Zhehui Jin, PhD

Assistant Professor, Petroleum Engineering, Faculty of Engineering - Civil and Environmental Engineering Dept

Pronouns: he, him, his

Contact

Assistant Professor, Petroleum Engineering, Faculty of Engineering - Civil and Environmental Engineering Dept
Email
zhehui2@ualberta.ca
Phone
(780) 492-6633
Address
6-304 Donadeo Innovation Centre For Engineering
9211-116 St
EdmontonAB
T6G 2H5

Overview

Area of Study / Keywords

Oil/Gas Energy Storage Chemical Additives "Smart" Materials Environment


About

Education

  • PhD, Chemical Engineering, University of California at Riverside, U.S.A., 2012
  • BSc, Materials Science and Engineering, Tsinghua University, China, 2007

Professional Experience

  • 09/16-present, Assistant Professor, School of Mining and Petroleum Engineering, Department of Civil and Environmental Engineering, University of Alberta, Edmonton, Alberta, Canada
  • 05/12-08/16, Researcher, Reservoir Engineering Research Institute, Palo Alto, California, U.S.A.
  • 09/07-05/12, Research Assistant, University of California at Riverside, Riverside, California, U.S.A.

Awards

  • Early Career Awards, 2016, 2017
  • 2022 Energy and Fuels Rising Stars, 2021
  • Faculty of Engineering Early-Career Research Award, 2022



Research

Research Interests

Current research focuses on the application of quantum mechanics, statistical thermodynamics, molecular modeling and simulations to the development of water treatment materials, unconventional and low-carbon energy, as well as energy storage systems through interdisciplinary studies. The active research areas include phase behavior and flow of fluids in nanoporous media, enhanced/improved oil recovery, interfacial phenomena, carbon capture, utilization and storage, catalysis, batteries, membranes, wettability, water treatment, etc.

Active Research Areas:

  • Gas/Liquid Phase Behavior and Flow under Nanoconfinement
  • Chemical Additives (Surfactant/Cosurfactant) for EOR and Drilling as well as Fracturing Fluids
  • Wastewater Treatment: (Micro) Pollutant Removal by Adsorption
  • CO2 Storage and Utilization
  • CO2-Responsive "Smart" Materials: Surfactant/Polymer
  • Liquid Electrolyte and Interface Designs for Batteries

Publications

Revealing the role of mo doping in promoting oxygen reduction reaction performance of Pt3Co nanowires

Author(s): Zhiping Deng, Wanying Pang, Mingxing Gong, Zhehui Jin, Xiaolei Wang
Publication Date: 3/1/2022
Publication: Journal of Energy Chemistry
Volume: 66
Page Numbers: 16-23
External Link: https://www.sciencedirect.com/science/article/pii/S2095495621003697

Mechanisms for Kerogen Wettability Transition from Water-Wet to CO2-Wet: Implications for CO2 Sequestration

Author(s): Juan Zhou, Jiajun Zhang, Jiapei Yang, Zhehui Jin, Kaihong Luo
Publication Date: 1/15/2022
Publication: Chemical Engineering Journal
Volume: 428
Page Numbers: 132020
DOI: 10.1016/j.cej.2021.132020
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894721035993?via%3Dihub

Molecular Simulation Study of Oil-Water Two-Phase Fluid Transport in Shale Inorganic Nanopores

Author(s): Wei Zhang, Qihong Feng, Zhehui Jin, Xiangdong Xing, Sen Wang
Publication Date: 12/14/2021
Publication: Chemical Engineering Science
Volume: 245
Page Numbers: 116948
External Link: https://www.sciencedirect.com/science/article/pii/S0009250921005133?via%3Dihub

Ion Valency and Concentration Effect on the Structural and Thermodynamic Properties of Brine-Oil Interfaces with Anionic Surfactant (SDS)

Author(s): Yiling Nan, Wenhui Li, Zhehui Jin
Publication Date: 8/17/2021
Publication: Journal of Physical Chemistry B
Volume: 125
Issue: 33
Page Numbers: 9610–9620
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.jpcb.1c04187

Ethanol Blending to Improve Reverse-Micelle Dispersity in Supercritical CO2: A Molecular Dynamics Study

