This is the full program for the Twenty-First Symposium on Thermophysical Properties. The presentations listed below are all abstracts that have been accepted for the Twenty-First Symposium . These include oral presentation, posters, and software demonstrations. Information on specific session assignments will be displayed at a later date.

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21st Symposium
Monday, June 21, 2021
Plenary 1 - Opening Ceremony and Keynote Lecture
Chair: Kenneth Kroenlein
Morning 0       6:15 AM – 7:45 AM       Room: Virtual

6:20 AM   Nature-Inspired Chemical Engineering: a NICE Approach to Grand Challenges in Sustainability (PaperID 4682) (Invited)
Marc-Olivier Coppens*

21st Symposium
Monday, June 21, 2021
Plenary 2
Chair: Kenneth Kroenlein
Morning 1       8:20 AM – 10:30 AM       Room: Virtual

8:25 AM   Modeling of Thermo-Physical Properties for Phase Transformations in Metal Systems (PaperID 4678) (Invited)
John Ågren*
9:15 AM   Hydrogen Stable Ionic Liquids Systems for Olefin/Paraffin Separation (PaperID 4702) (Invited)
Sejoon Park, Matt Davenport, Benny Freeman and Joan Brennecke*

21st Symposium
Monday, June 21, 2021
Correlations, Databases, and Engineering Equations of State 1
Chair: Ian H. Bell
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Evaluation of Different Predictive Mixture Models by Means of a Refrigeration Cycle (PaperID 4053) (Invited)
Andreas Jäger*, Erik Mickoleit and Cornelia Breitkopf
11:15 AM   Prediction of Activity Coefficients with Matrix Completion Methods (PaperID 4093)
Fabian Jirasek* and Hans Hasse
11:35 AM   Process Simulation Software: a Tool for Benchmarking Thermodynamic Models (PaperID 4116)
Edouard Moine*, Olivier Baudouin, Romain Privat, Jean-Noël Jaubert and Bastian Schmid
11:55 AM   Methane and Carbon Dioxide Gas Hydrates Phase Equilibria with Isopropyl Alcohol: Measurements and Comparison with a Prediction Model (PaperID 4174)
Luiz Fernando Vasconcelos dos Santos, Celina Kakitane, Amadeu K. Sum, Moisés Alves Marcelino Neto* and Rigoberto E. M. Morales
12:15 PM   Session Panel: Q&A (PaperID 4703)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Instrumentation and Measurement Techniques 1
Chair: Markus Richter
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   High Pressure Vapor Liquid Equilibrium Measurements of Gas and Water Mixtures using Nuclear Magnetic Resonance Spectroscopy (PaperID 4494)
Michael Sartini*, Bret Windom, Jason Widegren, Christopher Suiter and Mark McLinden
10:55 AM   Evaluation of Two Different Liquefaction Procedures for the Measurement of Thermophysical Properties of Cryogenic Liquid Mixtures (PaperID 4594)
Nils von Preetzmann*, Reiner Kleinrahm, Markus Richter and Roland Span
11:15 AM   Advantages of Accurate Dew-Point Data for the Determination of VLE (PaperID 4647)
Mark McLinden*, Ian H. Bell and Markus Richter
11:35 AM   The Four-Sinker Densimeter - A New Gravimetric Apparatus for Accurate Measurements of Dew-Point Densities of Fluid Mixtures (PaperID 4506)
Katharina Moritz, Reiner Kleinrahm, Mark McLinden, Luca Bernardini* and Markus Richter
11:55 AM   Improved Microwave Re-entrant Cavity Geometries for Dew-Point Measurements and a New Method to Quantify Adsorption and Precondensation Effects (PaperID 4552)
Yvonne Leusmann*, Mark McLinden, Richard Perkins and Markus Richter
12:15 PM   Session Panel: Q&A (PaperID 4722)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Ionic Liquids 1 - Measurement of Thermophysical Properties
Chair: Joan Brennecke
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Transport Properties of Imidazolium Ionic Liquids Saturated with Compressed Gases (PaperID 4279) (Invited)
Karim Al-Barghouti and Aaron Scurto*
11:15 AM   Thermophysical Properties of Choline Acetate + Water Mixtures (PaperID 4674)
André Silva, Carla Queirós, Ana Cristino, Xavier Paredes*, Carlos Nieto de Castro and Fernando Santos
11:35 AM   Density of 1-Butyl-3-Methylimidazolium Trifluoro­methanesulfonate and Methanol Binary Mixtures (PaperID 4515)
Aytakin Guluzade and Javid Safarov*
11:55 AM   Thermophysical Properties and Structure of [C2mim][CH3SO3]+ Water Mixtures (PaperID 4644)
Xavier Paredes, Carla Queirós, Francisco Bioucas, Fernando Santos*, Ângela Santos, Maria José Lourenço and Carlos Nieto de Castro
12:15 PM   Session Panel: Q&A (PaperID 4727)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Molecular Simulation 1
Chair: Michael Shirts
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Parallelization of Monte Carlo Simulations using Prefetching (PaperID 4101)
Harold Hatch* and Vincent Shen
10:55 AM   Multi-criteria Optimisation of Molecular Models of Water (PaperID 4083)
Aditya Kulkarni*, Michael Bortz, Karl-Heinz Küfer, Maximilian Kohns and Hans Hasse
11:15 AM   Molecular Thermodynamics Approach to the Relative Permittivity (PaperID 4076)
Maximilian Kohns*, Joshua Marx and Kai Langenbach
11:35 AM   Characterization of Fick Diffusion in Electrolyte Systems by Equilibrium Molecular Dynamics (EMD) Simulations (PaperID 4168)
Chathura Jayan Kankanamge*, Tobias Klein and Andreas Paul Fröba
11:55 AM   Modeling Adsorption on Sinker Surfaces in Densimetry: A Short Story on Surface Wetting and Capillary Condensation (PaperID 4508)
Markus Sekulla* and Markus Richter
12:15 PM   Session Panel: Q&A (PaperID 4732)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Non-equilibrium Thermodynamics 1 - Foundations and Interdisciplinary Applications
Chair: Fernando Bresme and David Reguera
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Efficiency of Electropumping Nano-Confined Water (PaperID 4266) (Invited)
David Ostler, Sridhar Kannam, Federico Frascoli, Peter Daivis and Billy Todd*
11:15 AM   Entropy Production Beyond the Thermodynamic Limit: Single-Molecule Stretching Simulations (PaperID 4595)
Eivind Bering*, Signe Kjelstrup, Dick Bedeaux, J. Miguel Rubi and Astrid de Wijn
11:35 AM   What Can Irreversible Thermodynamics Do for Us? (PaperID 4118)
Øivind Wilhelmsen*, Geir Skaugen, Ailo Aasen, Diego Kingston, Signe Kjelstrup, Dick Bedeaux, Ole Meyer, Magnus Aa. Gjennestad and Åsmund Ervik
11:55 AM   Session Panel: Q&A (PaperID 4738)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Correlations, Databases, and Engineering Equations of State 2
Chair: Roland Span
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   RESTful API for Searching and Accessing Thermophysical and Thermochemical Properties Contained in the NIST ThermoML Archive (PaperID 4654)
Demian Riccardi*, Zachary Trautt and Chris Muzny
12:55 PM   Data Resources for Adsorption: Isotherms, Adsorbent Materials, Formatting Standards, and User Data Submission (PaperID 4263)
Daniel Siderius*, Leopold Talirz, Daniele Ongari, Berend Smit, Vincent Shen, Russell Johnson and Roger van Zee
1:15 PM   Application of Optimal Experimental Design to Thermodynamic Property Measurements (PaperID 4548)
Ophelia Frotscher*, Roland Herzog and Markus Richter
1:35 PM   Data Scarcity in Developing Property Prediction Models: Application of Multi-Task Transfer Learning (PaperID 4143)
Adem R.N. Aouichaoui*, Seyed Soheil Mansouri, Jens Abildskov and Gürkan Sin
1:55 PM   NIST Data Resource for Curated Thermophysical Property Data of Metal Systems (PaperID 4079)
Boris Wilthan*, Scott Townsend and Vladimir Diky
2:15 PM   Session Panel: Q&A (PaperID 4705)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Instrumentation and Measurement Techniques 2
Chair: Tara Fortin
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Optimization of Dynamic Vapor Microextraction for Ignitable Liquid Extraction (PaperID 4625)
Jennifer Berry*, Megan Harries, Christopher Suiter, Mary Gregg, Amanda Koepke, Adam Friss and Kavita Jeerage
12:55 PM   Obtaining Small Uncertainty in Vapor Pressure Measurements of Low Volatility and Low Stability Compounds with Rapid Dynamic Vapor Microextraction (PaperID 4627)
Cheryle Beuning*, Megan Harries, Tara Lovestead and Jason Widegren
1:15 PM   Determination of Solubility of Gases in Liquids by the Isochoric Saturation Method (PaperID 4172)
Julius Hans Jander*, Cédric Giraudet, Michael Heinrich Rausch and Andreas Paul Fröba
1:35 PM   Shadowgraph Investigation of Free-Diffusion of Aqueous Solutions of Glycerol Using a Cylindrical Flowing-Junction Cell (PaperID 4521)
Paul Fruton, Henri Bataller, Cédric Giraudet and Fabrizio Croccolo*
1:55 PM   Session Panel: Q&A (PaperID 4724)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Ionic Liquids 2 - Modeling and Correlation

