Mechanism of asphaltene aggregation induced by supercritical CO2: insights from molecular dynamics simulation

Revealing the Intermolecular Interactions of Asphaltene Dimers by Quantum Chemical Calculations

(2017) Huanjiang Wang et al.   ENERGY & FUELS

Enhanced oil recovery mechanism of CO 2 water-alternating-gas injection in silica nanochannel

(2017) Youguo Yan et al.   FUEL

CHARMM force field parameters for 2′-hydroxybiphenyl-2-sulfinate, 2-hydroxybiphenyl, and related analogs

(2017) Yue Yu et al.   JOURNAL OF MOLECULAR GRAPHICS & MODELLING

Novel Dispersant for Formation Damage Prevention in CO2: A Molecular Dynamics Study

(2016) Evan Lowry et al.   ENERGY & FUELS

The influence of asphaltene-resin molecular interactions on the colloidal stability of crude oil

(2016) Masoumeh Mousavi et al.   FUEL

Supercritical CO 2 selective extraction inducing wettability alteration of oil reservoir

(2016) Timing Fang et al.   JOURNAL OF SUPERCRITICAL FLUIDS

Group-type characterization of crude oil and bitumen. Part I: Enhanced separation and quantification of saturates, aromatics, resins and asphaltenes (SARA)

(2016) K.K. (Adry) Bissada et al.   ORGANIC GEOCHEMISTRY

Molecular Dynamics Simulation of Self-Aggregation of Asphaltenes at an Oil/Water Interface: Formation and Destruction of the Asphaltene Protective Film

(2015) Juan Liu et al.   ENERGY & FUELS

Visual investigation and modeling of asphaltene precipitation and deposition during CO2 miscible injection into oil reservoirs

(2015) Peyman Zanganeh et al.   FUEL

An overview of heavy oil properties and its recovery and transportation methods

(2014) R. G. Santos et al.   BRAZILIAN JOURNAL OF CHEMICAL ENGINEERING

Experimental Study of Asphaltene Precipitation Behavior During Miscible Carbon Dioxide Injection

(2014) A. Alizadeh et al.   Energy Sources Part A-Recovery Utilization and Environmental Effects

Investigation of asphaltene adsorption in sandstone core sample during CO2 injection: Experimental and modified modeling

(2014) T. Jafari Behbahani et al.   FUEL

Opportunities for Using Anthropogenic CO2 for Enhanced Oil Recovery and CO2 Storage

(2013) Michael L. Godec et al.   ENERGY & FUELS

Modeling asphaltene precipitation and flow behavior in the processes of CO2 flood for enhanced oil recovery

(2013) Binshan Ju et al.   JOURNAL OF PETROLEUM SCIENCE AND ENGINEERING

Effect of Asphaltene Structure on Association and Aggregation Using Molecular Dynamics

(2013) Mohammad Sedghi et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Supercritical extraction of crude oil by methanol- and ethanol-modified carbon dioxide

(2013) Svetlana Rudyk et al.   JOURNAL OF SUPERCRITICAL FLUIDS

Modeling Asphaltene Aggregation with a Single Compound

(2012) Bianca Breure et al.   ENERGY & FUELS

Advances in Asphaltene Science and the Yen–Mullins Model

(2012) Oliver C. Mullins et al.   ENERGY & FUELS

Asphaltene Deposition during CO2 Injection and Pressure Depletion: A Visual Study

(2011) Peyman Zanganeh et al.   ENERGY & FUELS

SwissParam: A fast force field generation tool for small organic molecules

(2011) Vincent Zoete et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Molecular Characterization of Sulfur Compounds in Venezuela Crude Oil and Its SARA Fractions by Electrospray Ionization Fourier Transform Ion Cyclotron Resonance Mass Spectrometry

(2010) Peng Liu et al.   ENERGY & FUELS

Molecular Structures of Asphaltenes Based on the Dissociation Reactions of Their Ions in Mass Spectrometry

(2010) David Borton et al.   ENERGY & FUELS

Molecular Dynamics Simulations of Asphaltene Aggregation in Supercritical Carbon Dioxide with and without Limonene†

(2010) Thomas F. Headen et al.   ENERGY & FUELS

Implementation of the CHARMM Force Field in GROMACS: Analysis of Protein Stability Effects from Correction Maps, Virtual Interaction Sites, and Water Models

(2010) Pär Bjelkmar et al.   Journal of Chemical Theory and Computation

g_wham—A Free Weighted Histogram Analysis Implementation Including Robust Error and Autocorrelation Estimates

(2010) Jochen S. Hub et al.   Journal of Chemical Theory and Computation

Evidence for Asphaltene Nanoaggregation in Toluene and Heptane from Molecular Dynamics Simulations†

(2009) Thomas F. Headen et al.   ENERGY & FUELS

Role of Resins on Asphaltene Stability†

(2009) Mohammad Sedghi et al.   ENERGY & FUELS

Characterization of asphaltenes precipitated with three light alkanes under different experimental conditions

(2009) Peng Luo et al.   FLUID PHASE EQUILIBRIA

Comparative Study of CO2and N2Foams in Porous Media at Low and High Pressure−Temperatures

(2009) Rouhi Farajzadeh et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

PACKMOL: A package for building initial configurations for molecular dynamics simulations

(2009) L. Martínez et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Molecular Thermodynamic Approach to the Formation of Mixed Asphaltene−Resin Aggregates

(2008) E. Rogel   ENERGY & FUELS

Contrasting Perspective on Asphaltene Molecular Weight. This Comment vs the Overview of A. A. Herod, K. D. Bartle, and R. Kandiyoti

(2008) Oliver C. Mullins et al.   ENERGY & FUELS

GROMACS 4:  Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

(2008) Berk Hess et al.   Journal of Chemical Theory and Computation

Modeling Study of CO2-Induced Asphaltene Precipitation†

(2007) Doris L. Gonzalez et al.   ENERGY & FUELS