Search for reaction pathways with P-graphs and reaction blocks: methanation of carbon dioxide with hydrogen

DOI10.1007/s10910-017-0844-7zbMath1390.92172OpenAlexW2770539745MaRDI QIDQ2636415

Ignacio E. Grossmann, Jenny Miranda-Pérez, Felipe A. Díaz-Alvarado

Publication date: 5 June 2018

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-017-0844-7

zbMATH Keywords

hydrogencarbon dioxideP-graphmethanationreaction pathways

Mathematics Subject Classification ID

Classical flows, reactions, etc. in chemistry (92E20) Paths and cycles (05C38)

Uses Software

• Octave
• expa

Cites Work

• Combinatorial Classification of Chemical Mechanisms
• Process network synthesis: Problem definition
• Multiple Equilibria in Complex Chemical Reaction Networks: II. The Species-Reaction Graph
• A new general algorithmic method in reaction syntheses using linear algebra

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