A priori modeling of chemical reactions on computational grid platforms: Workflows and data models

Chemical Physics

Volumn 398, Issue 1, 2012, Pages 192-198

  Rampino, S ^a   Monari, A ^b   Rossi, E ^c   Evangelisti, S ^d   Lagana A ^a  

^a UNIVERSITY OF PERUGIA   (Italy)

^b NANCY UNIVERSITÉ   (France)

^c CINECA   (Italy)

^d UNIVERSITÉ PAUL SABATIER   (France)

Author keywords

Atom diatom reactions; Chemistry data models; Scientific workflows; Thermal rate coefficients

Indexed keywords

EID: 84860884339     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2011.04.028     Document Type: Article

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