Computer Simulation of Asphaltenes


Citar

Texto integral

Acesso aberto Acesso aberto
Acesso é fechado Acesso está concedido
Acesso é fechado Somente assinantes

Resumo

The review describes theoretical approaches based on computer simulations at various levels of details (from quantum chemical calculations to atomistic and coarse-grained models) to study asphaltenes and systems containing asphaltenes. The used methods are described, their advantages and disadvantages are discussed in terms of computational costs and time- and spatial-scales available for simulations. The results of studies of the asphaltenes interactions with each other and their aggregation behavior in low-molecular solvents are presented. The most promising approaches of computer simulations of asphaltenes-based systems are determined.

Sobre autores

S. Lyulin

Institute of Macromolecular Compounds, Russian Academy of Sciences

Autor responsável pela correspondência
Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

A. Glova

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

S. Falkovich

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

V. Ivanov

Lomonosov Moscow State University

Email: s.v.lyulin@gmail.com
Rússia, Moscow

V. Nazarychev

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

A. Lyulin

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

S. Larin

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

S. Antonov

Topchiev Institute of Petrochemical Synthesis, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, Moscow

P. Ganan

Universidad Pontificia Bolivariana

Email: s.v.lyulin@gmail.com
Colômbia, Medellín

J. Kenny

Institute of Macromolecular Compounds, Russian Academy of Sciences

Email: s.v.lyulin@gmail.com
Rússia, St. Petersburg

Arquivos suplementares

Arquivos suplementares
Ação
1. JATS XML

Declaração de direitos autorais © Pleiades Publishing, Ltd., 2018