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Extending conceptual DFT to include external variables: the influence of magnetic fields

descriptionPublicationkeyboard_double_arrow_right Article , Other literature type 01 Jan 2022 Belgium, Norway English Publisher:Royal Society of Chemistry (RSC)Journal:Chemical Science, volume 13, pages 5,311-5,324 (issn: 2041-6520, eissn: 2041-6539, Copyright policy )Funded by:EC | topDFT, UKRI | Bridging the gap between ...
Authors: Robin Francotte; Tom J. P. Irons; Andrew M. Teale; Frank de Proft; Paul Geerlings;

doi: 10.1039/d1sc07263c

pmid: 35655570

pmc: PMC9093152

handle: 10852/100874

Extending conceptual DFT to include external variables: the influence of magnetic fields

Abstract

An extension of conceptual DFT to include the influence of an external magnetic field is proposed in the context of a program set up to cope with the ever increasing variability of reaction conditions and concomitant reactivity.

Countries
Belgium, Norway
Related Organizations
Keywords

Chemistry, 500, General Chemistry

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    This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
    		 13
    popularity
    This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
    		 Top 10%
    influence
    This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
    		 Average
    impulse
    This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
    		 Top 10%
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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
13
Top 10%
Average
Top 10%
Green
gold
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