Chair: Aaron Scurto
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   A Low Mach Number Fluctuating Hydrodynamics Model For Ionic Liquids (PaperID 4058)
Andy Nonaka*, Katie Klymko, Sean Carney, Alejandro Garcia and John Bell
12:55 PM   Lateral Ordering in Nanoscale Ionic Liquid Films Between Charged Surfaces Enhances Lubricity (PaperID 4232)
Silvia Di Lecce, Alexei Kornyshev, Michael Urbakh and Fernando Bresme*
1:15 PM   Thermal Conductivity of Ionic Liquids and IoNanofluids (PaperID 4534)
Xavier Paredes, Maria José Lourenço, Carlos Nieto de Castro* and William A. Wakeham
1:35 PM   Discovering High Conductivity Imidazolium-Based Ionic Liquid Mixtures using Artificial Neural Network (PaperID 4655)
Pratik Dhakal* and Jindal Shah
1:55 PM   Session Panel: Q&A (PaperID 4731)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Non-equilibrium Thermodynamics 2 - Thermodiffusion and Thermophoresis
Chair: Jean-Marc Simon
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   The Thermophobicity Concept in Thermodiffusion - Expanding the Matrix (PaperID 4073)
Werner Köhler*, Bastian Pur and Konstantin Morozov
12:55 PM   The Role of Mass Asymmetry on the Thermal Polarization of Janus Particles (PaperID 4145)
Juan D. Olarte-Plata* and Fernando Bresme
1:15 PM   Determination of C60-Thn-Tol Nanofluid Thermodiffusion Coefficient by the Conventional Thermogravitational Technique (PaperID 4243)
Ane Errarte*, Maialen Aginagalde and M. Mounir Bou-Ali
1:35 PM   Anisotropic Particles under Thermal Fields: How Non-Equilibrium Coupling Effects Alter Transport Properties (PaperID 4154)
Oliver R. Gittus* and Fernando Bresme
1:55 PM   How Do Non-Ionic and Ionic Contributions Influence the Thermophoresis of Protein-Ligand Systems? (PaperID 4117)
Simone Wiegand*, Shilpa Mohanakumar and Doreen Niether
2:15 PM   Session Panel: Q&A (PaperID 4739)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Theory of Thermophysical Properties 1
Chair: Clare McCabe and Amparo Galindo
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Using the Solubility Parameter Method MOSCED to Predict Phase Behavior and Gain Molecular-Level Insight (PaperID 4051)
Andrew Paluch*
12:55 PM   Entropy Scaling of the Transport Properties of Simple and Not-so-Simple Fluids (PaperID 4633)
Ian H. Bell*, Lorenzo Costigliola, Trond Ingebrigtsen, Jeppe Dyre, Guillaume Galliero and Stephanie Delage Santacreu
1:15 PM   Kinetic Theory and Shear Viscosity of Dense Dipolar Hard Sphere Liquids (PaperID 4150)
Faezeh Pousaneh and Astrid S. de Wijn*
1:35 PM   Fully Quantum Calculation of Dielectric Virial Coefficients for Noble Gases (PaperID 4112)
Giovanni Garberoglio* and Allan Harvey
1:55 PM   Session Panel: Q&A (PaperID 4773)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Correlations, Databases, and Engineering Equations of State 3
Chair: Ian H. Bell
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Trial to Estimate Uncertainties of Helmholtz Equation of State for Refrigerants (PaperID 4568) (Invited)
Yohei Kayukawa*
7:45 PM   Measurement and Modeling of Thermodynamic Properties for Various Hydrogen Carriers (PaperID 4107)
Hiroyuki Miyamoto*, Kota Suzuki, Shoun Nakamura, Ryo Akasaka and Eric W. Lemmon
8:05 PM   A Comprehensive Liquid Metal Thermophysical Property Database and Preliminary Statistical Calculation Models for Viscosity and Density (PaperID 4067)
Lei Gan*
8:25 PM   From Generalized Langmuir Isotherm to Mixed-gas Adsorption Equilibria (PaperID 4560)
Usman Hamid*, Hla Tun and Chau-Chyun Chen
8:45 PM   Session Panel: Q&A (PaperID 4709)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Instrumentation and Measurement Techniques 3
Chair: Eric May
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Direct Measurement of Adsorbant Capacity and Function Using In-Situ Raman Spectroscopy (PaperID 4564) (Invited)
Kwanghee Jeong, Gregor Lipinski, Arash Arami-Niya, Xiaoxian Yang, Gongkui Xiao, Eric May, Markus Richter and Paul Stanwix*
7:45 PM   Application of Raman Spectroscopy for Sorption Analysis of Functionalized Translucent Materials (PaperID 4549)
Gregor Lipinski, Kwanghee Jeong, Katharina Moritz, Paul Stanwix, Eric May and Markus Richter*
8:05 PM   A New Microwave Resonator to Measure Phase Behaviour of Binary Mixtures (PaperID 4277)
Liam Tenardi*, Matthew Hopkins, Eric May and Paul Stanwix
8:25 PM   Adapting the Transient Hot-Wire Method to Find the Thermal Conductivity of Stereolithographic 3D Printed Resins (PaperID 4191)
Conner Mantz*, Derek Sanchez, Greg Nordin and Troy Munro
8:45 PM   Session Panel: Q&A (PaperID 4723)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Ionic Liquids 3 - Gas Phase Separations
Chair: Mark B. Shiflett
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Properties of Imidazolium Ionic Liquids Bearing both Benzylic and n-Alkyl Substituents (PaperID 4287)
Joseph Magee*, Jason Bara, Alexia Finotello, Shuai Qian, Kathryn O'Harra, Grayson Dennis and Richard Noble
7:25 PM   Measuring Physical Solubilities of Gases in Ionic Liquids using Gas Chromatography (PaperID 4614)
Kimberly Bourland*, Joan Brennecke and V. K. P. Janakey Devi
7:45 PM   Accurate Computation of Hydrofluorocarbon Solubility in Ionic Liquids with Molecular Simulation (PaperID 4201)
Ryan S. DeFever*, Bridgette Befort, Alexander W. Dowling and Edward J. Maginn
8:05 PM   The Solubility of Nitrogen in Ionic Liquids (PaperID 4619)
Caitlin Bentley*, Tangqiumei Song and Joan Brennecke
8:25 PM   Session Panel: Q&A (PaperID 4729)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Thermal Properties of Nanostructured Materials 1 - Phonon Transport Understanding and Tailoring
Chair: Yan Wang
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Thermal Non-equilibrium between Optical and Acoustic Phonons in Graphene Paper under Photon Excitation (PaperID 4141)
Hamidreza Zobeiri*
7:25 PM   Intrinsically High Cross-Plane Thermal Conductivity of HOPG (PaperID 4569)
Lu Zhao* and Bo Sun
7:45 PM   Thermoelectric Properties of Topological Surface States in Tetradymite 3D TI (PaperID 4615)
Shouyuan Huang* and Xianfan Xu
8:05 PM   Characterization of Energy Coupling Factor Between Optical and Acoustic Phonons Under Photon Excitation in 2D Transition Metal Dichalcogenides (PaperID 4205)
Ridong Wang*, Hamidreza Zobeiri and Xinwei Wang
8:25 PM   Session Panel: Q&A (PaperID 4780)
Session Chair & Speakers*

21st Symposium
Monday, June 21, 2021
Wetting, Interfaces, and Membranes 1 - Hydrates- Kinetics
Chair: Carolyn Koh
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Dependence of Hydrate Formation Kinetics on System-Size and Shear (PaperID 4222)
Peter Metaxas*, Vincent Lim, Kwanghee Jeong, Mark Barwood, Chenglong Li, Bruce Norris, Michael Johns, Zachary Aman and Eric May
7:25 PM   Hydrate Agglomeration in Crude Oil Systems (PaperID 4268)
Jose Delgado-Linares*, Ahmad A A Majid, Nur Aminatulmimi Ismail, Hannah Stoner and Carolyn Koh
7:45 PM   The Effect of Gas-Water Interfacial Hydrates in Water Dominant Multiphase Flow (PaperID 4106)
Louis Yu*, Bruce Norris, Zachary Aman and Carolyn Koh
8:05 PM   High-Fidelity Modelling and New Technologies to Reduce Inhibitor Injection Requirements for Long Subsea Tiebacks (PaperID 4210)
Bruce Norris*, David Zhu, Eric May and Zachary Aman
8:25 PM   Gas Hydrate Plugging Assessment Using High Pressure Differential Scanning Calorimetry (PaperID 4265)
Ahmad Afif Abdul Majid*, Jefferson Creek and Carolyn Koh
8:45 PM   Session Panel: Q&A (PaperID 4789)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Correlations, Databases, and Engineering Equations of State 4
Chair: Monika Thol
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Entropy Scaling Applied to the Shear Viscosity of Propane and Other Normal Alkanes (PaperID 4634) (Invited)
Ian H. Bell*
7:15 AM   Thermodynamic Curvature of the Binary van der Waals Fluid (PaperID 4155)
George Ruppeiner*
7:35 AM   Simple Quantum Corrections Improve the Accuracy of Cubic Equations of State for Mixtures That Contain Hydrogen, Helium, Neon and Deuterium (PaperID 4119)
Øivind Wilhelmsen*, Ailo Aasen, Morten Hammer, Jean-Noël Jaubert and Silvia Lasala
7:55 AM   Applications of Machine Learning to Experimental Chemical Property Data (PaperID 4794)
Thomas C. Allison*
8:15 AM   Session Panel: Q&A (PaperID 4708)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Fluid Property Measurements 1
Chair: Ala Bazyleva
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Density and Dielectric Virial Coefficients of Argon for Applications in Gas Metrology (PaperID 4609)
Christian Guenz* and Christof Gaiser
6:55 AM   Polarizability Measurements of (Hydrogen + Carbon Dioxide) Mixtures using Microwave Cavity Technology - Examination of Polarizability Mixing Rules (PaperID 4553)
Yvonne Leusmann*, Fabian Luther, Paul Stanwix, Eric May and Markus Richter
7:15 AM   Bidimensional Empirical Mode Decomposition and Dynamic Differential Microscopy Reveals Multiscale Dynamics of Critical Fluctuations (PaperID 4635)
Ana Oprisan*, Sorinel Oprisan, Carole Lecoutre-Chabot, Yves Garrabos and Daniel Beysens
7:35 AM   Numerical and Experimental Study of the Hydrostatic Pressure Correction in Gas Thermometry: A Case in the SPRIGT (PaperID 4611)
Changzhao Pan*, Dongxu Han, Haiyang Zhang, Mark Plimmer, Ercang Luo, Bo Gao and Laurent Pitre
7:55 AM   Session Panel: Q&A (PaperID 4715)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Molecular Simulation 2
Chair: Jacob Monroe
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   The Necessity of Large System Size in Interpreting Solvent Effects on Hydration and Kinetics in Atomistic Simulations (PaperID 4613)
Dilip Asthagiri*, Dheeraj Tomar, Arjun Valiya Parambathu and Walter Chapman
6:55 AM   Discovering Hidden Structures of Clathrate Hydrates (PaperID 4095)
Amadeu Sum* and Yong Chen
7:15 AM   Dynamics of Single-Chain Conformations in Triblock Copolymers (PaperID 4511)
Marcus Müller*
7:35 AM   Predicting Chemical Reaction Equilibria in Molten Carbonate Fuel Cells via Molecular Simulation (PaperID 4295)
Jeffrey Young*, Anirban Mondal and Athanassios Panagiotopoulos
7:55 AM   Session Panel: Q&A (PaperID 4790)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Non-equilibrium Thermodynamics 3 - Ion Transport
Chair: Simone Wiegand
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Peltier and Dufour Effects in the Polymer Electrolyte Membrane Fuel Cell (PaperID 4120)
Marco Sauermoser*, Signe Kjelstrup and Bruno G. Pollet
6:55 AM   The Soret Effect in Li-Ion Battery Electrolytes (PaperID 4251)
Anders Lervik*
7:15 AM   A Discrete Ion Stochastic Continuum Overdamped Solvent Algorithm for Modeling Electrolytes (PaperID 4082)
Daniel Ladiges*, Sean Carney, Andy Nonaka, Katherine Klymko, Guy Moore, Alejandro Garcia, Sachin Natesh, Aleksandar Donev and John Bell
7:35 AM   Ion Exchange Micropumps (PaperID 4185)
Maria Jose Esplandiu and David Reguera*
7:55 AM   Session Panel: Q&A (PaperID 4742)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Properties of Aqueous Systems 1
Chair: Frédéric Caupin
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Fingerprinting and Thermodynamic Modeling of Poorly Specified Mixtures with NMR Spectroscopy and Machine Learning (PaperID 4094)
Fabian Jirasek*, Thomas Specht and Hans Hasse
6:55 AM   Modelling Brines Consistent to Helmholtz Multi-Fluid Mixture Models for CCS Applications- from Seawater to High Concentrated Brine Mixtures in Saline Aquifers (PaperID 4181)
Benedikt Semrau*, Darren Rowland, Monika Thol and Roland Span
7:15 AM   Accurate Measurements of Seawater Density Up to Pressure of 110 MPa Including the Metastable Supercooled Liquid Region (PaperID 4622)
Jan Hrubý*, Aleš Blahut, Jiří Hykl, Pavel Peukert, Václav Vinš, Olga Prokopová and Jaroslav Klomfar
7:35 AM   Density Measurements of Supercooled Standard Seawater at High Pressure (PaperID 4680)
Rafaela Romeo*, Simona Lago and Paolo Alberto Giuliano Albo
7:55 AM   Comparing Classical Force Fields for Aqueous NaCl Solutions at Elevated Temperatures and Pressures (PaperID 4648)
Katie Maerzke*, Lara Patel and Robert Currier
8:15 AM   Session Panel: Q&A (PaperID 4757)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Correlations, Databases, and Engineering Equations of State 5
Chair: Andreas Jäger
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Comparison of COSMO-SAC and the Multi-Fluid Mixture Model with Binary and Ternary Mixtures (PaperID 4147)
Erik Mickoleit*, Constantino Grau Turuelo, Andreas Jäger and Cornelia Breitkopf
8:55 AM   Water Washing of Startup Crude Oil (PaperID 4075)
Paul Mathias*
9:15 AM   Modelling Uncertainty of Speed of Sound in Humid Air (PaperID 4677)
R.M. Gavioso*, M. Fogliati and D. Madonna Ripa
9:35 AM   Development of Thermodynamic Equations of State by Means of New Fitting Techniques (PaperID 4588)
Sven Pohl*, Monika Thol, Ian H. Bell, Jadran Vrabec and Roland Span
9:55 AM   Application of Binary Tree Architecture in Fitting Helmholtz Energy Equation of State with Argon as an Example (PaperID 4650)
Kehui Gao* and Eric W. Lemmon
10:15 AM   Session Panel: Q&A (PaperID 4713)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Fluid Property Measurements 2
Chair: Diego Cristancho
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Supporting Efficient Thermophysical Research: Reference Materials and Good Reporting Practice (PaperID 4273)
Ala Bazyleva*
8:55 AM   Low Pressure Vapor-Liquid Equilibria Measurements of Detergent Range Alkanes and Alcohols (PaperID 4220)
Susanna du Plessis, Carla Latsky and Cara Schwarz*
9:15 AM   Spectroscopic Quantification of Hydrogen Bonding for Improved Phase Equilibrium Models (PaperID 4631)
William G. Killian*, Andrew T. Norfleet, Aseel M. Bala, Lars Peereboom, James E. Jackson and Carl T. Lira
9:35 AM   The Role of Thermophysical Properties Measurements in Advancing Forensic Science (PaperID 4566)
Tara Lovestead*
9:55 AM   Influence of Nanofluid Instability on Thermodynamic Properties Near the Critical Point (PaperID 4286)
Joseph Magee*, Nikolai Polikhronidi, Rabiyat Batyrova and Ilmutdin Abdulagatov
10:15 AM   Session Panel: Q&A (PaperID 4719)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Molecular Simulation 3
Chair: Ryan DeFever
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Phase Equilibria and Critical Points of Pentaerythritol Esters Probed by Monte Carlo Simulations (PaperID 4497)
Tao Yang*, Jiangtao Wu and J. Ilja Siepmann
8:55 AM   Thermophysical Behaviour of Fluorinated Blends Using Molecular Dynamics Simulations Combined with Soft-Saft (PaperID 4607)
Daniel Jovell*, Gerard Alonso, Pablo Gamallo and Fèlix Llovell
9:15 AM   Intra- and Inter-chain Pair Correlation Functions of Polymeric Fluids: A Comparison of Self-Consistent Polymer Reference Interaction Site Model and Polymer Density-Functional Theories (PaperID 4097)
Yan Wang*, Jiawei Zhang, Suyu Wang, Baohui Li, Jianzhong Wu and Qiang Wang
9:35 AM   Formation Enthalpies of Organic Compounds of Third-Row Elements from ab initio Computations (PaperID 4158)
Eugene Paulechka* and Andrei Kazakov
9:55 AM   Thermodynamic and Dynamic Properties of a Resin Mixture with Embedded Sio2 from Molecular Simulations (PaperID 4235)
Arpenik Kroyan*, Mohammed Mostafa Adnan, Sondre Kvalvåg Schnell and Mari-Ann Einarsrud
10:15 AM   Session Panel: Q&A (PaperID 4733)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Non-equilibrium Thermodynamics 4 - Theoretical and Computational Methods
Chair: Ignacio Pagonabarraga
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Non-Equilibrium Molecular Dynamics Simulations in the Hamiltonian Adaptive Resolution Method (PaperID 4130)
Maziar Heidari, Kurt Kremer, Raffaello Potestio and Robin Cortes-Huerto*
8:55 AM   Applying Non Equilibrium and Constrained Molecular Dynamics to the Soret Effect in Solids with Charged Defects (PaperID 4152)
Guillaume Bareigts*, Serge Maillard, Jean-Marc Simon and Jürgen Janek
9:15 AM   Generalised Energy-Conserving Dissipative Particle Dynamics: a Coarse-Grain Method to Simulate Complex Fluids Through a Locally Defined Fluctuating Thermodynamics (PaperID 4180)
Josep Avalos*, Martin Lísal, James P. Larentzos, Allan Mackie and John K Brennan
9:35 AM   Session Panel: Q&A (PaperID 4743)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Wetting, Interfaces, and Membranes 2 - Interfaces
Chair: Marcus Mueller
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Conformal Solution Theory of Vapor-Liquid Interfaces (PaperID 4550)
Simon Stephan* and Hans Hasse
8:55 AM   Interfacial Properties for Phase Equilibria of Different Types and their Connection to the Phase Diagram (PaperID 4551)
Jens Staubach*, Simon Stephan and Hans Hasse
9:15 AM   Interfacial Tensions of Systems Comprising Carbon Dioxide, Decane and Iododecane at High Pressures and High Temperatures: Experimental Measurements and Modeling with Volume Translated Peng Robinson EOS and Square-Gradient Theory (PaperID 4190)
Ziqing Pan* and J.P. Martin Trusler
9:35 AM   Factors Affecting Water/Oil Interfacial Tension as Identified by Molecular Simulations (PaperID 4125)
Tai Bui*, Harry Frampton, Shanshan Huang, Ian R. Collins, Alberto Striolo and Angelos Michaelides
9:55 AM   Characterization of Multiphase Systems in Chemical and Energy Engineering (PaperID 4176)
Thomas Manfred Koller*
10:15 AM   Session Panel: Q&A (PaperID 4783)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Plenary 3 - Awards
Chair: Dan Friend
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Adsorption in Nanoporous Materials: High-Throughput Screening, Machine Learning, and First Principles Simulations (PaperID 4686) (Invited)
J. Ilja Siepmann*
11:25 AM   Presentation of the 2021 Yeram S. Touloukian Award (PaperID 4793)
Dan Friend*

