English (United Kingdom)

https://curated-unify.zendy.io/wp-json/zendy-region/v1/featured_content/oa?rat=en

https://curated-unify.zendy.io/wp-json/zendy-region/v1/highlighted_journal/

Global: Zendy Tools annual

Presents the keyphrase highlighting as premium feature

Keyphrase Highlighting

Presents the summarisation as premium feature

Summarisation

Insights

Presents the pdf analysis as premium feature

PDF Analysis

Presents the zaia usage as premium feature

ZAIA

Global: Zendy Tools monthly

Global: Zendy Plus monthly

Presents the access of premium content as premium feature

Premium Content

Global: Zendy Plus annual

Global: Zendy Free Plan

Some models were developed for the interpretation of infrared intensities based on the distribution of molecular charge and its mobility during atomic displacement. The objective of this paper is to apply NPA charges in the C-CF-O model to obtain the dipole moment derivatives and infrared intensities of AH 3 , X 2 CY and some linear molecules. In all cases analyzed, the NC-NCF-O model was more accurate than the reference model Charge – Charge Flux – Dipole Flux (C–CF–DF). Furthermore, the computational cost of obtaining NPA charges and their respective flux are much lower than those obtained by more complex models. This allows a greater application for large molecules.

The Natural Charge – Natural Charge Flux – Overlap model: a modification of the charge-charge flux-overlap model through NPA charges