Author(s): Yiling Nan, Wenhui Li, Mingshan Zhang, Zhehui Jin
Publication Date: 8/12/2021
Publication: Journal of Physical Chemistry B
Volume: 125
Issue: 33
Page Numbers: 9621–9628
DOI: 10.1021/acs.jpcb.1c04869
External Link: https://pubs.acs.org/doi/10.1021/acs.jpcb.1c04869

Simple and Robust Algorithm for Multiphase Equilibrium Computations at Temperature and Volume Specifications

Author(s): Lingfei Xu, Chang Lu, Huazhou Li, Zhehui Jin
Publication Date: 8/11/2021
Publication: SPE Journal
Volume: 26
Issue: 4
Page Numbers: 2397-2416
External Link: https://onepetro.org/SJ/article-abstract/26/04/2397/463581/Simple-and-Robust-Algorithm-for-Multiphase

Structural Properties of Deprotonated Naphthenic Acids Immersed in Water in Pristine and Hydroxylated Carbon Nanopores from Molecular Perspectives

Author(s): Mingshan Zhang, Wenhui Li, Zhehui Jin
Publication Date: 8/5/2021
Publication: Journal of Hazardous Materials
Volume: 415
Page Numbers: 125660
External Link: https://www.sciencedirect.com/science/article/pii/S0304389421006245?via%3Dihub

Highly Efficient and Accurate Gas-Alkane Binary Mixture Interfacial Tension Equations for a Broad Range of Temperatures, Pressures, and Compositions

Author(s): Yingnan Wang, Nadia Shardt, Janet Elliott, Zhehui Jin
Publication Date: 7/30/2021
Publication: SPE Journal

Hydrocarbon Mixture and CO2 Adsorptions in A Nanopore-Bulk Multiscale System in Relation to CO2 Enhanced Shale Gas Recovery

Author(s): Yingnan Wang, Zhehui Jin
Publication Date: 7/1/2021
Publication: Chemical Engineering Journal
Volume: 415
Page Numbers: 128398
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894720345101

CO2 Solubility in Brine in Silica Nanopores in Relation to Geological CO2 Sequestration in Tight Formations: Effect of Salinity and pH

Author(s): Wenhui Li, Yiling Nan, Qing You, Zhehui Jin
Publication Date: 5/1/2021
Publication: Chemical Engineering Journal
Volume: 411
Page Numbers: 127626
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894720337487

Hydrocarbon Mixture Phase Behavior in Multi-Scale Systems in Relation to Shale Oil Recovery: The Effect of Heterogeneous Pore Size Distributions

Author(s): Yinuo Zhao, Zhehui Jin
Publication Date: 5/1/2021
Publication: Fuel
Volume: 291
Page Numbers: 120141
External Link: https://www.sciencedirect.com/science/article/abs/pii/S001623612100017X

Comprehensive Review about Methane Adsorption in Shale Nanoporous Media

Author(s): Wanying Pang, Yingnan Wang, Zhehui Jin
Publication Date: 4/30/2021
Publication: Energy & Fuels
Volume: 35
Issue: 10
Page Numbers: 8456-8493
External Link: https://pubs.acs.org/doi/pdf/10.1021/acs.energyfuels.1c00357

Electrolyte Structure Regulation for Stablizing Polysulfide Intermediates in Practical Lithium-Sulfur Batteries

Author(s): Xueqiang Zhang, Qi Jin, Yiling Nan, Lipeng Hou, Boquan Li, Xiang Chen, Zhehui Jin, Xitian Zhang, Jiaqi Huang, Qiang Zhang
Publication Date: 4/29/2021
Publication: Angewandte Chemie International Edition
Volume: 60
Page Numbers: 2-9
External Link: https://onlinelibrary.wiley.com/doi/10.1002/anie.202103470

CO2-regulated octane flow in calcite nanopores from molecular perspectives

Author(s): Wei Zhang, Qihong Feng, Sen Wang, Xiangdong Xing, Zhehui Jin
Publication Date: 2/15/2021
Publication: Fuel
Volume: 286
Page Numbers: 119299
External Link: https://www.sciencedirect.com/science/article/abs/pii/S001623612032295X

