Comparative evaluation for catalytic gasification of petroleum coke and asphaltene in subcritical and supercritical water

2019 ◽  
Vol 31 ◽  
pp. 107-118 ◽  
Author(s):  
Rachita Rana ◽  
Sonil Nanda ◽  
Aimee Maclennan ◽  
Yongfeng Hu ◽  
Janusz A. Kozinski ◽  
...  
2017 ◽  
Vol 140 (4) ◽  
Author(s):  
Hui Jin ◽  
Bin Chen ◽  
Xiao Zhao ◽  
Changqing Cao

Supercritical water gasification (SCWG) is an efficient and clean conversion of biomass due to the unique chemical and physical properties. Anthracene and furfural are the key intermediates in SCWG, and their microscopic reaction mechanism in supercritical water may provide information for reactor optimization and selection of optimal operating condition. Density functional theory (DFT) and reactive empirical force fields (ReaxFF) were combined to investigate the molecular dynamics of catalytic gasification of anthracene and furfural. The simulation results showed that Cu and Ni obviously increased the production of H radicals, therefore the substance SCWG process. Ni catalyst decreased the production of H2 with the residence time of 500 ps while significantly increased CO production and finally increased the syngas production. Ni catalyst was proved to decrease the free carbon production to prohibit the carbon deposition on the surface of active sites; meanwhile, Cu catalyst increased the production of free carbon.


2020 ◽  
Vol 93 (5) ◽  
pp. 2025-2032 ◽  
Author(s):  
Rachita Rana ◽  
Sonil Nanda ◽  
Sivamohan N. Reddy ◽  
Ajay K. Dalai ◽  
Janusz A. Kozinski ◽  
...  

2018 ◽  
Vol 6 (5) ◽  
pp. 448-459 ◽  
Author(s):  
Sonil Nanda ◽  
Sivamohan N. Reddy ◽  
Dai-Viet N. Vo ◽  
Bichitra N. Sahoo ◽  
Janusz A. Kozinski

2018 ◽  
Vol 32 (8) ◽  
pp. 8115-8120 ◽  
Author(s):  
Renjie Zou ◽  
Liang Cao ◽  
Guangqian Luo ◽  
Zehua Li ◽  
Ruize Sun ◽  
...  

Fuel ◽  
2014 ◽  
Vol 118 ◽  
pp. 416-425 ◽  
Author(s):  
Ning Ding ◽  
Ramin Azargohar ◽  
Ajay K. Dalai ◽  
Janusz A. Kozinski

2004 ◽  
Vol 18 (2) ◽  
pp. 327-333 ◽  
Author(s):  
Mitsumasa Osada ◽  
Takafumi Sato ◽  
Masaru Watanabe ◽  
Tadafumi Adschiri ◽  
Kunio Arai

2017 ◽  
Vol 7 (4) ◽  
pp. 415-424 ◽  
Author(s):  
Nikolaos Boukis ◽  
Elena Hauer ◽  
Sophia Herbig ◽  
Jörg Sauer ◽  
Frédéric Vogel

2009 ◽  
Vol 34 (13) ◽  
pp. 5357-5364 ◽  
Author(s):  
Donghai Xu ◽  
Shuzhong Wang ◽  
Xin Hu ◽  
Chongming Chen ◽  
Qingming Zhang ◽  
...  

2009 ◽  
Vol 2 (5) ◽  
pp. 535 ◽  
Author(s):  
Samuel Stucki ◽  
Frédéric Vogel ◽  
Christian Ludwig ◽  
Anca G. Haiduc ◽  
Martin Brandenberger

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