A ReaxFF molecular dynamics study on the mechanism and the typical pyrolysis gases in the pyrolysis process of Longkou oil shale kerogen-Reference-Cited by-同舟云学术

A ReaxFF molecular dynamics study on the mechanism and the typical pyrolysis gases in the pyrolysis process of Longkou oil shale kerogen

Published:2020-08-26 Issue:15 Volume:46 Page:1191-1199
ISSN:0892-7022
Container-title:Molecular Simulation
language:en
Short-container-title:Molecular Simulation

Author:

Zhang Zhijun¹²^ORCID,Guo Liting¹,Zhang Hanyu³

Affiliation:

1. National Engineering Research Center of Coal Preparation and Purification, China University of Mining and Technology, Xuzhou, People’s Republic of China

2. School of Chemical and Environmental Engineering, China University of Mining and Technology, Beijing, People’s Republic of China

3. Department of Chemical and Materials Engineering, University of Alberta, Edmonton, Canada

Funder

National Natural Science Foundation of China

Beijing Municipal Natural Science Foundation

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemical Engineering,Modelling and Simulation,Information Systems,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/08927022.2020.1809658

Reference33 articles.

1. Oil from shale as a viable replacement of depleted crude reserves: processes and challenges

2. Evaluation of Structural Characteristics of Huadian Oil Shale Kerogen Using Direct Techniques (Solid-State 13C NMR, XPS, FT-IR, and XRD)

3. Predicting oil and gas compositional yields via chemical structure–chemical yield modeling (CS-CYM): Part 1 – Concepts and implementation

4. Source rock characteristics of the Lower Cretaceous Abu Gabra Formation in the Muglad Basin, Sudan, and its relevance to oil generation studies

5. Organic geochemical characteristics and depositional setting of Paleogene oil shale, mudstone and sandstone from onshore Penyu Basin, Chenor, Pahang, Malaysia

Cited by 10 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Experimental and reactive molecular dynamics simulation of municipal sludge extract pyrolysis;Journal of the Energy Institute;2024-06

2. Effect of methanol on the pyrolysis behaviour of kerogen by ReaxFF molecular dynamics simulations;Molecular Simulation;2023-10-26

3. Decomposition and reaction characteristics of C6F12O/N2 with rubber materials based on ReaxFF;Materials Today Communications;2023-08

4. The mechanism of H2O in the superheated steam affecting the quality of in-situ pyrolysates of oil shale kerogen: Part B-favorable conversion of residues;Fuel;2023-04

5. The non-isothermal thermal decomposition evolution of the Fushun oil shale kerogen based on ReaxFF molecular dynamics simulation;Journal of Analytical and Applied Pyrolysis;2023-01