Surface Tension as A Function of Temperature and Composition for A Broad Range of Mixtures

Author(s): Nadia Shardt, Yingnan Wang, Zhehui Jin, Janet Elliot
Publication Date: 2/2/2021
Publication: Chemical Engineering Science
Volume: 230
Page Numbers: 116095
External Link: https://www.sciencedirect.com/science/article/pii/S0009250920306278

Molecular dynamic study on structural and dynamic properties of water, counter-ions and polyethylene glycols in Na-montmorillonite interlayers

Author(s): Mingshan Zhang, Hui Mao, Zhehui Jin
Publication Date: 1/15/2021
Publication: Applied Surface Science
Volume: 536
Page Numbers: 147700
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0169433220324570

Molecular Dynamics Study on CO2 Storage in Water-Filled Kerogen Nanopores in Shale Reservoirs: Effects of Kerogen Maturity and Pore Size

Author(s): Wenhui Li, Mingshan Zhang, Yiling Nan, Wanying Pang, Zhehui Jin
Publication Date: 1/12/2021
Publication: Langmuir
Volume: 37
Issue: 1
Page Numbers: 542-552
External Link: https://pubs.acs.org/doi/full/10.1021/acs.langmuir.0c03232

Validity of the Kelvin Equation and the Equation-of-State-with-Capillary-Pressure Model for the Phase Behavior of a Pure Component under Nanoconfinement

Author(s): Yingnan Wang, Nadia Shardt, Chang Lu, Huazhou Li, Janet Elliot, Zhehui Jin
Publication Date: 11/23/2020
Publication: Chemical Engineering Science
Volume: 226
Page Numbers: 115839
External Link: https://www.sciencedirect.com/science/article/pii/S0009250920303717

The Role of Brine in Gas Adsorption and Dissolution in Kerogen Nanopores for Enhanced Gas Recovery and CO2 Sequestration

Author(s): Juan Zhou, Zhehui Jin, Kaihong Luo
Publication Date: 11/1/2020
Publication: Chemical Engineering Journal
Volume: 399
Page Numbers: 125704
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894720318325

Hydrophilicity/Hydrophobicity Driven CO2 Solubility in Kaolinite Nanopores in Relation to Carbon Sequestration

Author(s): Wenhui Li, Yiling Nan, Zilin Zhang, Qing You, Zhehui Jin
Publication Date: 10/15/2020
Publication: Chemical Engineering Journal
Volume: 398
Page Numbers: 125449
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894720314418

Determination of Hildebrand Solubility Parameter for Pure Hydrocarbons by Incorporating Temperature-Dependent Volume Translation into Peng-Robinson Equation of State

Author(s): Chang Lu, Zhehui Jin, Huazhou Li
Publication Date: 10/1/2020
Publication: Journal of Supercritical Fluids
Volume: 164
Page Numbers: 104945
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0896844620301960

Methane Absolute Adsorption in Kerogen Nanoporous Media With Realistic Continuous Pore Size Distributions

Author(s): Wanying Pang, Zhehui Jin
Publication Date: 9/18/2020
Publication: Energy & Fuels
Volume: 34
Issue: 10
Page Numbers: 12158-12172
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.energyfuels.0c01886

Study of Liquid-Liquid Two-Phase Flow in Hydrophilic Nanochannels by Molecular Simulaitons and Theoretical Modeling

Author(s): Shiyuan Zhan, Yuliang Su, Zhehui Jin, Mingshan Zhang, Wendong Wang, Yongmao Hao, Lei Li
Publication Date: 9/1/2020
Publication: Chemical Engineering Journal
Volume: 395
Page Numbers: 125053
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894720310457

Molecular Insight into the Boundary Conditions of Water Flow in Clay Nanopores

Author(s): Shiyuan Zhan, Yuliang Su, Zhehui Jin, Wendong Wang, Mingyu Cai, Lei Li, Yongmao Hao
Publication Date: 8/1/2020
Publication: Journal of Molecular Liquids
Volume: 311
Page Numbers: 113292
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0167732220305377

The origin of sulfuryl-containing components in SEI from sulfate additive for stable cycling of ultrathin lithium metal anodes

