Leaderboards/Phase Equilibria and Thermodynamics

Phase Equilibria and Thermodynamics

Last updated July 7, 2026

Rising Stars

New and hot

Rising Stars Researchers

1
Qia Ke
Oregon State University
2
Ali Hussain Motagamwala
Shell (United States)
3
Francesco Sabatino
Eindhoven University of Technology
4
Ashish Gautam
Indian Institute of Technology BHU
5
Yadong Du
Beijing Institute of Technology
6
Stefano E. Zanco
ETH Zurich
7
Nabaparna Chakraborty
Lovely Professional University
8
Slyvester Yew Wang Chai
Jinan University
9
Chaitanya Dhoke
SINTEF
10
Mobin Safarzadeh Khosrowshahi
Universidad de Zaragoza

Rising Stars Papers

1
Recent progress on advanced solid adsorbents for CO2 capture: From mechanism to machine learning
Materials Today Sustainability|2024
53 cit.
2
Post-combustion CO2 absorption-desorption performance of novel aqueous binary amine blend of Hexamethylenediamine (HMDA) and 2-Dimethylaminoethanol (DMAE)
Energy|2024
19 cit.
3
Synergistic effect of adsorption-photocatalytic reduction of Cr(<scp>vi</scp>) in wastewater with biochar/TiO<sub>2</sub> composite under simulated sunlight illumination
Physical Chemistry Chemical Physics|2024
13 cit.
4
Utilization of accelerated weathering of limestone captured carbon dioxide (CO2) with cement kiln dust to produce building material
Journal of Cleaner Production|2024
12 cit.
5
Chemical looping combustion-driven cooling and power cogeneration system with LNG cold energy utilization: Exergoeconomic analysis and three-objective optimization
Energy|2024
11 cit.
6
Green synthesis of ZnS/MoS2-decorated porous carbon for photocatalytic degradation of tetracycline under visible light
Scientific Reports|2025
10 cit.
7
Techno-economic Optimization of the Combined Supercritical Carbon Dioxide and Air Brayton Cycles Driven by Copper-Based Chemical Looping Combustion
Energy & Fuels|2024
9 cit.
8
Thermodynamic and optimization analysis of a fuel cell-based combined cooling, heating, and power system integrated with LNG-fueled chemical looping hydrogen generation
Applied Thermal Engineering|2024
9 cit.
9
Understanding of lactobionic acid in aqueous-glycol mixtures at different temperatures: Ultrasonic investigation and spectroscopic study
Journal of Molecular Liquids|2024
7 cit.
10
Optimization of accelerated weathering of limestone for CO2 capture in cement industry
AIP conference proceedings|2024
5 cit.

Emerging Leaders

Gaining momentum

Emerging Leaders Researchers

1
Seyed Ali Sajadian
University of Kashan
2
Helei Liu
Ministry of Agriculture
3
Othonas A. Moultos
Delft University of Technology
4
Arun Kumar Narayanan Nair
King Abdullah University of Science and Technology
5
Todd R. Gingrich
Living Systems (United States)
6
Gholamhossein Sodeifian
University of Kashan
7
Li‐Chiang Lin
National Taiwan University
8
Roberta Campardelli
University of Genoa
9
Kuan Huang
JEOL (China)
10
Juan L. Aragones
Universidad Autónoma de Madrid

Emerging Leaders Papers

1
Solubility, Extraction, and Nanoparticles Production in Supercritical Carbon Dioxide: A Mini‐Review
ChemBioEng Reviews|2022
95 cit.
2
An overview on the corrosion mechanisms and inhibition techniques for amine-based post-combustion carbon capture process
Separation and Purification Technology|2022
93 cit.
3
Interfacial Tensions, Solubilities, and Transport Properties of the H<sub>2</sub>/H<sub>2</sub>O/NaCl System: A Molecular Simulation Study
Journal of Chemical & Engineering Data|2023
86 cit.
4
Experimental study of ketoconazole impregnation into polyvinyl pyrrolidone and hydroxyl propyl methyl cellulose using supercritical carbon dioxide: Process optimization
The Journal of Supercritical Fluids|2022
66 cit.
5
<scp>AI</scp> models for correlation of physical properties in system of <scp>1DMA2P‐CO<sub>2</sub>‐H<sub>2</sub>O</scp>
AIChE Journal|2022
65 cit.
6
Remarkable <scp>NH<sub>3</sub></scp> absorption in <scp>metal‐based</scp> deep eutectic solvents by multiple coordination and <scp>hydrogen‐bond</scp> interaction
AIChE Journal|2022
61 cit.
7
CO2 utilization for determining solubility of teriflunomide (immunomodulatory agent) in supercritical carbon dioxide: Experimental investigation and thermodynamic modeling
Journal of CO2 Utilization|2022
60 cit.
8
Solubility of favipiravir (as an anti-COVID-19) in supercritical carbon dioxide: An experimental analysis and thermodynamic modeling
The Journal of Supercritical Fluids|2022
59 cit.
9
A New Force Field for OH<sup>–</sup> for Computing Thermodynamic and Transport Properties of H<sub>2</sub> and O<sub>2</sub> in Aqueous NaOH and KOH Solutions
The Journal of Physical Chemistry B|2022
58 cit.
10
Synthesis of cyclic polystyrene in supercritical carbon dioxide green solvent
The Journal of Supercritical Fluids|2022
54 cit.

Current Senior Leaders

Established & currently active

Current Senior Leaders Researchers

1
Michael L. Klein
Temple College
2
John M. Prausnitz
University of California, Berkeley
3
Lee G. Pedersen
University of North Carolina at Chapel Hill
4
Keith E. Gubbins
North Carolina State University
5
J. Ilja Siepmann
University of Minnesota System
6
Wolfgang Wagner
Vrije Universiteit Amsterdam
7
Gabriele Sadowski
TU Dortmund University
8
Daan Frenkel
University of Cambridge
9
W. A. Wakeham
University of Southampton
10
Pablo G. Debenedetti
Princeton University

Current Senior Leaders Papers

1
Comparison of simple potential functions for simulating liquid water
The Journal of Chemical Physics|1983
42.1k cit.
2
Particle mesh Ewald: An <i>N</i>⋅log(<i>N</i>) method for Ewald sums in large systems
The Journal of Chemical Physics|1993
30.7k cit.
3
A smooth particle mesh Ewald method
The Journal of Chemical Physics|1995
22.9k cit.
4
Local compositions in thermodynamic excess functions for liquid mixtures
AIChE Journal|1968
6.7k cit.
5
Constant pressure molecular dynamics algorithms
The Journal of Chemical Physics|1994
5.9k cit.
6
Understanding Molecular Simulation
Computers in Physics|1997
5.5k cit.
7
<i>Understanding Molecular Simulation: From Algorithms to Applications</i>
Physics Today|1997
5.1k cit.
8
A New Equation of State for Carbon Dioxide Covering the Fluid Region from the Triple-Point Temperature to 1100 K at Pressures up to 800 MPa
Journal of Physical and Chemical Reference Data|1996
4.9k cit.
9
Statistical thermodynamics of liquid mixtures: A new expression for the excess Gibbs energy of partly or completely miscible systems
AIChE Journal|1975
4.6k cit.
10
Supercooled liquids and the glass transition
Nature|2001
4.6k cit.

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