21st Symposium
Tuesday, June 22, 2021
Fluid Property Measurements 3
Chair: Diego Cristancho
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Measurements of Thermophysical Properties for CCS (PaperID 4129) (Invited)
Sigurd Weidemann Løvseth*
1:15 PM   Interfacial Tension Measurements of Binary Mixtures of N2 + Brine and CO2 + Hydrocarbon Systems at Conditions Relevant for CCS and EOR (PaperID 4604)
Haruna Dantata Salihu*, Inês Graça, Jan Vinogradov and David Vega-Maza
1:35 PM   Measurement of Interfacial Tension of Liquids with Dissolved Gases by the Pendant-Drop Method up to 573 K and 10 MPa (PaperID 4173)
Patrick Sebastian Schmidt*, Julius Hans Jander, Cédric Giraudet, Michael Heinrich Rausch and Andreas Paul Fröba
1:55 PM   Isobaric Heat Capacities of Aqueous Solutions of MDEA and DEA at High Pressures for Carbon Capture (PaperID 4087)
Alejandro Moreau, Eduardo I. Concepción, José J. Segovia, David Vega-Maza* and M. Carmen Martín
2:15 PM   Session Panel: Q&A (PaperID 4714)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Ionic Liquids 4 - Separations Technology Design
Chair: Bernd Rathke
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Effect of Hydrogen Bonding on LCST Behavior of Aqueous Ionic Liquid Solutions (PaperID 4618)
Edwin Torres-Cuevas*, Oscar Morales-Collazo, Benny Freeman and Joan Brennecke
12:55 PM   Design of Low Viscosity Hydrophobic Deep Eutectic Solvents: Correlation with the Pure Constituent Molecular Structure and Liquid Phase Non-Ideality (PaperID 4162)
Ahmad Alhadid*, Liudmila Mokrushina and Mirjana Minceva
1:15 PM   Reverse-Selective PTMSP Supported Ionic Liquid Membranes for Light Hydrocarbon Separations (PaperID 4620)
Jose Davila Labastida*, Maximilian Strauss, Benny Freeman and Joan Brennecke
1:35 PM   Thermal Stability of Ionic Liquids: Evaporation Vs Decomposition, TGA and DSC (PaperID 4262)
Dzmitry Zaitsau*
1:55 PM   Session Panel: Q&A (PaperID 4730)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Properties for Materials Science at High Temperatures 1
Chair: Michael Sansoucie
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Specific Heats of Equilibrium and Supercooled Ti39.5Zr39.5Ni21, Zr64Ni36, and Cu50Zr50 Liquids from Ground- and Space-Based Studies (PaperID 4602) (Invited)
Anup Gangopadhyay*, Daniel Van Hoesen, Dirk Holland-Moritz, Stefanie Koch, Peter Galenko and Kenneth Kelton
1:15 PM   Surface Tension and Density of L625 (Alloy 625) by voestalpine BÖHLER Edelstahl GmbH & Co KG Measured with an Electromagnetic Levitation Apparatus (PaperID 4151)
Thomas Leitner*, Siegfried Kleber and Gernot Pottlacher
1:35 PM   Session Panel: Q&A (PaperID 4753)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Correlations, Databases, and Engineering Equations of State 6
Chair: Yohei Kayukawa
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Peng-Robinson Plus Association Equation of State for Hydrofluorocarbon Systems (PaperID 4063)
Jorge Estela*
7:25 PM   Necessary Details for the Helium Equation of State at Low Temperature (PaperID 4103)
Allan Harvey*
7:45 PM   Improving Confidence in Hydrate Phase Boundary Predictions for MEG Systems (PaperID 4225)
David Zhu*, Bruce Norris, Eric May and Zachary Aman
8:05 PM   Equation of State for Solid Benzene Valid for Temperatures up to 470 K and Pressures up to 1800 MPa (PaperID 4163)
Xiong Xiao*, Xiaoxian Yang, Saif Z.S. Al Ghafri, J.P. Martin Trusler and Eric May
8:25 PM   Session Panel: Q&A (PaperID 4712)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Properties of Aqueous Systems 2
Chair: Andre Anderko
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Flow Calorimeter for Specific Heat Capacity Measurement Based on Differential Method (PaperID 4211)
Lingyan Gui*, Xianyang Meng and Jiangtao Wu
7:25 PM   A Priori Prediction of the Standard State Partial Molar Volume of Aqueous Electrolytes to High Temperatures and High Pressures (PaperID 4517)
Essmaiil Djamali*
7:45 PM   First Principles Simulations of CuCl in High Temperature Water Vapor (PaperID 4567)
Katie Maerzke*, Ryan Jadrich, Tae Jun Yoon, Jeffrey Leiding and Robert Currier
8:05 PM   Hydrophilic Interactions Dominate the Inverse Temperature Dependence of Polypeptide Hydration Free Energies Attributed to Hydrophobicity (PaperID 4616)
Dheeraj Tomar, Michael Paulaitis, Lawrence Pratt and Dilip Asthagiri*
8:25 PM   Session Panel: Q&A (PaperID 4756)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Properties of Working Fluids including Refrigerants 1
Chair: Mark McLinden
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   The Measurements of Saturation Vapor Pressures, and the Critical Pressure for Trifluoroiodomethane (CF3I, R13I1) and a Vapor Pressure Correlation (PaperID 4175)
Uthpala Perera*, Kyaw Thu, Takahiko Miyazaki, Naoya Sakoda and Yukihiro Higashi
7:25 PM   Bubble-point Measurements of Six Binary Mixtures of Refrigerants (PaperID 4159)
Stephanie Outcalt*
7:45 PM   Thermodynamic Properties Measurement of CF3I (PaperID 4178)
Naoya Sakoda* and Yukihiro Higashi
8:05 PM   A New Fundamental Equation of State for cis-1-Chloro-2,3,3,3-tetrafluoropropene [R1224yd(Z)] (PaperID 4502)
Ryo Akasaka* and Eric W. Lemmon
8:25 PM   Session Panel: Q&A (PaperID 4771)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Thermal Properties of Nanostructured Materials 2 - Thermal Transport in Nanostructured Materials
Chair: Ridong Wang
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Multi-pace Heat Conduction in Carbon Nanotube Bundles Induced by Structure Separation (PaperID 4104)
Yangsu Xie* and Xinwei Wang
7:25 PM   Solid-State Thermal Regulation and Rectification Based on Polyethylene Nanofibers (PaperID 4612)
Xiao Luo* and Sheng Shen
7:45 PM   Ultracompliant Nanowire Array as High-Performance Thermal Interface Materials (PaperID 4641)
Lin Jing*, Wei Gong and Sheng Shen
8:05 PM   Offset Nanoslot Patterns as an Effective Way to Reduce the In-Plane Thermal Conductivities of Thin Films (PaperID 4656)
Sien Wang* and Qing Hao
8:25 PM   In-Situ and Real-Time Thermal Characterization of Individual Water-Filled Nanotubes Inside a Scanning Transmission Electron Microscope (PaperID 4591)
Dawei Li*, Qin-Yi Li, Tatsuya Ikuta and Koji Takahashi
8:45 PM   Session Panel: Q&A (PaperID 4778)
Session Chair & Speakers*