Author(s): Jin-Xiu Chen, Xue-Qiang Zhang, Bo-Quan Li, Xin-Meng Wang, Peng Shi, Wancheng Zhu, Aibing Chen, Zhehui Jin, Rong Xiang, Jia-Qi Huang, Qiang Zhang
Publication Date: 8/1/2020
Publication: Journal of Energy Chemistry
Volume: 47
Page Numbers: 128-131
External Link: https://www.sciencedirect.com/science/article/abs/pii/S2095495619309167

Discontinuous Displacement at Solvent–Immobile Hydrocarbon Interfaces

Author(s): Haoxiang Wang, John Shaw, Zhehui Jin
Publication Date: 7/27/2020
Publication: Energy & Fuels
Volume: 34
Issue: 8
Page Numbers: 9392-9400
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.energyfuels.0c01222

Effects of salts and silica nanoparticles on oil-brine interfacial properties under hydrocarbon reservoir conditions: A molecular dynamics simulation study

Author(s): Wenhui Li, Yiling Nan, Qing You, Qichao Xie, Zhehui Jin
Publication Date: 5/1/2020
Publication: Journal of Molecular Liquids
Volume: 305
Page Numbers: 112860
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0167732219365584

Insights into recovery of multi-component shale gas by CO2 injection: A molecular perspective

Author(s): Juan Zhou, Zhehui Jin, Kaihong Luo
Publication Date: 5/1/2020
Publication: Fuel
Volume: 267
Page Numbers: 117247
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236120302428

Roles of Alcohol as a Cosurfactant at Brine-Oil Interface Under a Typical Reservoir Condition

Author(s): Yiling Nan, Wenhui Li, Zhehui Jin
Publication Date: 4/26/2020
Publication: Langmuir
Volume: 36
Issue: 19
Page Numbers: 5198-5207
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.0c00494

A Wetting Transition of Ionic Substrate by Modulating Surface Charge Distribution

Author(s): Peng Jiang, Hongguan Wu, Leying Qing, Xiaofei Xu, Zhehui Jin, Li Yang, Shuangliang Zhao
Publication Date: 3/11/2020
Publication: Langmuir
Volume: 36
Issue: 13
Page Numbers: 3667-3675
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b03933

A-site deficient perovskite with nano-socked Ni-Fe alloy particles as highly active and durable catalyst for high-temperature CO2 electrolysis

Author(s): Shaochen Ding, Meng Li, Wanying Pang, Bin Hua, Nanqi Duan, Ya-Qian Zhang, Sheng-Nian Zhang, Zhehui Jin, Jing-Li Luo
Publication Date: 3/1/2020
Publication: Electrochimica Acta
Volume: 335
Page Numbers: 135683
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0013468620300748

A Mixed Ether Electrolyte for Lithium Metal Anode Protection in Working Lithium–Sulfur Batteries

Author(s): Wei‐Jing Chen, Chang‐Xin Zhao, Bo‐Quan Li, Qi Jin, Xue‐Qiang Zhang, Tong‐Qi Yuan, Xitian Zhang, Zhehui Jin, Stefan Kaskel, Qiang Zhang
Publication Date: 2/24/2020
Publication: Energy & Environmental Materials
Volume: 3
Page Numbers: 160-165
External Link: https://onlinelibrary.wiley.com/doi/full/10.1002/eem2.12073

Effect of Water Film on Oil flow in Quartz Nanopores from Molecular Perspectives

Author(s): Shiyuan Zhan, Yuliang Su, Zhehui Jin, Wendong Wang, Lei Li
Publication Date: 2/15/2020
Publication: Fuel
Volume: 262
Page Numbers: 116560
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236119319143

Recovery Mechanisms of Hydrocarbon Mixtures in Organic and Inorganic Nanopores During Pressure Drawdown and CO2 Injection from Molecular Perspectives

Author(s): Mingshan Zhang, Shiyuan Zhan, Zhehui Jin
Publication Date: 2/15/2020
Publication: Chemical Engineering Journal
Volume: 382
Page Numbers: 122808
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1385894719322181

Dual interface layers for solid-state Li metal battery with low interfacial resistance and small polarization based on garnet electrolyte

