Crystalline Behavior of Paraffin Wax

Simulation of Crystallization of Pentacene and Its Derivatives from Solution

(2021) Makoto Yoneya   Journal of Physical Chemistry C

Molecular Dynamics Simulation of Waxy Crude Oil Multiphase System Depositing and Sticking on Pipeline Inner Walls and the Micro Influence Mechanism of Surface Physical–Chemical Characteristics

(2021) Yifan Gan et al.   ENERGY & FUELS

Does Confinement Enable Methane Hydrate Growth at Low Pressures? Insights from Molecular Dynamics Simulations

(2020) Kai Bin Yu et al.   Journal of Physical Chemistry C

Why Are Some Crystals Straight?

(2020) Chao Li et al.   Journal of Physical Chemistry C

Transport Properties of Waxy Crude Oil: A Molecular Dynamics Simulation Study

(2020) Xuejiao Chen et al.   ACS Omega

Amorphous-to-Crystalline Transition during Sintering of Nascent TiO2 Nanoparticles in Gas-Phase Synthesis: A Molecular Dynamics Study

(2020) Yihua Ren et al.   Journal of Physical Chemistry C

Fluid-solid phase transition of n-alkane mixtures: Coarse-grained molecular dynamics simulations and diffusion-ordered spectroscopy nuclear magnetic resonance

(2019) S. Shahruddin et al.   Scientific Reports

Molecular Dynamics Simulation of the Nucleation and Gelation Process for a Waxy Crude Oil Multiphase System under Different Physical–Chemical Influencing Factors

(2019) Yifan Gan et al.   ENERGY & FUELS

Molecular Dynamics Simulation of Pure n-Alkanes and Their Mixtures at Elevated Temperatures Using Atomistic and Coarse-Grained Force Fields

(2019) Konstantinos D. Papavasileiou et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Molecular dynamics simulation of the microscopic mechanisms of the dissolution, diffusion and aggregation processes for waxy crystals in crude oil mixtures

(2019) Yifan Gan et al.   JOURNAL OF PETROLEUM SCIENCE AND ENGINEERING

Fundamental Study of Wax Deposition in Crude Oil Flows in a Pipeline via Interface-Resolved Numerical Simulations

(2019) Mirco Magnini et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Characterization of the wax precipitation in Iranian crude oil based on wax appearance temperature (WAT): The influence of ultrasonic waves

(2019) Jaber Taheri-Shakib et al.   JOURNAL OF MOLECULAR STRUCTURE

Characterization of the wax precipitation in Iranian crude oil based on Wax Appearance Temperature (WAT): Part 1. The influence of electromagnetic waves

(2018) Jaber Taheri-Shakib et al.   JOURNAL OF PETROLEUM SCIENCE AND ENGINEERING

Molecular dynamics simulations of the crystallization process of n-alkane mixtures and the resulting thermal conductivity

(2018) Yi Zeng et al.   ENERGY & FUELS

Local structure order assisted two-step crystal nucleation in polyethylene

(2017) Xiaoliang Tang et al.   PHYSICAL REVIEW MATERIALS

Crystal structures of eight mono-methyl alkanes (C26–C32)viasingle-crystal and powder diffraction and DFT-D optimization

(2015) Lee Brooks et al.   IUCrJ

Wax formation in oil pipelines: A critical review

(2011) Ararimeh Aiyejina et al.   INTERNATIONAL JOURNAL OF MULTIPHASE FLOW

Solving paraffin deposition problem in tubing by heating cable application

(2010) Dusan Danilovic et al.   Thermal Science

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

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

CHARMM general force field: A force field for drug-like molecules compatible with the CHARMM all-atom additive biological force fields

(2009) K. Vanommeslaeghe et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

(2009) Alexander Stukowski   MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING