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First principle-based simulation of ethane steam cracking

Maarten Sabbe (UGent) , Kevin Van Geem (UGent) , Marie-Françoise Reyniers (UGent) and Guy Marin (UGent)
(2011) AICHE JOURNAL. 57(2). p.482-496
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Keywords
group additivity, ab initio, radical chemistry, reactor simulation, steam cracking, TRANSITION-STATE THEORY, BETA-SCISSION REACTIONS, HYDROGEN ABSTRACTION REACTIONS, CENTERED RADICAL-ADDITION, REACTION-RATE PREDICTION, SET MODEL CHEMISTRY, THERMAL-CRACKING, ACTIVATION-ENERGIES, GAS-PHASE, HYDROCARBON RADICALS

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Citation

Please use this url to cite or link to this publication:

Chicago
Sabbe, Maarten, Kevin Van Geem, Marie-Françoise Reyniers, and Guy Marin. 2011. “First Principle-based Simulation of Ethane Steam Cracking.” Aiche Journal 57 (2): 482–496.
APA
Sabbe, Maarten, Van Geem, K., Reyniers, M.-F., & Marin, G. (2011). First principle-based simulation of ethane steam cracking. AICHE JOURNAL, 57(2), 482–496.
Vancouver
1.
Sabbe M, Van Geem K, Reyniers M-F, Marin G. First principle-based simulation of ethane steam cracking. AICHE JOURNAL. 2011;57(2):482–96.
MLA
Sabbe, Maarten, Kevin Van Geem, Marie-Françoise Reyniers, et al. “First Principle-based Simulation of Ethane Steam Cracking.” AICHE JOURNAL 57.2 (2011): 482–496. Print.
@article{1139714,
  author       = {Sabbe, Maarten and Van Geem, Kevin and Reyniers, Marie-Fran\c{c}oise and Marin, Guy},
  issn         = {0001-1541},
  journal      = {AICHE JOURNAL},
  keyword      = {group additivity,ab initio,radical chemistry,reactor simulation,steam cracking,TRANSITION-STATE THEORY,BETA-SCISSION REACTIONS,HYDROGEN ABSTRACTION REACTIONS,CENTERED RADICAL-ADDITION,REACTION-RATE PREDICTION,SET MODEL CHEMISTRY,THERMAL-CRACKING,ACTIVATION-ENERGIES,GAS-PHASE,HYDROCARBON RADICALS},
  language     = {eng},
  number       = {2},
  pages        = {482--496},
  title        = {First principle-based simulation of ethane steam cracking},
  url          = {http://dx.doi.org/10.1002/aic.12269},
  volume       = {57},
  year         = {2011},
}

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