Articles | Volume 35, issue 1
https://doi.org/10.5194/ejm-35-105-2023
https://doi.org/10.5194/ejm-35-105-2023
Research article
 | 
16 Feb 2023
Research article |  | 16 Feb 2023

Effect of Fe–Fe interactions and X-site vacancy ordering on the OH-stretching spectrum of foitite

Etienne Balan, Guillaume Radtke, Chloé Fourdrin, Lorenzo Paulatto, Heinrich A. Horn, and Yves Fuchs

Viewed

Total article views: 4,448 (including HTML, PDF, and XML)
HTML PDF XML Total Supplement BibTeX EndNote
4,338 100 10 4,448 35 6 6
  • HTML: 4,338
  • PDF: 100
  • XML: 10
  • Total: 4,448
  • Supplement: 35
  • BibTeX: 6
  • EndNote: 6
Views and downloads (calculated since 16 Feb 2023)
Cumulative views and downloads (calculated since 16 Feb 2023)

Viewed (geographical distribution)

Total article views: 4,441 (including HTML, PDF, and XML) Thereof 4,441 with geography defined and 0 with unknown origin.
Country # Views %
  • 1
1
 
 
 
 

Cited

Latest update: 28 Mar 2024
Download

The requested paper has a corresponding corrigendum published. Please read the corrigendum first before downloading the article.

Short summary
Assignment of OH-stretching bands to specific atomic-scale environments in tourmaline is still debated, which motivates detailed theoretical studies of their vibrational properties. We have theoretically investigated the OH-stretching spectrum of foitite, showing that specific OH bands observed in the vibrational spectra of iron-rich and Na-deficient tourmalines are affected by the magnetic configuration of iron ions and X-site vacancy ordering.