21st Symposium
Tuesday, June 22, 2021
Wetting, Interfaces, and Membranes 3 - Hydrates - Interfaces
Chair: Eric May
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   The Role of Interfacial Chemistry to Unlock Long Subsea Gas-Condensate Tiebacks (PaperID 4491)
Zachary Aman*
7:25 PM   Interactions of Protective Internal Corrosion Scales with Hydrate Particles in CO2 Environments (PaperID 4114)
Juan Diaz*, Bruce Norris, Eric May, Mariano Iannuzzi and Zachary Aman
7:45 PM   Evaluation of Stability and Integrity of Solid Natural Gas Hydrate Pellets Under Self-Preservation and Dissociation Conditions (PaperID 4276)
Sriram Ravichandran*, Mathias Pohl, Ahmad Majid, David Wu, Manika Prasad and Carolyn Koh
8:05 PM   Detection of Hydrate Formation and Deposition Using Microwave Sensing Techniques (PaperID 4289)
Matthew Hopkins*, Eric May and Paul Stanwix
8:25 PM   Contact-free Hydrate Formation on Water Droplets Acoustically-Levitated in High-Pressure Natural Gas (PaperID 4198)
Kwanghee Jeong*, Peter Metaxas, Zachary Aman, Paul Stanwix, Michael Johns and Eric May
8:45 PM   Session Panel: Q&A (PaperID 4788)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Fluid Property Measurements 4
Chair: Diego Cristancho
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Improved Characterization of Fluid Phase Behaviour Using an Advanced Microwave Re-Entrant Cavity (PaperID 4284)
Matthew Hopkins*, Yvonne Leusmann, Markus Richter, Eric May and Paul Stanwix
6:55 AM   Accurate Measurements of Carbon Dioxide and Sulfur Dioxide (CO2+ SO2) Vapor-Liquid Equilibria (PaperID 4267)
Sigurd Weidemann Løvseth*, Hans Georg Jacob Stang, Martin Viktor Johansson*, Martin Khamphasith and Eric May
7:15 AM   Viscosity of CO2-rich mixtures at relevant condition for Carbon Capture and Storage (CCS) (PaperID 4123)
Bahareh Khosravi*, Benjamin Betken, Roland Span, Jana Poplsteinova Jakobsen and Sigurd Weidemann Løvseth
7:35 AM   Session Panel: Q&A (PaperID 4717)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Instrumentation and Measurement Techniques 4
Chair: J.P. Martin Trusler
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   2nd Time Around: Design, Build, and Performance of MIRE-2, an Accurate Gas Refractometer (PaperID 4102)
Patrick Egan*, Michael Braine, Tobias Herman and Julia Scherschligt
6:55 AM   Measurement of Thermodynamic Temperature Between 5 K and 24.5 K with Single-Pressure Refractive-Index Gas Thermometry (PaperID 4606)
Bo Gao, Haiyang Zhang, Dongxu Han, Changzhao Pan, Yaonan Song, Wenjing Liu, Jiangfeng Hu, Xiangjie Kong, Fernando Sparasci, Mark Plimmer, Ercang Luo and Laurent Pitre*
7:15 AM   Quantitative Non-Destructive Single-Frequency Thermal-Wave-Radar Imaging of Case Depths in Hardened Steels (PaperID 4639)
Alexander Melnikov, Wei Yu, Andreas Mandelis* and Mingfeng Wang
7:35 AM   Surface Light Scattering for the Accurate Determination of Viscosity and Interfacial Tension of Non-Transparent Systems (PaperID 4227)
Junwei Cui*, Johannes Knorr*, Thomas Manfred Koller and Andreas Paul Fröba
7:55 AM   Session Panel: Q&A (PaperID 4791)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Ionic Liquids 5 - Condensed Phase Equilibria
Chair: Joseph W. Magee
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   The Interplay of Ionic Liquid Phase Boundaries: Liquid-Liquid and Vapor-Liquid Equilibria of Imidazolium Triflate Ionic Liquids with n-Alkyl Alcohols (PaperID 4598) (Invited)
Aileen Aykoc, Maximilian Pfeiffer, Sabine Wagenfeld, Marcus Stuckenholz, Johannes Kiefer, Wolffram Schröer and Bernd Rathke*
7:15 AM   Session Panel: Q&A (PaperID 4728)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Properties for Fuels and Energy Systems 1 - Phase Behavior and Properties
Chair: Kurt A. G. Schmidt and Sergio E. Quiñones-Cisneros
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Measurement of Jet Fuel and Fuel Surrogate Thermal Properties Using Thermogravimetric Analysis/Differential Scanning Calorimetry (PaperID 4540)
Dianne Luning Prak*, Paul Trulove and David Durkin
6:55 AM   Dimethyl Sulfoxide as a Gas Hydrate Inhibitor: Phase Equilibria, Freezing Point, Density, and Viscosity Measurements (PaperID 4668)
Anton Semenov*, Rais Mendgaziev, Andrey Stoporev, Vladimir Vinokurov, Vladimir Istomin and Daria Sergeeva
7:15 AM   Encapsulated Salt Hydrates - Highly Stable Heat-Storage Materials (PaperID 4649)
Andrei Novikov*, Anton Semenov, Andrey Stoporev, Rais Mendgaziev, Vladimir Vinokurov and Dmitry Shchukin
7:35 AM   Session Panel: Q&A (PaperID 4762)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Properties of Solids 1
Chair: Ursula Kattner
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Coupling the CALPHAD Method and First Principles Simulations for the Prediction and Modelling of the Thermal Transport Properties in Complex Solid Salt Systems (PaperID 4683) (Invited)
Aimen E. Gheribi* and Patrice Chartrand
7:15 AM   A Simple Test Method for Assessment of the Interface Thermal Resistance (PaperID 4530)
Simone Pedrazzi, Giulio Allesina, Mauro A. Corticelli, Paolo Tartarini and Alberto Muscio*
7:35 AM   Effect of Silicone-Paste Properties on the Accurate Measurement of the Thermal Conductivity of Solids with the Transient Hot-Wire Technique (PaperID 4111)
Danai Velliadou, Marc J. Assael, William A. Wakeham and Konstantinos D. Antoniadis*
7:55 AM   Session Panel: Q&A (PaperID 4765)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Correlations, Databases, and Engineering Equations of State 7
Chair: Marc Assael
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   New International Formulations for the Viscosity and Thermal Conductivity of Heavy Water (PaperID 4690) (Invited)
Marcia Huber, Marc Assael, Richard Perkins*, Stella Monogenidou, Robert Hellmann and Jan Sengers
11:15 AM   Reference Correlations for the Viscosity and Thermal Conductivity of Xenon from the Triple Point to High Temperatures and Pressures (PaperID 4113)
Danai Velliadou*, Katerina Tasidou, Konstantinos Antoniadis, Marc Assael, Marcia Huber and Richard Perkins
11:35 AM   Reference Correlations for the Viscosity and Thermal Conductivity of Ethylene Glycol from the Triple Point to High Temperatures and Pressures (PaperID 4115)
Markos Mebellis*, Danai Velliadou, Marc Assael and Marcia Huber
11:55 AM   New Data, Reference Data and Reference Correlations for [C6mim][(CF3SO2)2N] (PaperID 4525)
Xavier Paredes, Carla Queirós, Fernando Santos, Ângela Santos, Maria da Soledade Santos, Maria José Lourenço* and Carlos Nieto de Castro
12:15 PM   Session Panel: Q&A (PaperID 4711)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Fluid Property Measurements 5
Chair: Ala Bazyleva
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Needle Probe for Measuring Thermal Conductivity of Molten Salts (PaperID 4197)
Brian Merritt*, Peter Hartvigsen, McKay Wilkerson, Kurt Davis and Troy Munro
10:55 AM   Thermophysical Properties of New Ga-Sn-Zn Liquid Alloys (PaperID 4542)
Alexandra Dobosz* and Tomasz Gancarz
11:15 AM   The Effect of Nozzle Design in the Discharge Crucible Method (PaperID 4489)
Quentin Champdoizeau*, Hani Henein and Abdoul-Aziz Bogno
11:35 AM   Thermal Conductivity of Common Fluids from -100OC to 300 OC Using a Single-Wire Transient Hot-Wire Sensor (PaperID 4527)
Sofia Mylona* and Dale Hume
11:55 AM   Determination of Fick Diffusion Coefficients in Electrolyte Systems Comprised Entirely of Ions by Dynamic Light Scattering (DLS) (PaperID 4165)
Maximilian Piszko, Chathura J. Kankanamge, Michael Heinrich Rausch, Tobias Klein and Andreas Paul Fröba*
12:15 PM   Session Panel: Q&A (PaperID 4718)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Molecular Simulation 4
Chair: Andrei Kazakov
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Structural Properties of Ionic Surfactants using a SAFT-𝜸 Mie Force Field in Molecular Simulation (PaperID 4576)
Matthias Kiesel*, George Jackson, Erich A. Müller and Amparo Galindo
10:55 AM   Construction of a Composite-Sphere Model for Molecules of Tetrahedral Symmetry (PaperID 4646)
Lloyd Lee, Giuseppe Pellicane*, Franklin Ramos and Ana Ramos
11:15 AM   Thermophysical Properties of Molten Salts Using Atomistic Simulations (PaperID 4207)
Haimeng Wang*, Ryan S. DeFever, Yong Zhang, Fei Wu, Shobha Sharma, Matthew S. Emerson, Claudio J. Margulis and Edward J. Maginn
11:35 AM   Kirkwood-Buff Integrals from Molecular Simulation (PaperID 4259)
Noura Dawas, Peter Kruger, Sondre Kvalvåg Schnell, Jean-Marc Simon* and Thijs Vlugt
11:55 AM   Thermophysical and Atomic Transport Properties of Mixed-Oxide Fuel: Interatomic Empirical Potential and Ab Initio Calculations (PaperID 4572)
Didier Bathellier*, Michel Freyss, Luca Messina, Marjorie Bertolus, Pär Olsson and Emeric Bourasseau
12:15 PM   Session Panel: Q&A (PaperID 4735)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Non-equilibrium Thermodynamics 5 - Interfacial Phenomena
Chair: J Miguel Rubi
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Entropy Production in a Shock Wave (PaperID 4078) (Invited)
Bjørn Hafskjold*, Dick Bedeaux, Signe Kjelstrup and Øivind Wilhelmsen
11:15 AM   Transient Melting and Freezing Under Thermal Gradient: a Non-Equilibrium Simulation Study (PaperID 4149)
Fernando Bresme*, Francesc Font and William Micou
11:35 AM   A Missing Thermodynamic Ingredient in Classical Nucleation Theory? (PaperID 4177)
Ailo Aasen*, Øivind Wilhelmsen and David Reguera
11:55 AM   Session Panel: Q&A (PaperID 4745)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Posters 1 - AM Poster Session
Chair: Joseph Magee and Jason Widegren
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

Correlations, Databases, and Engineering Equations of State
  Influence of NRTL Parameters on the Separation of Water + Alcohol Systems (PaperID 4219)
Jean-Gideon Steenkamp and Cara Schwarz*
Fluid Property Measurements
  Combination of Molecular Dynamics Simulation and Gravimetric Experiments: The Key to Accurate Dew-Point Densities? (PaperID 4555)
Luca Bernardini*, Markus Sekulla and Markus Richter
Instrumentation and Measurement Techniques
  Modified Isothermal Phase Equilibria Apparatus for Solubility Measurements of Carbon Dioxide in Aqueous Amine Solutions (PaperID 4086)
Alejandro Moreau*, José J. Segovia, Miguel A. Villamañán, Rosa M. Villamañán and M. Carmen Martín
  Conceptual Sensor Design for Hydrogen-Enriched Natural Gas Mixtures (PaperID 4296)
Vanessa Kaub* and Roland Span
Molecular Simulation
  A Molecular Model for Poly(oxymethylene) Dimethyl Ethers (OME) (PaperID 4084)
Aditya Kulkarni*, Edder J. Garcia, Angelo Damone, Michael Schappals, Simon Stephan, Maximilian Kohns and Hans Hasse
  A Database for Molecular Models for the Simulation of Thermodynamic Properties of Fluids (PaperID 4495)
Simon Stephan*, Martin Horsch, Jadran Vrabec and Hans Hasse
Optical and Thermal Radiative Properties
  Emissivity Measurements on Reflective Insulation Materials (PaperID 4229)
Albert Adibekyan*, Elena Kononogova, Christian Monte, Jacques Hameury and Jörg Hollandt
  Complex Oxidation Behavior of Ti-6Al-4V Revealed by Infrared Emissivity Measurements (PaperID 4124)
Iñigo González de Arrieta*, Telmo Echaniz, Luis Gonzalez-Fernandez and Manuel Tello
  Development, Simulation and Realization of a Nearly Lambertian Surface for the FIR Range (PaperID 4630)
Elena Kononogova*, Christian Monte, Mathias Kehrt, Nathan A. Tomlin, John H. Lehman and Jörg Hollandt
Properties for Fuels and Energy Systems
  Accurate Experimental Speed of Sound Data of Natural Gas and Hydrogen-Enriched Natural Gas Mixtures (PaperID 4088)
Daniel Lozano-Martín, César R. Chamorro, Dirk Tuma, David Vega-Maza* and José J. Segovia
  Phase Equilibria and Speed of Sound Measurements of Carbon Dioxide and Nitrogen Mixtures (PaperID 4089)
Daniel Lozano-Martín*, Rodrigo Susial, Angel Gómez-Hernández, Teresa E. Fernández-Vicente, Andrés Rojo and José J. Segovia
Properties of Aqueous Systems
  Predictive Models for the Phase Behaviour and Solution Properties of Weak Electrolytes: Nitric, Sulfuric and Carbonic Acids (PaperID 4077)
Maximilian Kohns*, Spiros Kournopoulos, Silvia Di Lecce, Georgia Lazarou, Esther Forte, Felipe A. Perdomo, George Jackson, Claire S. Adjiman and Amparo Galindo