Author(s): Linhui Chen, Zeya Huang, Wanying Pang, Zhehui Jin, Yutao Li, Chang-An Wang
Publication Date: 1/10/2020
Publication: Electrochimica Acta
Volume: 330
Page Numbers: 135352
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0013468619322248

Slip length of methane flow under shale reservoir conditions: Effect of pore size and pressure

Author(s): Yiling Nan, Wenhui Li, Zhehui Jin
Publication Date: 2020
Publication: Fuel
Volume: 259
Page Numbers: 116237
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236119315911

Hydrocarbon-Phase Behaviors in Shale Nanopore/Fracture Model: Multiscale, Multicomponent, and Multiphase

Author(s): Yinuo Zhao, Zhehui Jin
Publication Date: 12/1/2019
Publication: SPE Journal
Volume: 24
Issue: 6
Page Numbers: 2526-2540
External Link: https://www.onepetro.org/journal-paper/SPE-198908-PA

Effect of Ion Concentration and Multivalence on Methane-Brine Interfacial Tension and Phenomena from Molecular Perspectives

Author(s): Wenhui Li, Zhehui Jin
Publication Date: 10/15/2019
Publication: Fuel
Volume: 254
Page Numbers: 115657
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236119310099

Effect of pore size distribution on hydrocarbon mixtures adsorption in shale nanoporous media from engineering density functional theory

Author(s): Yingnan Wang, Zhehui Jin
Publication Date: 10/15/2019
Publication: Fuel
Volume: 254
Page Numbers: 115650
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236119310026

Effects of Salinity and N-, S-, and O-Bearing Polar Components on Light Oil-Brine Interfacial Properties from Molecular Perspectives

Author(s): Wenhui Li, Yiling Nan, Xianli Wen, Wendong Wang, Zhehui Jin
Publication Date: 8/29/2019
Publication: The Journal of Physical Chemistry C
Volume: 123
Issue: 38
Page Numbers: 23520-23528
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.jpcc.9b06600

Characterization of CO2/CH4 Competitive Adsorption in Various Clay Minerals in Relation to Shale Gas Recovery from Molecular Simulation

Author(s): Xiaofei Hu, Hucheng Deng, Chang Lu, Yuanyuan Tian, Zhehui Jin
Publication Date: 8/14/2019
Publication: Energy & Fuels
Volume: 33
Issue: 9
Page Numbers: 8202-8214
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.energyfuels.9b01610

Recent advances in understanding dendrite growth on alkali metal anodes

Author(s): He Liu, Xin-Bing Cheng, Zhehui Jin, Rui Zhang, Guoxiu Wang, Long-Qing Chen, Quan-Bing Liu, Jia-Qi Huang, Qiang Zhang
Publication Date: 7/1/2019
Publication: Energychem
Volume: 1
Issue: 1
Page Numbers: 100003
External Link: https://www.sciencedirect.com/science/article/abs/pii/S258977801930003X

A Dopamine Modified Li 6.4 La 3 Zr 1.4 Ta 0.6 O 12/PEO Solid-State Electrolyte: Enhanced Thermal and Electrochemical Properties

Author(s): Zeya Huang, Wanying Pang, Peng Liang, Zhehui Jin, Nicholas S Grundish, Yutao Li, Changan Wang
Publication Date: 6/18/2019
Publication: Journal of Materials Chemistry A
Volume: 7
Page Numbers: 16425-16436
External Link: https://pubs.rsc.org/--/content/articlelanding/2019/ta/c9ta03395e/unauth

Assessment of Various Approaches in the Prediction of Methane Absolute Adsorption in Kerogen Nanoporous Media

Author(s): Wanying Pang, Yinzhu Ye, Zhehui Jin
Publication Date: 6/17/2019
Publication: Energy & Fuels
Volume: 33
Issue: 7
Page Numbers: 6258-6263
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.energyfuels.9b01116

Effects of Moisture Contents on Shale Gas Recovery and CO2 Sequestration

Author(s): Juan Zhou, Zhehui Jin, Kai Hong Luo
Publication Date: 6/5/2019
Publication: Langmuir
Volume: 35
Issue: 26
Page Numbers: 8716-8725
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.9b00862

