CCL: Last days of DFT poll
- From: "Marcel Swart"
<marcel.swart===icrea.cat>
- Subject: CCL: Last days of DFT poll
- Date: Wed, 28 Sep 2016 09:36:07 -0400
Sent to CCL by: "Marcel Swart" [marcel.swart : icrea.cat]
The 2016 edition of the Annual DFT Popularity Poll will end soon (October 1!!).
Your preferences for the poll can be entered at www.marcelswart.eu/dft-poll
or directly at www.surveymoz.com/s/dft-poll2016.
This year's edition continues with the new format of having three questions.
With the third question participants can indicate for each functional on the
list
(both Primera and Segona Divisi 2016),
what is their preference for a total of 11 properties (see also Rule #8):
Reaction barriers
Vibrational frequencies, Normal modes, Thermodynamics
Dispersion energy, - stacking
Hydrogen bonds
Excitation energies and chiroptical properties
Main group elements
Transition metals
Relativistic elements
NMR shieldings, NMR couplings
Geometries
Spin-state splittings
For each of these properties one can choose between the following five
preferences:
++ Love it ; + Like it ; 0 Neutral ; - Dislike it ; -- Hate it
(only for the third question)
New in this years edition is that (if wanted) one can save the (partial)
answers,
and then continue later. This has been added to enable one to respond to the
third
question in all time that is needed.
As usual the poll ends on October 1, after which a news item will be published
with the 2016 results, and the full results will be made available through
www.marcelswart.eu/dft-poll (just as was done for the 2015 edition).
Best regards,
Marcel Swart
Matthias Bickelhaupt
Miquel Duran