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Selectivity prediction: making the comparison between extended cluster and periodic calculations

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citronellal cyclization, selectivity prediction, periodic DFT-D

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Chicago
Vandichel, Matthias, Frederik Vermoortele, Stijn Cottenie, Dirk De Vos, Michel Waroquier, and Veronique Van Speybroeck. 2012. “Selectivity Prediction: Making the Comparison Between Extended Cluster and Periodic Calculations.” In ICAMM 2012 & VASP Workshop, Abstracts, 122–123.
APA
Vandichel, M., Vermoortele, F., Cottenie, S., De Vos, D., Waroquier, M., & Van Speybroeck, V. (2012). Selectivity prediction: making the comparison between extended cluster and periodic calculations. ICAMM 2012 & VASP workshop, Abstracts (pp. 122–123). Presented at the ICAMM 2012 & VASP Workshop.
Vancouver
1.
Vandichel M, Vermoortele F, Cottenie S, De Vos D, Waroquier M, Van Speybroeck V. Selectivity prediction: making the comparison between extended cluster and periodic calculations. ICAMM 2012 & VASP workshop, Abstracts. 2012. p. 122–3.
MLA
Vandichel, Matthias, Frederik Vermoortele, Stijn Cottenie, et al. “Selectivity Prediction: Making the Comparison Between Extended Cluster and Periodic Calculations.” ICAMM 2012 & VASP Workshop, Abstracts. 2012. 122–123. Print.
@inproceedings{2951778,
  author       = {Vandichel, Matthias and Vermoortele, Frederik and Cottenie, Stijn and De Vos, Dirk and Waroquier, Michel and Van Speybroeck, Veronique},
  booktitle    = {ICAMM 2012 \& VASP workshop, Abstracts},
  keyword      = {citronellal cyclization,selectivity prediction,periodic DFT-D},
  language     = {eng},
  location     = {Nantes, France},
  pages        = {122--123},
  title        = {Selectivity prediction: making the comparison between extended cluster and periodic calculations},
  year         = {2012},
}