Tackling the challenges in the estimation of methane absolute adsorption in kerogen nanoporous media from molecular and analytical approaches

Author(s): Wanying Pang, Yanqing He, Changhui Yan, Zhehui Jin
Publication Date: 4/15/2019
Publication: Fuel
Volume: 242
Page Numbers: 687-698
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236119300602

A two-phase flash algorithm with the consideration of capillary pressure at specified mole numbers, volume and temperature

Author(s): Chang Lu, Zhehui Jin, Huazhou Andy Li
Publication Date: 4/15/2019
Publication: Fluid Phase Equilibria
Volume: 485
Page Numbers: 67-82
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0378381218304990

Smart mobility control agent for enhanced oil recovery during CO2 flooding in ultra-low permeability reservoirs

Author(s): Yan Zhang, Mingwei Gao, Qing You, Hongfu Fan, Wenhui Li, Yifei Liu, Jichao Fang, Guang Zhao, Zhehui Jin, Caili Dai
Publication Date: 4/1/2019
Publication: Fuel
Volume: 241
Page Numbers: 442-450
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236118321318

Molecular dynamics simulations of natural gas-water interfacial tensions over wide range of pressures

Author(s): Wenhui Li, Zhehui Jin
Publication Date: 1/15/2019
Publication: Fuel
Volume: 236
Page Numbers: 480-492
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236118315771

Revisiting Methane Absolute Adsorption in Organic Nanopores from Molecular Simulation and Ono-Kondo Lattice Model

Author(s): Wanying Pang, Zhehui Jin
Publication Date: 2019
Publication: Fuel
Volume: 235
Page Numbers: 339-349
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236118312973

Ono-Kondo lattice model for propane multilayer adsorption in organic nanopores in relation to shale gas

Author(s): Wanying Pang, Zhehui Jin
Publication Date: 2019
Publication: Fuel
Volume: 235
Page Numbers: 158-166
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236118312857

Activating p-Blocking Centers in Perovskite for Efficient Water Splitting

Author(s): Bin Hua, Meng Li, Wanying Pang, Weiqiang Tang, Shuangliang Zhao, Zhehui Jin, Yimin Zeng, Babak Shalchi Amirkhiz, Jing-Li Luo
Publication Date: 12/13/2018
Publication: Chem
Volume: 4
Issue: 12
Page Numbers: 2902-2916
External Link: https://www.sciencedirect.com/science/article/pii/S2451929418304327

Natural gas vaporization in a nanoscale throat connected model of shale: Multi-scale, Multi-component and Multi-phase

Author(s): Arnav Jatukaran, Junjie Zhong, Ali Abedini, Atena Sherbatian, Yinuo Zhao, Zhehui Jin, Farshid Mostowfi, David Sinton
Publication Date: 12/10/2018
Publication: Arnav Jatukaran, Junjie Zhong, Ali Abedini, Atena Sherbatian, Yinuo Zhao, Zhehui Jin, Farshid Mostowfi, David Sinton
Volume: 19
Page Numbers: 272-280
External Link: https://pubs.rsc.org/en/content/articlelanding/2018/lc/c8lc01053f/unauth#!divAbstract

Bubble Point Pressures of Hydrocarbon Mixtures in Multiscale Volumes from Density Functional Theory

Author(s): Yinuo Zhao, Yingnan Wang, Junjie Zhong, Yi Xu, David Sinton, Zhehui Jin
Publication Date: 10/23/2018
Publication: Langmuir
Volume: 34
Issue: 46
Page Numbers: 14058–14068
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.8b02789

Confinement Effect on Molecular Conformation of Alkanes in Water-filled Cavitands: A Combined Quantum/Classical DFT Study

Author(s): Xiaochen Yu, Weiqiang Tang, Teng Zhao, Zhehui Jin, Shuangliang Zhao, Honglai Liu
Publication Date: 10/11/2018
Publication: Langmuir
Volume: 34
Issue: 45
Page Numbers: 13491–13496
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.8b02209

Nanoscale Phase Measurement for the Shale Challenge: Multi-component Fluids in Multi-scale Volumes

