adsorption chillers: Avoiding discretization by operator splitting

Enrichment of methanol inside pNIPAM gels in the cononsolvency-induced collapse

Environmental potential of carbon dioxide utilization in the polyurethane supply chain.

Environmental trade-offs of direct air capture technologies in climate change mitigation toward 2100

Estimation of the binary interaction parameter kij of the PC-SAFT Equation of State based on pure component parameters using a QSPR method

Fick Diffusion Coefficients in Ternary Liquid Systems from Equilibrium Molecular Dynamics Simulations

Fick Diffusion Coefficients of Liquid Mixtures Directly Obtained From Equilibrium Molecular Dynamics

Finite-Size Effects of Binary Mutual Diffusion Coefficients from Molecular Dynamics.

From molecules to dollars: integrating molecular design into thermo-economic process design using consistent thermodynamic modeling

Fully automated indirect hard modeling of mixture spectra

High performance, but low cost and environmental impact? Integrated techno-economic and life cycle assessment of polyoxazolidinone as a novel high-performance polymer

How to apply the Kirkwood–Buff theory to individual species in salt solutions

Identification Methods for Reaction Kinetics and Transport

Identification of diffusive transport by means of an incremental approach

Identification of multicomponent mass transfer by means of an incremental approach

Incremental and simultaneous identification of reaction kinetics: methods and comparison

Industry-Cost-Curve Approach for Modeling the Environmental Impact of Introducing New Technologies in Life Cycle Assessment.

Integrated design of ORC process and working fluid using process flowsheeting software and PC-SAFT

Integrated thermo-economic design of ORC process, working fluid and equipment using PC-SAFT

Integrating working fluid design into the thermo-economic design of ORC processes using PC-SAFT

Integration of process and solvent design towards a novel generation of CO2 absorption capture systems

Life Cycle Assessment for the Design of Chemical Processes, Products, and Supply Chains

Life Cycle Assessment of Power-to-Gas: Syngas vs Methane

Life cycle assessment of CO2 capture and utilization: a tutorial review

MEXA goes CAMD — Computer-aided molecular design for physical property model building

Massive, automated solvent screening for minimum energy demand in hybrid extraction–distillation using COSMO-RS

Maxwell-Stefan diffusivities in binary mixtures of ionic liquids with dimethyl sulfoxide (DMSO) and H2O

Model-based measurement of diffusion using Raman spectroscopy

Multicomponent diffusion coefficients from microfluidics using Raman microspectroscopy

Multispeed models in off-lattice Boltzmann simulations

Nitrogen-Based Fuels: A Power-to-Fuel-to-Power Analysis

OCTP: A Tool for On-the-Fly Calculation of Transport Properties of Fluids with the Order- n Algorithm in LAMMPS

One-stage approach for the integrated design of ORC processes and working fluid using PC-SAFT

Physically-based Thermodynamic Models in Integrated Process and Molecular Design

Power-to-What? – Environmental assessment of energy storage systems

Prediction of multicomponent mutual diffusion in liquids: Model discrimination using NMR data

Rapid microfluidic screening of CO2 solubility and diffusion in pure and mixed solvents

Second-Order Analytical Uncertainty Analysis in Life Cycle Assessment

Selecting CO2 Sources for CO2 Utilization by Environmental-Merit-Order Curves

Sensitivity-based analysis of the k – ε model for the turbulent flow between two plates

Simultaneous Optimization of Working Fluid and Process for Organic Rankine Cycles Using PC-SAFT

Simultaneous process and working fluid optimisation for Organic Rankine Cycles (ORC) using PC-SAFT

Stochastic Technology Choice Model for Consequential Life Cycle Assessment.

Sustainable Conversion of Carbon Dioxide: An Integrated Review of Catalysis and Life Cycle Assessment

Ternary diffusivities by model-based analysis of Raman spectroscopy measurements

The trade-off between experimental effort and accuracy for determination of PCP-SAFT parameters

Time-resolved structural evolution during the collapse of responsive hydrogels: The microgel-to-particle transition.

Validation of the CO2/N2O Analogy Using Molecular Simulation

Wider Impacts: general discussion