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

Matthias Vandichel UGent, Frederik Vermoortele, Stijn Cottenie UGent, Dirk De Vos, Michel Waroquier UGent and Veronique Van Speybroeck UGent (2012) ICAMM 2012 & VASP workshop, Abstracts. p.122-123
Please use this url to cite or link to this publication:
author
organization
year
type
conference
publication status
published
subject
keyword
citronellal cyclization, selectivity prediction, periodic DFT-D
in
ICAMM 2012 & VASP workshop, Abstracts
pages
122 - 123
conference name
ICAMM 2012 & VASP Workshop
conference location
Nantes, France
conference start
2012-06-11
conference end
2012-06-16
language
English
UGent publication?
yes
classification
C3
copyright statement
I have retained and own the full copyright for this publication
id
2951778
handle
http://hdl.handle.net/1854/LU-2951778
date created
2012-07-03 09:51:47
date last changed
2012-07-06 09:42:42
@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},
}

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.