Author(s): Junjie Zhong, Yinuo Zhao, Chang Lu, Yi Xu, Zhehui Jin, Farshid Mostowfi, David Sinton
Publication Date: 8/3/2018
Publication: Langmuir
Volume: 34
Issue: 34
Page Numbers: 9927-9935
External Link: https://pubs.acs.org/doi/abs/10.1021/acs.langmuir.8b01819

Determination of the absolute adsorption/desorption isotherms of CH4 and n-C4H10 on shale from a nano-scale perspective

Author(s): Yueliang Liu, Huazhou Andy Li, Yuanyuan Tian, Zhehui Jin, Hucheng Deng
Publication Date: 4/15/2018
Publication: Fuel
Volume: 218
Page Numbers: 67-77
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0016236118300127

Comparison of Peng-Robinson Equation of State With Capillary Pressure Model With Engineering Density-Functional Theory in Describing the Phase Behavior of Confined Hydrocarbons

Author(s): Yueliang Liu, Zhehui Jin, Huazhou Andy Li
Publication Date: 3/1/2018
Publication: SPE Journal
Volume: 23
Issue: 5
Page Numbers: 1784-1797
External Link: https://www.onepetro.org/journal-paper/SPE-187405-PA

Bubble/dew point and hysteresis of hydrocarbons in nanopores from molecular perspective

Author(s): Zhehui Jin
Publication Date: 2/25/2018
Publication: l Fluid Phase Equilibria
Volume: 458
Page Numbers: 177-185
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0378381217304600

Characterization of methane excess and absolute adsorption in various clay nanopores from molecular simulation

Author(s): Yuanyuan Tian, Changhui Yan, Zhehui Jin
Publication Date: 9/20/2017
Publication: Scientific reports
Volume: 7
Issue: 1
Page Numbers: 1-21
External Link: https://www.nature.com/articles/s41598-017-12123-x

Effect of nano-confinement on high pressure methane flow characteristics

Author(s): Zhehui Jin
Publication Date: 9/1/2017
Publication: Journal of Natural Gas Science and Engineering
Volume: 45
Page Numbers: 575-583
External Link: https://www.sciencedirect.com/science/article/abs/pii/S1875510017302536

Phase behavior and flow in shale nanopores from molecular simulations

Author(s): Zhehui Jin, Abbas Firoozabadi
Publication Date: 9/23/2016
Publication: Fluid Phase Equilibria
Volume: 430
Page Numbers: 156-168
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0378381216304460

Thermodynamic modeling of phase behavior in shale media

Author(s): Zhehui Jin, Abbas Firoozabadi
Publication Date: 2/1/2016
Publication: SPE Journal
Volume: 21
Issue: 1
Page Numbers: 190-207
External Link: https://www.onepetro.org/journal-paper/SPE-176015-PA?journal=SPE+Formation+Evaluation

Flow of methane in shale nanopores at low and high pressure by molecular dynamics simulations

Author(s): Zhehui Jin, Abbas Firoozabadi
Publication Date: 9/14/2015
Publication: The Journal of chemical physics
Volume: 143
Issue: 10
Page Numbers: 104315
External Link: https://aip.scitation.org/doi/abs/10.1063/1.4930006

Phase behavior and adsorption of pure substances and mixtures and characterization in nanopore structures by density functional theory

Author(s): Zhidong Li, Zhehui Jin, Abbas Firoozabadi
Publication Date: 12/1/2014
Publication: SPE Journal
Volume: 19
Issue: 6
Page Numbers: 1096-1109
External Link: https://www.onepetro.org/journal-paper/SPE-169819-PA

Effect of water on methane and carbon dioxide sorption in clay minerals by Monte Carlo simulations

Author(s): Zhehui Jin, Abbas Firoozabadi
Publication Date: 11/25/2014
Publication: Fluid Phase Equilibria
Volume: 382
Page Numbers: 10-20
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0378381214004282

Methane and carbon dioxide adsorption in clay-like slit pores by Monte Carlo simulations

Author(s): Zhehui Jin, Abbas Firoozabadi
Publication Date: 12/25/2013
Publication: Fluid Phase Equilibria
Volume: 360
Page Numbers: 456-465
External Link: https://www.sciencedirect.com/science/article/abs/pii/S0378381213005542