21st Symposium
Wednesday, June 23, 2021
Software Demonstrations 1
Chair: Vladimir Diky
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   NIST ThermoData Engine version 10.4.2 (PaperID 4206)
Vladimir Diky, Ala Bazyleva*, Eugene Paulechka, Joseph W. Magee, Andrei F. Kazakov, Demian Riccardi, Eric W. Lemmon and Ian H. Bell
12:35 PM   REFPROP - Reference Fluid Thermodynamic and Transport Properties (PaperID 4675)
Eric W. Lemmon, Marcia Huber, Ian H. Bell* and Mark McLinden
12:35 PM   The Citrine Platform for Machine Learning and Data Management (PaperID 4669)
Maxwell Hutchinson*, Ryan Latture, Brendan Folie, Kenneth Kroenlein, Gregor Robinson and Raphael Stargrove

21st Symposium
Wednesday, June 23, 2021
Posters 2 - PM Poster Session
Chair: Jason Widegren and Joseph Magee
Afternoon 2       5:00 PM – 7:00 PM       Room: Virtual

Properties of Aqueous Systems
  Thermodynamic Properties of Deep-Ocean Water Mixtures from Experimental Sound-Speed Measurements (PaperID 4536)
Subash Dhakal*, Saif Al Ghafri, Darren Rowland, J.P. Martin Trusler, Eric May and Paul Stanwix
Correlations, Databases, and Engineering Equations of State
  Precise Measurements of Isothermal PVTx and Vapor Liquid Equilibrium Properties for Low GWP refrigerant R1123/R1234yf/R32 Ternary Mixtures (PaperID 4109)
Tessei Yamada* and Hiroyuki Miyamoto
Instrumentation and Measurement Techniques
  The Measurement of Vapor-Phase Composition, Vapor Density, and More with 1H NMR Spectroscopy (PaperID 4662)
Jason Widegren*, Christopher Suiter, Mark McLinden, Veruska Malavé and Edward Garboczi
Molecular Simulation
  Parsimonious Comparison of Non-Bonded Models Using Bayesian Inference (PaperID 4657)
Owen Madin*, Simon Boothroyd, Richard Messerly and Michael Shirts
Properties of Solids
  Evaluation of the Glass Transition Temperature of EPDM by Dynamic Mechanical Analyzer (PaperID 4575)
Daeho Kim*, Jae Kap Jung and Sanghyun Lee
Theory of Thermophysical Properties
  Numerical Simulations of the Molecular Behavior and Entropy of Non-Ideal Argon (PaperID 4057)
Matthew Marko*
Thermal Properties of Nanostructured Materials
  Thermal Non-equilibrium between Optical and Acoustic Phonons in Graphene Paper under Photon Excitation (PaperID 4192)
Hamidreza Zobeiri*
Wetting, Interfaces, and Membranes
  Contact Angle Analysis of Water Droplet and Hydrate/Pipe Surface Interfaces (PaperID 4288)
Zek Kelly, Hannah Stoner*, Carolyn Koh, Jose Delgado, Marshall  Pickarts, Magnus Chun and Jonathan Wells

21st Symposium
Wednesday, June 23, 2021
Fluid Property Measurements 6
Chair: Diego Cristancho
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Solids Formation Risk in Natural Gas, LNG and Liquid Hydrogen Production (PaperID 4280) (Invited)
Eric May*, Peter Metaxas, Paul Stanwix, Peter Falloon, Darren Rowland, Arman Siahvashi, Saif Al Ghafri, Vincent Lim, Matthew Hopkins, Catherine Sampson, Xiong Xiao, David Zhu, Mirhadi Seyyedsadaghiani, Brendan Graham, Bruce Norris, Michael Johns and Zachary Aman
7:45 PM   Visual Measurements of Water Solubility in Methane and Hydrate Equilibrium at Cryogenic Conditions with Implications for LNG Production (PaperID 4183)
Mirhadi S. Sadaghiani*, Arman Siahvashi, Bruce Norris, Saif Al-Ghafri, Peter J. Metaxes, Arash Arami-Niya, Zackary M. Aman and Eric May
8:05 PM   Hydrate Slurries Viscosity Measurements Coupled with Visualization (PaperID 4070)
Ahmad Afif Abdul Majid* and Carolyn Koh
8:25 PM   Solubility of Methanethiol in Water (PaperID 4203)
Fang Y. Jou, Alan E. Mather, Craig N. Schubert and Kurt A. G. Schmidt*
8:45 PM   Session Panel: Q&A (PaperID 4716)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Properties of Solids 2
Chair: Scott J. McCormack
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Madelung Energy and Bragg Peak Function from Finite Volume Kirkwood-Buff Integrals (PaperID 4208)
Peter Krüger*
7:25 PM   Heat Transfer Interface Guided Design for an Instrument to Measure the Heat Transfer Coefficient in Friction Stir Welding (PaperID 4194)
Daniel Ellis*, Matthew Goodson, Michael Miles and Troy Munro
7:45 PM   Extension of Kirkwood-Buff Integral Theory to Solids (PaperID 4160)
Masafumi Miyaji*, Bastien Radola, Jean-Marc Simon and Peter Krüger
8:05 PM   Quantitative Analysis of Heat Transfer Coefficient for Friction Stir Welding Temperature Profiles (PaperID 4490)
Matthew Goodson*, Michael Miles and Troy Munro
8:25 PM   Anomalous Electrical and Thermal Transport Properties of Pyrolytic Graphite Films at Near Room Temperatures (PaperID 4285)
Meng Han* and Xiaoliang Zeng
8:45 PM   Session Panel: Q&A (PaperID 4766)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Properties of Working Fluids including Refrigerants 2
Chair: Stephanie Outcalt
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Speed of Sound Measurement for HFO Refrigerants in the Liquid Phase (PaperID 4661)
Takashi Nishiyama*, Taro Kuranari, Lei Gao, Yukihiro Higashi and Ryo Akasaka
7:25 PM   Speed of Sound Measurements of Binary Mixtures of 1,1,1,2-Tetrafluorethane, 2,3,3,3-Tetrafluoropropene, and 1,3,3,3-Tetrafluoropropene Refrigerants (PaperID 4498)
Aaron Rowane* and Richard Perkins
7:45 PM   Measurement of Transport Properties of R1336mzz(E) (PaperID 4518)
Atiqur Rahman Tuhin*, Dipayan Mondal, Naomasa Amakusa, Keishi Kariya and Akio Miyara
8:05 PM   Compressed Liquid Viscosity of Binary Mixtures of 1,1,1,2-Tetrafluoroethane (R134a) and Trans-1,3,3,3-Tetrafluoroprop-1-ene (R1234ze(E)) from (273 to 353) K at Pressures up to 15 MPa (PaperID 4283)
Ximei Liang*, Jinrong Sun, Xianyang Meng and Jiangtao Wu
8:25 PM   Session Panel: Q&A (PaperID 4770)
Session Chair & Speakers*

21st Symposium
Wednesday, June 23, 2021
Wetting, Interfaces, and Membranes 4 - Wetting, Interfaces, Membranes, Hydrates
Chair: Zachary Aman
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Permeability, Solubility, and Diffusivity of HFC-32 and HFC-125 in Polymeric Membranes (PaperID 4069)
Abby Harders*, Erin Sturd, Kathryn McNaughton, David Corbin and Mark B. Shiflett
7:25 PM   Direct Observation of Cationic Surfactant Adsorption via in-situ Raman Spectroscopy (PaperID 4199)
Kwanghee Jeong*, Paul Stanwix, Eric May and Zachary Aman
7:45 PM   Quantification of Hydrate Formation Probability in Thermodynamically- and Kinetically-Inhibited Systems (PaperID 4230)
Vincent Lim*, Peter Metaxas, Mark Barwood, Michael Johns, Zachary Aman and Eric May
8:05 PM   Micromechanical Force Measurements for Biomedical Applications (PaperID 4105)
Angus McKenzie*, Barry Doyle and Zachary Aman
8:25 PM   Carbon Dioxide Hydrate in a Microfluidic Device: Phase Boundary and Crystallization Kinetics with Micro-Raman Spectroscopy (PaperID 4290)
Jonathan Wells*, Weiqi Chen, Ryan Hartman and Carolyn Koh
8:45 PM   Session Panel: Q&A (PaperID 4785)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Fluid Property Measurements 7
Chair: Ala Bazyleva
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Planning and Justification of Thermophysical Research: a Data Aspect (PaperID 4204)
Vladimir Diky*, Eugene Paulechka and Ala Bazyleva
6:55 AM   Density Measurements for the System Ethylbenzene + Propylene Carbonate for the Temperature Range of (283.15 - 343.15) K (PaperID 4270)
Maria I. Gabriel, Ana Cristino*, Luis Nobre, Ângela Santos, Maria Isabel Lampreia and Ala Bazyleva
7:15 AM   Use of Aminosiloxanes for CO2 Capture in Gas-Treating Solvents (PaperID 4195)
Jacob Crosthwaite* and Florin Dan
7:35 AM   Thermodynamic Properties of Liquid Toluene from Speed-of-Sound Measurements at Temperatures from 283.15 to 473.15 K and at Pressures up to 390 MPa (PaperID 4535)
Subash Dhakal*, Weparn Tay, Sean Mullins, Darren Rowland, Saif Al Ghafri, Eric May, J.P. Martin Trusler and Paul Stanwix
7:55 AM   Session Panel: Q&A (PaperID 4720)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Fuels and Energy Systems 2 - Carbon Dioxide
Chair: Kurt A. G. Schmidt
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   The Challenges of Determining Reliable Thermophysical Properties Required for CO2 Carbon Capture and Storage. (PaperID 4701) (Invited)
Jefferson Creek*
7:15 AM   Simultaneous CCS and NG Storage in Salt Caverns (PaperID 4246)
Stefan Pollak*, Vincent Bürk and Sergio E. Quiñones-Cisneros
7:35 AM   Phase Barotropicity in Blends of CO2 with Oil of Different Chemical Structures (PaperID 4240)
Vincent Bürk*, Stefan Pollak and Sergio E. Quiñones-Cisneros
7:55 AM   Gradient Barotropicity in Columns of Oil (PaperID 4244)
Sergio E. Quiñones-Cisneros*, Vincent Bürk, Stefan Pollak and Kurt Schmidt
8:15 AM   Session Panel: Q&A (PaperID 4759)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Materials Science at High Temperatures 2
Chair: Gernot Pottlacher
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Surface Tension of Liquid Ti with Adsorbed Oxygen and Its Prediction (PaperID 4522) (Invited)
Juergen Brillo*, Johanna Wessing, Hidekazu Kobatake and Hiroyuki Fukuyama
7:15 AM   Enthalpy Measurements from Levitation-Processed Hypercooled TiAlCrNb (PaperID 4541)
Douglas M. Matson*
7:35 AM   Thermophysical Property Measurement of Levitated Molten Ni-Based Superalloys (PaperID 4556)
Jannatun Nawer*, Stéphane Gossé, Michael Sansoucie and Douglas Matson
7:55 AM   Density and Surface Tension of 304L and 16MND5 Liquid Steel Using Droplet-Based or Bubbling Techniques (PaperID 4121)
Jules Delacroix* and Nourdine Chikhi
8:15 AM   Session Panel: Q&A (PaperID 4751)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties of Aqueous Systems 3
Chair: Simona Lago
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Minimal Lattice Model with Water-Like Anomalies (PaperID 4629) (Invited)
Frédéric Caupin* and Mikhaïl A. Anisimov
7:15 AM   A Combined Density-Functional Theory and Molecular Dynamics Study on the Adsorption Behavior of Corrosion Inhibitors at the Iron-Water Interface (PaperID 4581)
Seba Alareeqi*, Daniel Bahamon, Ricardo Nogueira and Lourdes F. Vega
7:35 AM   Surface Tension and Density of Water + Ethylene Glycol Mixtures at Low Temperatures Including Metastable Supercooled State (PaperID 4055)
Vaclav Vins*, Jiri Hykl, Olga Prokopova, Josefine Gatter, Jaroslav Klomfar, Monika Souckova, Miroslav Censky and Ales Blahut
7:55 AM   Session Panel: Q&A (PaperID 4792)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Wetting, Interfaces, and Membranes 5 - Confinement and Transport
Chair: Walter Chapman
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Soft Materials Surface and Interface Characterization Through Molecular Dynamics Simulations (PaperID 4253)
Francesco Maria Bellussi*, Annalisa Cardellini, Pietro Asinari and Matteo Fasano
6:55 AM   Molecular Simulations Insights into the Performance of Hybrid Graphene Oxide Membranes for Water Treatment (PaperID 4585)
Daniel Bahamon*, Ki Ryuk Bang, Eun-Seon Cho and Lourdes F. Vega
7:15 AM   Stochastic Hybrid Multiscale Model for Gas-Solid Interfacial Systems (PaperID 4216)
Changho Kim*, Andy Nonaka, Alejandro Garcia and John Bell
7:35 AM   Session Panel: Q&A (PaperID 4784)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Fluid Property Measurements 8
Chair: Ala Bazyleva
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Tests of Working Equations for the Oscillating Quartz- Crystal Viscometer (PaperID 4068) (Invited)
Stephen Richardson and William Wakeham*
9:15 AM   Measurement of the Viscosity of (Hydrogen + Methane) and (Hydrogen + Carbon Dioxide) Gas Mixtures (PaperID 4684)
Benjamin Betken*, Bahareh Khosravi and Roland Span
9:35 AM   Density and Viscosity of Aqueous Silver Nitrate/Olefin Solutions (PaperID 4501)
Berlyn Mellein*, Mark B. Shiflett and Aaron Scurto
9:55 AM   Evaluation of the Applicability and Limits of Dynamic Light Scattering (DLS) for the Simultaneous Measurement of Diffusivities (PaperID 4161)
Maximilian Piszko*, Michael Heinrich Rausch, Cédric Giraudet and Andreas Paul Fröba
10:15 AM   Session Panel: Q&A (PaperID 4721)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Molecular Simulation 5
Chair: Daniel Siderius
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Analyzing Coarse-Grained Model Assumptions Through Variational Autoencoders (PaperID 4153)
Jacob Monroe* and Vincent Shen
8:55 AM   Efficient Force Field Tuning for Predicting Thermophysical Properties (PaperID 4182)
Bridgette Befort*, Ryan DeFever, Garrett Tow, Alexander Dowling and Ed Maginn
9:15 AM   Automated Property Predictions in the Open Force Field Initiative and Their Application in Small Organic Molecule Force Field Parameterization (PaperID 4653)
Owen Madin*, Simon Boothroyd, Jeffrey Wagner, Matthew Thompson, David Mobley, Michael Gilson, John Chodera, Lee-Ping Wang and Michael Shirts
9:35 AM   Utilizing the Molecular Simulation Design Framework (MoSDeF) to Screen Soft Matter Systems (PaperID 4691)
Justin Gilmer*, Andrew Summers, Co D. Quach, Christopher R. Iacovella, Peter T. Cummings and Clare McCabe
9:55 AM   Perturbation Theory Based Equation of State for Small Systems under Confinement (PaperID 4169)
Vilde Bråten*, Daniel Tianhou Zhang, Sebastian Everard Nordby Price, Morten Hammer, Ailo Aasen, Sondre Kvalvåg Schnell and Øivind Wilhelmsen
10:15 AM   Session Panel: Q&A (PaperID 4736)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Non-equilibrium Thermodynamics 7 - Fluctuations and Transport Phenomena
Chair: Werner Köhler
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Dynamic Shadowgraphy Measurements of the Diffusion and Soret Coefficients in Triethylene Glycol - Water Binary Mixtures (PaperID 4164)
Ange Tatiana Ndjaka*, Paul Fruton, Arnault Lassin, Mohamed Azaroual, Fabrizio Croccolo and Henri Bataller
8:55 AM   Characterization of the Convective Dissolution of CO2 in Water at a Temperature of 308 K and Pressures up to 10 MPa (PaperID 4221)
Paul Fruton*, Henri Bataller, Cédric Giraudet and Fabrizio Croccolo
9:15 AM   Applicability of the Shadowgraph Method for the Determination of Diffusion Coefficients (PaperID 4186)
Wenchang Wu*, Julius Hans Jander, Michael Heinrich Rausch, Cédric Giraudet and Andreas Paul Fröba
9:35 AM   Nonequilibrium Hydrodynamic Fluctuations Driven by Concentration and Temperature Gradients Across a Transpiration Membrane (PaperID 4156)
Ishan Srivastava*, Daniel Ladiges, Andy Nonaka, John Bell and Alejandro Garcia
9:55 AM   Multiscale Image Processing Method for Investigating Giant Concentration Fluctuations in Nanocolloids (PaperID 4643)
Ana Oprisan*, David Dorf, Patrick Simonson and Sorinel Oprisan
10:15 AM   Session Panel: Q&A (PaperID 4740)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Optical and Thermal Radiative Properties 1 - Emissivity Measurement and Modeling-I
Chair: Zhuomin Zhang
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   High-Accuracy Emissivity Data on Black Coatings for ESA’s Ninth Earth Explorer Mission FORUM (PaperID 4228)
Albert Adibekyan*, Elena Kononogova, Christian Monte, Charlotte Pachot, Bernardo Carnicero Domínguez, Daniel M. Peters, Dave Smith, Edoardo Alberti, Philippe Giaccari and Jörg Hollandt
8:55 AM   Apparent Emissivity Measurement of Semitransparent Materials (PaperID 4137)
Julian Gieseler*, Christian Monte, Albert Adibekyan and Jörg Hollandt
9:15 AM   Infrared Emissivity of Noble Metals and the Anomalous Skin Effect (PaperID 4126)
Iñigo González de Arrieta*, Telmo Echaniz, Albert Adibekyan, Christian Monte, Joerg Hollandt and Gabriel A. Lopez
9:35 AM   Direct Emissivity Measurements at UPV/EHU: Updated Methods and Uncertainty Budget (PaperID 4090)
Telmo Echániz*, Iñigo González de Arrieta, Raquel Fuente and Gabriel Alejandro López
9:55 AM   Session Panel: Q&A (PaperID 4747)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Theory of Thermophysical Properties 2
Chair: Andrew Paluch
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Quantifying the Effect of Polar Interactions on the Thermophysical Properties of Selected Model and Experimental Systems (PaperID 4577)
Ismail Alkhatib and Lourdes F. Vega*
8:55 AM   Extending the SAFT-Gamma Mie Approach to Model Benzoic Acid, Diphenylamine, and Mefenamic Acid: Solubility Prediction and Experimental Measurement (PaperID 4543)
Thomas Bernet*
9:15 AM   Predicting the Phase Behaviour and Ph-Solubility Profiles of Active Pharmaceutical Ingredients Using the SAFT-Γ Mie Group-Contribution Approach (PaperID 4533)
Malak Wehbe*, Andrew Haslam, George Jackson and Amparo Galindo
9:35 AM   Leverage Electron Properties to Predict Phonon Properties via Transfer Learning for Semiconductors (PaperID 4546)
Zeyu Liu, Meng Jiang and Tengfei Luo*
9:55 AM   Addressing the Capacity of Fluorinated Ionic Liquids and Deep Eutectic Solvents for the Separation and Recovery of Refrigerants (PaperID 4547)
Daniel Jovell, Joao Araújo, Ana Belén Pereiro and Fèlix Llovell*
10:15 AM   Session Panel: Q&A (PaperID 4772)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Correlations, Databases, and Engineering Equations of State 8
Chair: Eric W. Lemmon
Morning 1       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Generalized Equations of State for the Calculation of Thermodynamic Properties of Hydrocarbon Mixtures (PaperID 4512)
Monika Thol*, Robin Beckmüller, Tobias Dietl, Roland Span and Eric W. Lemmon
10:55 AM   A Generalized Fundamental van der Waals Equation of State (PaperID 4249)
Sergio E. Quiñones-Cisneros*, Stefan Pollak and Ulrich K. Deiters
11:15 AM   The Representation of Cross Second Virial Coefficients by Multi-Fluid Mixture Models and Other Equations of State (PaperID 4538)
Andreas Jäger*, Cornelia Breitkopf and Markus Richter
11:35 AM   New Fundamental Equations of State for Hydrogen-Rich Binary Mixtures (PaperID 4059)
Robin Beckmüller*, Monika Thol, Ian H. Bell, Eric W. Lemmon and Roland Span
11:55 AM   A New Model Combining Helmholtz Energy Equations of State with Gibbs Excess Models to Describe Reactive Mixtures (PaperID 4503)
Tobias Neumann*, Jana Poplsteinova Jakobsen, Monika Thol and Roland Span
12:15 PM   Session Panel: Q&A (PaperID 4710)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Optical and Thermal Radiative Properties 2 - Emissivity Measurement and Modeling-II
Chair: Leonard Hanssen
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Measurement of Characteristic Spatial Distributions of Emissivity and Temperature of Laser Powder Bed Fusion Processes at the NIST AMMT Facility (PaperID 4545) (Invited)
David Deisenroth*, Leonard Hanssen and Sergey Mekhontsev
11:15 AM   Characterization of Temperature-dependent Radiative Properties of Narrow-Bandgap Semiconductor Selective Emitters with High-Temperature Fourier-Transform Spectrometry (PaperID 4242)
Cheng-An Chen, Jeremy Chao, Nikolas Deffigos and Liping Wang*
11:35 AM   Thermal Radiation Spectra of Nanoplasmonic Structures: Simulation, Theory and Application (PaperID 4624)
Zhuo Li*, Jiayu Li, Bowen Yu and Sheng Shen
11:55 AM   Session Panel: Q&A (PaperID 4748)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Materials Science at High Temperatures 3
Chair: Boris Wilthan
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Re-Investigation of the Normal Spectral Emissivity at 684.5 nm of Solid and Liquid Molybdenum (PaperID 4128)
Alexander Eber, Peter Pichler* and Gernot Pottlacher
10:55 AM   Time-Resolved Micro-Spectral Radiometry During Nanosecond Laser Pulse Heating of Tungsten Thin Films (PaperID 4231)
Yermek Yermekbay*, Azat Abdullaev, A. Dawood, Tanat Kissikov, Zhanatay Nurekeyev, C. Spitas, K.V. Kostas and Zhandos Utegulov
11:15 AM   Molten Salt Hot Wire Sensor for Thermal Conductivity (PaperID 4250)
Peter Kasper*, Troy Munro, Kirsten Steele, Jay Bettinger, Jace Davis, Connor Last and Erik Barbosa
11:35 AM   Session Panel: Q&A (PaperID 4752)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties of Metastable and Glassy Systems 1
Chair: Frédéric Caupin
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Ideal Glasses and New Materials (PaperID 4685) (Invited)
Mark Ediger*
11:15 AM   A Digression to Ionic Liquid Metastability- The case of C2mim][CH3SO3] (PaperID 4513)
Daniel Lozano-Martín, Salomé Vieira, Xavier Paredes, Maria José Lourenço, Carlos Nieto de Castro*, Jan Sengers and Klemens Massonne
11:35 AM   Session Panel: Q&A (PaperID 4781)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Wetting, Interfaces, and Membranes 6 - Hydrates- Modeling of Interfaces
Chair: Luis E. Zerpa
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Performance of Surfactants Used as Anti-Agglomerants for Hydrate Management: Insights from Molecular Dynamics Simulations (PaperID 4245)
Alberto Striolo, Anh Phan* and Carolyn Koh
10:55 AM   Study of the Adsorption of Volatiles and Surface Processes on Astrophysical Ices and Clathrates using Molecular Simulations (PaperID 4189)
Antoine Patt*, Jean-Marc Simon, J. Marcos Salazar and Sylvain Picaud
11:15 AM   A Machine Learning Algorithm for Detection and Measurement of Hydrate Droplets and Agglomerates in Flowlines (PaperID 4074)
Daniel Croce*, Hannah Stoner, Kattie Elis and Carolyn Koh
11:35 AM   Hydrate-Phobic Surface Treatment for Deposition Prevention (PaperID 4196)
Marshall Pickarts*, Erika Brown and Carolyn Koh
11:55 AM   Clathrate Hydrate Contact Angle/Wettability Investigations for Multiphase Agglomeration Models (PaperID 4209)
Hannah Stoner*, Anh Phan, Alberto Striolo and Carolyn Koh
12:15 PM   Session Panel: Q&A (PaperID 4787)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Instrumentation and Measurement Techniques 6
Chair: Tara Fortin
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Water & Air Calibration of Vibrating-Tube Densimeter at Temperatures from 0 to 90°C and Atmospheric Pressure (PaperID 4054)
Olga Prokopova, Ales Blahut, Miroslav Censky, Monika Souckova and Vaclav Vins*
12:55 PM   Novel Experimental Ultrasound Technique for Determining the Gravitational Stability of Magnetic Fluids/Colloids (PaperID 4239)
Ainara Gómez*, Illart Alcorta, Joanes Berasategi, Tomas Gómez Álvarez-Arenas and M. Mounir Bou-Ali
1:15 PM   Streaming Potential Measurement at Supercritical CO2 Condition (PaperID 4537)
Miftah Hidayat*, Jan Vinogradov, Stefan Iglauer, David Vega-Maza, Jos Derksen and Mohammad Sarmadivaleh
1:15 PM   An Optical Based AC-Calorimetry Method for In-Plane Thermal Conductivity Measurement (PaperID 4278)
Dihui Wang*
1:55 PM   Session Panel: Q&A (PaperID 4726)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Non-equilibrium Thermodynamics 8 - Multidisciplinary Applications
Chair: Øivind Wilhelmsen
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Out-of-Equilibrium Self-Assembly for the Formation of Soft-Matter and Biological Structures (PaperID 4509)
J Miguel Rubi*, Andres Arango-Restrepo and Daniel Barragan
12:55 PM   Fast Manometric Method for Determining the Effective Oxygen Diffusion Coefficient Through Wine Stopper (PaperID 4257)
Julie Chanut, Jean-Marc Simon*, Jean-Pierre Bellat and Thomas Karbowiak
1:15 PM   Self-Thermophoresis at the Nanoscale Using Light Induced Solvation Dynamics (PaperID 4632)
Carles Calero*, Rossend Rey and Edwin L. Sibert III
1:35 PM   Mechanical Behavior and Emerging Morphologies in Active Matter (PaperID 4526)
Ignacio Pagonabarraga*
1:55 PM   Session Panel: Q&A (PaperID 4746)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Optical and Thermal Radiative Properties 3 - Radiative Properties and Applications-I
Chair: Liping Wang
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Thermal Nanophotonics in Functional Metamaterials (PaperID 4529) (Invited)
Yi Zheng*
1:15 PM   Tunable Nanophotonic Filter Based on Thermochromic Vanadium Dioxide (PaperID 4255)
Jeremy Chao*, Sydney Taylor and Liping Wang
1:35 PM   Measurements and Modeling of the Spectral Radiative Properties of SiO2­ Particle Beds (PaperID 4603)
Chuyang Chen*, Chiyu Yang, Devesh Ranjan, Peter Loutzenhiser and Zhuomin Zhang
1:55 PM   Session Panel: Q&A (PaperID 4749)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Fuels and Energy Systems 3 - Properties of Fuels and Biofuels
Chair: Andreas Paul Fröba
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Thermophysical Properties of OMEX Synthetic Fuels (PaperID 4574)
Javid Safarov* and Karsten Müller
12:55 PM   Viscosity and Interfacial Tension of Long-Chained Alkanes, Alcohols, and their Mixtures with Dissolved Gases (PaperID 4215)
Tobias Klein*, Frances Daggett Lenahan, Manuel Kerscher, Ziwen Zhai, Thomas Manfred Koller, Michael Heinrich Rausch and Andreas Paul Fröba
1:15 PM   Characterization of Mutual Diffusion in Liquids with Dissolved Gases (PaperID 4166)
Frances Lenahan*, Thomas Manfred Koller, Michael Rausch, Tobias Klein and Andreas Paul Fröba
1:35 PM   Viscosity and Interfacial Tension of Liquid Organic Hydrogen Carrier (LOHC) Systems by Surface Light Scattering and Conventional Techniques (PaperID 4223)
Manuel Kerscher*, Patrick Sebastian Schmidt, Francisco Eduardo Berger Bioucas, Patrick Preuster, Thomas Manfred Koller, Michael Heinrich Rausch, Peter Wasserscheid and Andreas Paul Fröba
1:55 PM   Session Panel: Q&A (PaperID 4760)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties of Aqueous Systems 4
Chair: Essmaiil Djamali
Afternoon 1       12:30 PM – 2:30 PM       Room: Virtual