Application of density functional theory to study the double layer of an electrolyte with an explicit dimer model for the solvent

Author(s): Douglas Henderson, De-en Jiang, Zhehui Jin, Jianzhong Wu
Publication Date: 9/13/2012
Publication: The Journal of Physical Chemistry B
Volume: 116
Issue: 36
Page Numbers: 11356-11361
External Link: https://pubs.acs.org/doi/abs/10.1021/jp305400z

Density functional theory for encapsidated polyelectrolytes: A comparison with Monte Carlo simulation

Author(s): Zhehui Jin, Jianzhong Wu
Publication Date: 7/28/2012
Publication: The Journal of chemical physics
Volume: 137
Issue: 4
Page Numbers: 044905
External Link: https://aip.scitation.org/doi/abs/10.1063/1.4737931

Solvent effect on the pore-size dependence of an organic electrolyte supercapacitor

Author(s): De-en Jiang, Zhehui Jin, Douglas Henderson, Jianzhong Wu
Publication Date: 7/5/2012
Publication: The journal of physical chemistry letters
Volume: 3
Issue: 13
Page Numbers: 1727-1731
External Link: https://pubs.acs.org/doi/abs/10.1021/jz3004624

Shape effect on nanoparticle solvation: A comparison of morphometric thermodynamics and microscopic theories

Author(s): Zhehui Jin, Jehoon Kim, Jianzhong Wu
Publication Date: 5/1/2012
Publication: Langmuir
Volume: 28
Issue: 17
Page Numbers: 6997-7006
External Link: https://pubs.acs.org/doi/abs/10.1021/la2051178

Oscillation of capacitance inside nanopores

Author(s): De-en Jiang, Zhehui Jin, Jianzhong Wu
Publication Date: 12/14/2011
Publication: Nano letters
Volume: 11
Issue: 12
Page Numbers: 5373-5377
External Link: https://pubs.acs.org/doi/abs/10.1021/nl202952d

Density functional study of the electric double layer formed by a high density electrolyte

Author(s): Douglas Henderson, Stanisław Lamperski, Zhehui Jin, Jianzhong Wu
Publication Date: 11/10/2011
Publication: The journal of physical chemistry B
Volume: 115
Issue: 44
Page Numbers: 12911-12914
External Link: https://pubs.acs.org/doi/abs/10.1021/jp2078105

A classical density functional theory for interfacial layering of ionic liquids

Author(s): Jianzhong Wu, Tao Jiang, De-en Jiang, Zhehui Jin, Douglas Henderson
Publication Date: 10/14/2011
Publication: Soft Matter
Volume: 7
Issue: 23
Page Numbers: 11222-11231
External Link: https://pubs.rsc.org/lv/content/articlelanding/2011/sm/c1sm06089a/unauth#!divAbstract

New theoretical method for rapid prediction of solvation free energy in water

Author(s): Shuangliang Zhao, Zhehui Jin, Jianzhong Wu
Publication Date: 6/2/2011
Publication: The Journal of Physical Chemistry B
Volume: 115
Issue: 21
Page Numbers: 6971-6975
External Link: https://pubs.acs.org/doi/abs/10.1021/jp201949k

A perturbative density functional theory for square-well fluids

Author(s): Zhehui Jin, Yiping Tang, Jianzhong Wu
Publication Date: 5/7/2011
Publication: The Journal of chemical physics
Volume: 134
Issue: 17
Page Numbers: 174702
External Link: https://aip.scitation.org/doi/abs/10.1063/1.3585677

Hybrid MC− DFT method for studying multidimensional entropic forces

Author(s): Zhehui Jin, Jianzhong Wu
Publication Date: 2/17/2011
Publication: The Journal of Physical Chemistry B
Volume: 115
Issue: 6
Page Numbers: 1450-1460
External Link: https://pubs.acs.org/doi/abs/10.1021/jp110066z

Entropic forces of single-chain confinement in spherical cavities

Author(s): Zhehui Jin, Shuangliang Zhao, Jianzhong Wu
Publication Date: 10/22/2010
Publication: Physical Review E
Volume: 82
Issue: 4
Page Numbers: 041805
External Link: https://journals.aps.org/pre/abstract/10.1103/PhysRevE.82.041805