12:35 PM   Kinetics and Equilibrium of Hydrogen Solubility in Water and Brines at High Pressures (PaperID 4252)
J.P. Martin Trusler* and Geraldine Torin-Ollarves
12:55 PM   New Data for the Ionisation Constant of Water at High Temperatures and Pressures from Direct Conductivity Measurements (PaperID 4226)
Hugues Arcis*, Jane P. Ferguson, Jenny S. Cox and Peter R. Tremaine
1:15 PM   Electrolyte Nonrandom Two-Liquid Activity Coefficient Model with Association Theory (PaperID 4052)
Yu-Jeng Lin* and Chau-Chyun Chen
1:35 PM   Chemical Phenomena at the Critical Point of Solution (PaperID 4066)
James Baird*
1:55 PM   Modeling Speciation and Phase Equilibria in Aqueous Systems Containing Rare Earth Elements in the Presence of Inorganic and Organic Ligands (PaperID 4500)
Gaurav Das, Jiangping Liu, Malgorzata Lencka and Andre Anderko*
2:15 PM   Session Panel: Q&A (PaperID 4758)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Molecular Simulation 6
Chair: Andrei Kazakov
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   NMR Relaxation of Alkanes and Water in Nanoporous Shale Systems (PaperID 4652)
Arjun Valiya Parambathu*, Dilip N. Asthagiri, Philip M. Singer, George J. Hirasaki and Walter G. Chapman
7:25 PM   Baby Shark, u u u u u u: The Effect of Nanoscale Fins on Velocity Autocorrelation and Heat Transfer at Fluid-Solid Interfaces> (PaperID 4664)
Yuanhao Li and Gerald Wang*
7:45 PM   Quasi-2D Phase Transition of Methane Adsorbed in Cylindrical Silica Mesopores (PaperID 4258)
Daniel Siderius*, William Krekelberg, Wei-Shan Chiang, Yun Liu and Vincent Shen
8:05 PM   Thermodynamic Properties from Combining Intermolecular Potentials (PaperID 4193)
Richard Sadus*
8:25 PM   Study of Kapitza Resistance at Fluid-Solid Interfaces in Planar and Cylindrical Nano-Confinement Systems (PaperID 4108)
Sobin Alosious*, Sridhar Kumar Kannam, Sarith P Sathian and Billy Todd
8:45 PM   Session Panel: Q&A (PaperID 4737)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Optical and Thermal Radiative Properties 4 - Radiative Properties and Applications-II
Chair: Liping Wang
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Fiber Coupled Near-Field Thermoplasmonic Emission from Gold Nanorods at 1100 K (PaperID 4626) (Invited)
Jiayu Li, Zhuo Li and Sheng Shen*
7:45 PM   High-Temperature Emittance of Bauxite and SiO2­ Particle Beds (PaperID 4605)
Chuyang Chen, Chiyu Yang*, Devesh Ranjan, Peter Loutzenhiser and Zhuomin Zhang
8:05 PM   Characterization of Single-Particle Scattering Properties Using a Laser Scatterometer (PaperID 4610)
Shin Young Jeong*, Chuyang Chen, Devesh Ranjan, Peter Loutzenhiser and Zhuomin Zhang
8:25 PM   Session Panel: Q&A (PaperID 4750)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Fuels and Energy Systems 4 - Phase Behavior and Properties
Chair: Eric May
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   An Experimental Study of High Temperature, High Pressure, Multi-phase Reactions between Sulfur and Hydrocarbons; Phase Behavior and Reaction Results (PaperID 4638)
Peter Koronaios*, David Ertle, Ryan Weber, Glenn Cormack, Riddhesh Patel, Goetz Veser, Hseen Baled and Robert Enick
7:25 PM   A Simpler Approach for Gas Hydrate Phase Equilibria in Inhibited Systems (PaperID 4096)
Amadeu Sum*
7:45 PM   Measurements of Solidification Kinetics for Benzene in Methane at High Pressures and Cryogenic Temperatures (PaperID 4081)
Catherine Sampson*, Peter Metaxas, Arman Siahvashi, Paul Stanwix, Brendan Graham, Michael Johns and Eric May
8:05 PM   Evaluating the Hydrate Anti-Agglomerant Characteristics of Butyl Glycol Ether (BGE) (PaperID 4558)
Nasir Khan*, Zachary Aman, Asheesh Kumar, Eric May and Michael Johns
8:25 PM   Session Panel: Q&A (PaperID 4763)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Properties for Materials Science at High Temperatures 4
Chair: Masahito Watanabe
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Density, Surface Tension and Viscosity of Cu2S and FeS Melts Measured by Levitation Techniques (PaperID 4579) (Invited)
Masayoshi Adachi*, Ryoya Masaoka, Makoto Ohtsuka, Masahito Watanabe, Jun-ichi Takahashi and Hiroyuki Fukuyama
7:45 PM   Thermophysical Property Measurements of Pd Melt Using EML with a Static Magnetic Field (PaperID 4520)
Manabu Watanabe*, Masayoshi Adachi and Hiroyuki Fukuyama
8:05 PM   Uncertainty Assessment of Thermal Conductivity Measurement at High Temperatures Using Guarded Hot Plate Apparatus (PaperID 4202)
Inseok Yang*, Daeho Kim and Sanghyun Lee
8:25 PM   Surface Oscillation of Viscous Droplet Under Microgravity and on Ground (PaperID 4565)
Masahito Watanabe, Satsuki Shimizu*, Seijiro Taguchi and Hiromichi Hasome
8:45 PM   Session Panel: Q&A (PaperID 4754)
Session Chair & Speakers*

21st Symposium
Thursday, June 24, 2021
Thermal Properties of Nanostructured Materials 3 - Interface and Film Thermal Transport
Chair: Xinwei Wang
Evening       7:00 PM – 9:00 PM       Room: Virtual

7:05 PM   Interfacial Thermal Conductance between Monolayer WSe2 and SiO2 under Consideration of Radiative Electron-hole Recombination (PaperID 4099)
Nicholas Hunter* and Xinwei Wang
7:25 PM   Experimental and Computational Investigation of Layer Dependent Thermal Conductivities and Interfacial Thermal Conductance of 1- to 3-Layer WSe2 (PaperID 4256)
Annie Xian Zhang*
7:45 PM   Toward Intrinsic Thermal Conductance of Epitaxial Al/Si Interfaces (PaperID 4528)
Houfu Song*, Bo Sun and Feiyu Kang
8:05 PM   Anomaly Thermal Resistance Reduction on Mo/Amorphous-HfO2/Mo Three-Layer Thin Film (PaperID 4570)
Yuichiro Yamashita*
8:25 PM   Session Panel: Q&A (PaperID 4777)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Non-equilibrium Thermodynamics 9 - Transport in Confined Fluids and at the Nanoscale
Chair: David Reguera and Fernando Bresme
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Soret Effects in Porous Media (PaperID 4122)
Bjørn Hafskjold*, Signe Kjelstrup, Olav Galteland and Dick Bedeaux
6:55 AM   Coupled Fluid Transport Through Vapor-Gap Membranes for Use in Cleaning Contaminated Liquids (PaperID 4072)
Michael Rauter*, Bjørn Hafskjold, Sondre Kvalvåg Schnell and Signe Kjelstrup
7:15 AM   Water/Brine Films Govern Fluid Transport in Aromatic-Filled Nanopores (PaperID 4247)
Anh Phan* and Alberto Striolo
7:35 AM   Transport Coefficients of a Rarefied Gas in a Hydrophobic Nanopore (PaperID 4135)
Kim Kristiansen* and Signe Kjelstrup
7:55 AM   Session Panel: Q&A (PaperID 4744)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Properties for Fuels and Energy Systems 5 - Carbon Dioxide
Chair: Bernd Rathke and Sergio E. Quiñones-Cisneros
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Solubility of H2S and Co2 in Bitumen and Cracked Products (PaperID 4200) (Invited)
Dhiraj Lal, Alan E. Mather and Kurt A.G. Schmidt*
7:15 AM   Molecular Insights into the Behavior of Aqueous Amine Solutions for CO2 capture in the Presence of Degraded Amine By-Products (PaperID 4586)
Daniel Bahamon*, Cristina G. Martinez, Ismail I.I. Alkhatib, Fèlix Llovell and Lourdes F. Vega
7:35 AM   Rapid Screening of Solvents for Post-Combustion CO2 Capture Processes (PaperID 4583)
Omar Khalifa*, Ismail I. I. Alkhatib, Daniel Bahamon, Ahmed Alhajaj, Mohammad RM Abu-Zahra and Lourdes F. Vega
7:55 AM   Liquid-Liquid Phase Behavior of Diesel/Biofuel Blends:Ternary Mixtures of n-Hexadecane, 2,2,4,4,6,6,8-Heptamethylnonane and Ethanol and the Binary Subsystems (PaperID 4597)
Anna Ballhause, Sabine Wagenfeld, Johannes Kiefer, Wolffram Schröer and Bernd Rathke*
8:15 AM   Session Panel: Q&A (PaperID 4761)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Properties of Working Fluids including Refrigerants 3
Chair: Aaron Rowane
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Molecular Modelling and Simulation Studies for Various HFO and HCFO Compounds and Their Mixtures (PaperID 4138)
Gabriele Raabe*
6:55 AM   Thermophysical Assessment of Low-GWP Refrigerant Blends in Vapor Compression Refrigeration Cycles by Means of the Polar Soft-SAFT EoS (PaperID 4580)
Carlos Albà*, Ismail Alkhatib, Fèlix Llovell and Lourdes F. Vega
7:15 AM   Azeotropic Fluorocarbon Refrigerant Mixture Separations using Porous Material (PaperID 4238)
Andrew Yancey*, Mark B. Shiflett, David Corbin, Sophia Terrian and Benjamin Shaw
7:35 AM   Session Panel: Q&A (PaperID 4768)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Thermal Properties of Nanostructured Materials 4 - Thermal Transport in Nanocomposites and Nanofluids
Chair: Yangsu Xie
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Multi-Scale Modeling of Thermophysical Properties of Phase-Change Nanocomposites for Energy Applications (PaperID 4144)
Alessandro Ribezzo*, Luca Bergamasco, Matteo Fasano and Eliodoro Chiavazzo
6:55 AM   Effective Thermal Conductivity of Nanofluids: Measurement and Prediction (PaperID 4179)
Francisco Bioucas*, Michael Rausch, Jochen Schmidt, Andreas Bück, Thomas Manfred Koller and Andreas Paul Fröba
7:15 AM   Hydrogen Bonding Enhanced Thermally Conductive Carbon Nano Grease (PaperID 4272)
Haiping Hong*
7:35 AM   Thermal Conductance between Water and nm-thick WS2: Extremely Localized Probing Using Nanosecond Energy Transport State-Resolved Raman (PaperID 4140)
Hamidreza Zobeiri*
7:55 AM   Session Panel: Q&A (PaperID 4779)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Wetting, Interfaces, and Membranes 7 - Hydrates- Thermodynamics
Chair: Jose Delgado and Ahmad Majid
Morning 0       6:30 AM – 8:30 AM       Room: Virtual

6:35 AM   Experimental Study and Thermodynamic Modeling of Xenon Clathrate Hydrate Equilibria (PaperID 4218) (Invited)
Ali Rasoolzadeh*, Louwrens Aaldijk, Sona Raeissi, Alireza Shariati, Muhammad Naveed Khan and Cornelis J Peters
7:15 AM   Hydrate Based Desalination: Thermodynamic and Kinetic Perspective (PaperID 4214)
Muhammad Naveed Khan*, Hao Qin, Sheraz Bashir, Cornelis J Peters and Carolyn Koh*
7:35 AM   Experimental Study and Thermodynamic Modeling of CCl4 + O2 and CCl4 + N2 Hydrate Equilibria (PaperID 4217)
Ali Rasoolzadeh*, Geert H. Lameris Lameris, Sona Raeissi, Alireza Shariati, Muhammad Naveed Khan and Cornelis Peters
7:55 AM   Analysis of Hydrate Agglomeration with Particle-Scale Models (PaperID 4271)
Anne Schide*, Daniel Croce, David Wu and Carolyn Koh
8:15 AM   Session Panel: Q&A (PaperID 4786)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Properties of Solids 3
Chair: Andreas Mandelis
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Directions of Zero Thermal Expansion in HfTiO4 (PaperID 4539) (Invited)
Scott J. McCormack*, Ben. S. Hulbert, William. A. Wheeler and Waltraud. M. Kriven
9:15 AM   Bayesian Uncertainty Analysis to Estimate Thermal Properties of Walls from Indirect Measurements (PaperID 4146)
Séverine Demeyer*, Julien Waeytens, Véronique Le Sant, Alain Koenen, Nicolas Fischer and Rémi Bouchié
9:35 AM   Session Panel: Q&A (PaperID 4764)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Theory of Thermophysical Properties 3
Chair: Fèlix Llovell and Amparo Galindo
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Molecular Dipole Moments: Critical Evaluation of Predictive Capabilities and Available Experimental Data (PaperID 4293)
Andrei Kazakov* and Eugene Paulechka
8:55 AM   Review and Comparison of Equations of State for the Lennard-Jones Fluid (PaperID 4496)
Simon Stephan*, Jens Staubach, Ulrich K. Deiters and Hans Hasse
9:15 AM   Fluctuation Solution Theory Correlation Function Integrals for Strongly Nonideal Multiphase Systems (PaperID 4523)
Jens Abildskov, John P. O'Connell and Jan Rotrekl*
9:35 AM   Liquid-Vapor Phase Equilibrium of a Simple Liquid Confined in a Random Porous Media: Second-Order Barker-Henderson Perturbation Theory and Scaled Particle Theory (PaperID 4697)
A.K. Nelson*, Y.V. Kalyuzhnyi, T. Patsahan and C. McCabe
9:55 AM   Session Panel: Q&A (PaperID 4774)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Thermal Properties of Nanostructured Materials 5 - Nanoscale Thermal Transport: Between Structure and Properties
Chair: Annie Xian Zhang
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Thermal reffusivity: Uncovering Relation between Energy Carrier Scattering and Structure (PaperID 4688) (Invited)
Xinwei Wang*
9:15 AM   Phonon Mean Free Path Distribution of Bi2Te3: a Comparison Between Thermal Measurements of Thin Films and First-Principles Calculations (PaperID 4563)
Xiaowei Lu, Sien Wang*, Ankit Negi, Hezhu Shao, Peng Jiang, Jun Liu and Qing Hao
9:35 AM   Understanding Thermal Transport from Nanostructured Sources Using Extreme Ultraviolet Measurements, Hydrodynamic Models, and Atomistic Simulations (PaperID 4658)
Joshua L. Knobloch*, Brendan McBennett, Albert Beardo, Hossein Honarvar, Travis Frazer, Lluc Sendra, Javier Bafaluy, Henry Kapteyn, Jorge Hernandez-Charpak, Weilun Chao, Begona Abad, Mahmoud Hussein, F. Xavier Alvarez, Juan Camacho and Margaret Murnane
9:55 AM   Nondestructive Measurements of Thermal Transport and Elastic Properties in Nanostructured Metalattices (PaperID 4659)
Brendan McBennett*, Joshua Knobloch, Begoña Abad, Travis Frazer, Weinan Chen, Hiu Cheng, Alex Grede, Nabila Nova, Jorge Hernández-Charpak, Pratibha Mahale, Thomas Mallouk, Noel Giebink, Venkatraman Gopalan, Ismaila Dabo, Vincent Crespi, Andrew Tomaschke, Virginia Ferguson, John Badding and Henry Kapteyn
10:15 AM   Session Panel: Q&A (PaperID 4775)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Wetting, Interfaces, and Membranes 8 - Copolymers and DFT
Chair: Marcus Mueller
Morning 1       8:30 AM – 10:30 AM       Room: Virtual

8:35 AM   Stimuli Response and Solute Partitioning in Highly Branched Copolymers from Density Functional Theory (PaperID 4667) (Invited)
Yuchong Zhang, Shun Xi, Jinxin Lu and Walter Chapman*
9:15 AM   A New Non-Local Classical DFT Formulation for Confined Mie Fluids (PaperID 4544)
Thomas Bernet*
9:35 AM   Promoting Gas Hydrate Formation for Improved Gas Storage Over HKUST-1 (PaperID 4298)
Shurraya Denning*, Ahmad Majid, Jolie Lucero, James Crawford, Moises Carreon and Carolyn Koh
9:55 AM   Session Panel: Q&A (PaperID 4782)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Properties of Solids 4
Chair: Aimen E. Gheribi
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Project SAVE: Silica Adsorption Vaccine Encapsulation (PaperID 4281)
Nicole Montoya*
10:55 AM   CALPHAD Modeling of the Molar Volume (PaperID 4254)
Ursula Kattner*
11:15 AM   Quantitative Lock-in Thermography Imaging of Thermal Diffusivity of Non-Flat Solid Structures (PaperID 4636)
Andreas Mandelis*, Alexander Melnikov, Mingfeng Wang and Chinhua Wang
11:35 AM   Non-Destructive and Non-Contacting Stress-Strain Characterization of Aerospace Metallic Alloys and Nanocoatings Using Photo-Thermo-Mechanical Radiometry (PTMR) Thermophysical Property Measurements (PaperID 4642)
Huiting Huan*, Alexander Melnikov and Andreas Mandelis
11:55 AM   Session Panel: Q&A (PaperID 4767)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Properties of Working Fluids including Refrigerants 4
Chair: Stephanie Outcalt
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Compressed Liquid, Superheated Vapor and Two-Phase Pvtx Measurements for Carbon Dioxide (R744) + Difluoromethane (R32) + 1,1,1,2-Tetrafluoroethane (R134a) Mixture (PaperID 4187)
Laura Fedele*, Giovanni Di Nicola, Davide Menegazzo, Sebastiano Tomassetti, Patrizio Parrabbi, Filippo Capodoglio and Sergio Bobbo
10:55 AM   Phase Equilibria Measurements of Pentafluoroethane and Difluoromethane in Ionic Liquids (PaperID 4260)
Kalin R. Baca*, Greta M. Olsen, Lucia Matamoros Valenciano, Madelyn G. Bennett and Mark B. Shiflett
11:15 AM   Liquid and Vapor Density Measurements of Refrigerant Blends Containing Hydrofluoroolefins from T = (230 to 400) K with Pressures to 20 MPa (PaperID 4499)
Tara Fortin* and Mark McLinden
11:35 AM   Session Panel: Q&A (PaperID 4769)
Session Chair & Speakers*

21st Symposium
Friday, June 25, 2021
Thermal Properties of Nanostructured Materials 6 - Nanoscale Thermal Transport: Phonon Behavior
Chair: Haiping Hong
Morning 2       10:30 AM – 12:30 PM       Room: Virtual

10:35 AM   Engineering Phonon Transport at Multiple Scales: Phonon Coherence and Localization (PaperID 4689) (Invited)
Yan Wang*
11:15 AM   Hot Carrier Transfer and Phonon Transport in Suspended nm WS2 Films (PaperID 4139)
Hamidreza Zobeiri*
11:35 AM   Optimal Geometric Parameters to Maximize or Minimize Phonon Boundary Scattering in Periodic Coaxial Cylindrical Nanowires (PaperID 4559)
Yingru Song and Geoff Wehmeyer*
11:55 AM   Thermal Analysis of Thin Films with Atomic Force Microscopy-based Local Anodic Oxidation (PaperID 4561)
Qiyu Chen*, Sien Wang and Qing Hao
12:15 PM   Session Panel: Q&A (PaperID 4776)
Session Chair & Speakers*

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